NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | position | program | type | subtype | subsubtype |
649594 | 6kg8 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | ambi |
# Restraints file 1: all.tbl assign (resid 38 and name HB2) (resid 124 and name HN) 3.65 1.85 1.85 ! 0.0000 0:10 Long 2.25, 4.07 A assign (resid 38 and name HB1) (resid 124 and name HN) 3.15 1.35 1.35 ! 0.9752 1:10 Long 1.94, 2.61 A assign (resid 123 and name HB1) (resid 124 and name HN) 3.15 1.35 1.35 ! 0.6070 2:10 Ambig 3.76, 4.10 A or (resid 39 and name HB*) (resid 124 and name HN) ! 0.3401 2:10 ----- 4.15, 5.00 A assign (resid 124 and name HB) (resid 124 and name HN) 2.30 0.50 0.50 ! 0.8927 3:10 Ambig 2.60, 2.73 A or (resid 124 and name HG12) (resid 124 and name HN) ! 0.1034 3:10 ----- 3.72, 4.01 A assign (resid 124 and name HD1*) (resid 124 and name HN) 3.15 1.35 1.35 ! 0.9410 4:10 Intra 2.36, 4.88 A assign (resid 48 and name HA) (resid 106 and name HN) 3.15 1.35 1.35 ! 0.0000 5:10 Long 2.66, 2.89 A assign (resid 50 and name HA) (resid 51 and name HN) 2.65 0.85 0.85 ! 0.0000 6:10 Seq 2.00, 2.08 A assign (resid 106 and name HB1) (resid 106 and name HN) 3.15 1.35 1.35 ! 0.9908 7:10 Intra 2.39, 2.77 A assign (resid 106 and name HB2) (resid 106 and name HN) 3.15 1.35 1.35 ! 0.9987 8:10 Intra 2.17, 2.24 A assign (resid 44 and name HB1) (resid 45 and name HN) 3.65 1.85 1.85 ! 0.9188 9:10 Ambig 3.60, 4.12 A or (resid 43 and name HB*) (resid 45 and name HN) ! 0.0812 9:10 ----- 5.39, 6.15 A assign (resid 44 and name HB2) (resid 45 and name HN) 3.65 1.85 1.85 ! 0.0000 10:10 Seq 4.28, 4.36 A assign (resid 50 and name HB) (resid 51 and name HN) 3.65 1.85 1.85 ! 0.0000 11:10 Seq 4.06, 4.15 A assign (resid 105 and name HB) (resid 106 and name HN) 3.65 1.85 1.85 ! 0.0000 12:10 Seq 4.10, 4.19 A assign (resid 76 and name HA1) (resid 45 and name HN) 3.65 1.85 1.85 ! 0.0000 13:10 Long 3.35, 3.95 A assign (resid 51 and name HB*) (resid 51 and name HN) 2.30 0.50 0.50 ! 0.5164 14:10 Ambig 2.16, 2.94 A or (resid 51 and name HD1) (resid 51 and name HN) ! 0.4817 14:10 ----- 2.19, 3.97 A assign (resid 109 and name HB*) (resid 106 and name HN) 2.65 0.85 0.85 ! 0.9982 15:10 Mid 2.40, 3.50 A assign (resid 45 and name HB*) (resid 45 and name HN) 2.30 0.50 0.50 ! 0.0000 16:10 Intra 2.46, 2.90 A assign (resid 104 and name HD1*) (resid 51 and name HN) 3.65 1.85 1.85 ! 0.4249 17:10 Ambig 5.30, 6.37 A or (resid 53 and name HG1*) (resid 51 and name HN) ! 0.3044 17:10 ----- 5.61, 6.42 A or (resid 101 and name HB*) (resid 51 and name HN) ! 0.1812 17:10 ----- 6.11, 6.95 A or (resid 78 and name HG2*) (resid 51 and name HN) ! 0.0895 17:10 ----- 6.87, 7.99 A assign (resid 50 and name HG2*) (resid 51 and name HN) 2.65 0.85 0.85 ! 0.9939 18:10 Seq 2.48, 3.38 A assign (resid 105 and name HG2*) (resid 106 and name HN) 2.30 0.50 0.50 ! 0.8677 19:10 Ambig 2.88, 3.62 A or (resid 47 and name HG2) (resid 106 and name HN) ! 0.1323 19:10 ----- 3.94, 4.34 A assign (resid 104 and name HG2*) (resid 106 and name HN) 3.15 1.35 1.35 ! 0.8788 20:10 Ambig 3.85, 5.30 A or (resid 105 and name HD1*) (resid 106 and name HN) ! 0.0831 20:10 ----- 5.70, 6.30 A assign (resid 77 and name HN) (resid 78 and name HN) 3.15 1.35 1.35 ! 0.0000 21:10 Seq 4.22, 4.35 A assign (resid 68 and name HA) (resid 69 and name HN) 2.65 0.85 0.85 ! 0.9921 22:10 Seq 2.21, 2.24 A assign (resid 81 and name HB) (resid 69 and name HN) 3.65 1.85 1.85 ! 0.0000 23:10 Long 3.89, 4.14 A assign (resid 111 and name HA) (resid 144 and name HN) 3.15 1.35 1.35 ! 0.5274 24:10 Ambig 4.08, 4.49 A or (resid 143 and name HB) (resid 144 and name HN) ! 0.4127 24:10 ----- 4.25, 4.35 A assign (resid 68 and name HB2) (resid 69 and name HN) 3.65 1.85 1.85 ! 0.0000 25:10 Seq 4.45, 4.51 A assign (resid 68 and name HB1) (resid 69 and name HN) 3.65 1.85 1.85 ! 0.0000 26:10 Seq 4.44, 4.47 A assign (resid 119 and name HB2) (resid 119 and name HN) 3.15 1.35 1.35 ! 0.0000 28:10 Intra 2.50, 2.63 A assign (resid 40 and name HB1) (resid 119 and name HN) 3.65 1.85 1.85 ! 0.9949 29:10 Long 2.97, 3.51 A assign (resid 78 and name HB) (resid 78 and name HN) 2.65 0.85 0.85 ! 0.9950 30:10 Intra 2.71, 2.80 A assign (resid 105 and name HB) (resid 105 and name HN) 2.65 0.85 0.85 ! 0.0000 31:10 Intra 2.50, 2.56 A assign (resid 105 and name HG1*) (resid 105 and name HN) 2.65 0.85 0.85 ! 0.0000 32:10 Intra 2.17, 2.84 A assign (resid 144 and name HB) (resid 144 and name HN) 2.65 0.85 0.85 ! 0.9045 33:10 Ambig 2.49, 2.55 A or (resid 113 and name HB1) (resid 144 and name HN) ! 0.0955 33:10 ----- 3.63, 5.20 A assign (resid 77 and name HB1) (resid 78 and name HN) 2.65 0.85 0.85 ! 0.9013 34:10 Ambig 2.29, 2.84 A or (resid 77 and name HB2) (resid 78 and name HN) ! 0.0656 34:10 ----- 3.55, 4.03 A assign (resid 77 and name HG1) (resid 78 and name HN) 3.65 1.85 1.85 ! 0.0000 35:10 Seq 4.31, 4.74 A assign (resid 104 and name HB) (resid 105 and name HN) 3.65 1.85 1.85 ! 0.0000 36:10 Seq 3.87, 4.12 A assign (resid 104 and name HG12) (resid 105 and name HN) 3.65 1.85 1.85 ! 0.0000 37:10 Seq 4.34, 4.59 A assign (resid 69 and name HB) (resid 69 and name HN) 2.65 0.85 0.85 ! 0.0000 38:10 Intra 2.61, 2.70 A assign (resid 69 and name HG12) (resid 69 and name HN) 3.65 1.85 1.85 ! 0.0000 39:10 Intra 4.37, 4.40 A assign (resid 115 and name HB*) (resid 115 and name HN) 2.30 0.50 0.50 ! 0.9896 40:10 Intra 2.41, 2.96 A assign (resid 141 and name HG1) (resid 115 and name HN) 3.15 1.35 1.35 ! 0.9676 41:10 Long 3.36, 3.81 A assign (resid 47 and name HD1) (resid 144 and name HN) 3.65 1.85 1.85 ! 0.5937 44:10 Ambig 4.40, 5.69 A or (resid 111 and name HB*) (resid 144 and name HN) ! 0.2355 44:10 ----- 5.14, 6.23 A or (resid 141 and name HG2) (resid 144 and name HN) ! 0.1708 44:10 ----- 5.42, 6.05 A assign (resid 6 and name HG1*) (resid 6 and name HN) 2.30 0.50 0.50 ! 0.5873 45:10 Ambig 1.94, 4.29 A or (resid 144 and name HG2*) (resid 144 and name HN) ! 0.3946 45:10 ----- 2.07, 3.11 A assign (resid 118 and name HB) (resid 119 and name HN) 3.15 1.35 1.35 ! 0.9792 46:10 Seq 3.89, 4.10 A assign (resid 120 and name HG*) (resid 119 and name HN) 4.15 2.35 2.35 ! 0.7375 48:10 Ambig 5.67, 6.37 A or (resid 120 and name HB1) (resid 119 and name HN) ! 0.2625 48:10 ----- 6.74, 7.04 A assign (resid 41 and name HG2*) (resid 78 and name HN) 2.65 0.85 0.85 ! 0.3171 49:10 Ambig 4.27, 5.22 A or (resid 78 and name HG2*) (resid 78 and name HN) ! 0.2450 49:10 ----- 4.45, 4.72 A or (resid 41 and name HD1*) (resid 78 and name HN) ! 0.2327 49:10 ----- 4.49, 5.64 A or (resid 41 and name HG11) (resid 78 and name HN) ! 0.2052 49:10 ----- 4.59, 5.14 A assign (resid 105 and name HG2*) (resid 105 and name HN) 3.15 1.35 1.35 ! 0.5155 50:10 Ambig 4.38, 4.56 A or (resid 20 and name HG2*) (resid 105 and name HN) ! 0.4845 50:10 ----- 4.42, 5.60 A assign (resid 104 and name HG2*) (resid 105 and name HN) 2.30 0.50 0.50 ! 0.7849 51:10 Ambig 2.64, 3.57 A or (resid 21 and name HG1*) (resid 105 and name HN) ! 0.1355 51:10 ----- 3.54, 4.86 A assign (resid 69 and name HG11) (resid 69 and name HN) 3.15 1.35 1.35 ! 0.7726 52:10 Ambig 3.58, 3.76 A or (resid 81 and name HG2*) (resid 69 and name HN) ! 0.1980 52:10 ----- 4.49, 5.69 A assign (resid 69 and name HD1*) (resid 69 and name HN) 2.30 0.50 0.50 ! 0.9111 53:10 Ambig 2.28, 3.28 A or (resid 70 and name HG2*) (resid 69 and name HN) ! 0.0686 53:10 ----- 3.50, 4.53 A assign (resid 80 and name HG2*) (resid 69 and name HN) 3.65 1.85 1.85 ! 0.0000 54:10 Long 4.27, 5.33 A assign (resid 142 and name HG2*) (resid 144 and name HN) 3.65 1.85 1.85 ! 0.0000 56:10 Mid 3.62, 4.91 A assign (resid 6 and name HG2*) (resid 6 and name HN) 3.15 1.35 1.35 ! 0.9063 57:10 Ambig 2.14, 3.46 A or (resid 5 and name HG2*) (resid 6 and name HN) ! 0.0765 57:10 ----- 3.23, 4.17 A assign (resid 118 and name HG1*) (resid 119 and name HN) 2.30 0.50 0.50 ! 0.8863 58:10 Ambig 2.56, 3.58 A or (resid 41 and name HG11) (resid 119 and name HN) ! 0.0462 58:10 ----- 4.19, 5.06 A assign (resid 79 and name HA) (resid 80 and name HN) 2.30 0.50 0.50 ! 0.0000 59:10 Seq 2.11, 2.17 A assign (resid 98 and name HA) (resid 98 and name HN) 3.65 1.85 1.85 ! 0.0000 61:10 Intra 2.88, 2.91 A assign (resid 6 and name HA) (resid 6 and name HN) 3.15 1.35 1.35 ! 0.9913 63:10 Intra 2.85, 2.90 A assign (resid 97 and name HA) (resid 98 and name HN) 2.65 0.85 0.85 ! 0.9975 64:10 Seq 2.11, 2.16 A assign (resid 49 and name HB) (resid 50 and name HN) 3.65 1.85 1.85 ! 0.9259 65:10 Seq 3.93, 4.24 A assign (resid 50 and name HA) (resid 50 and name HN) 2.65 0.85 0.85 ! 0.0000 66:10 Intra 2.82, 2.86 A assign (resid 147 and name HB*) (resid 148 and name HN) 3.15 1.35 1.35 ! 0.9549 67:10 Seq 2.06, 3.48 A assign (resid 82 and name HB2) (resid 82 and name HN) 2.65 0.85 0.85 ! 0.0000 68:10 Intra 2.58, 2.67 A assign (resid 82 and name HB1) (resid 82 and name HN) 3.15 1.35 1.35 ! 0.0000 69:10 Intra 3.72, 3.77 A assign (resid 100 and name HB*) (resid 23 and name HN) 3.15 1.35 1.35 ! 0.6422 72:10 Ambig 4.00, 5.09 A or (resid 103 and name HB2) (resid 23 and name HN) ! 0.1471 72:10 ----- 5.12, 5.42 A or (resid 22 and name HE2) (resid 23 and name HN) ! 0.1250 72:10 ----- 5.26, 5.96 A or (resid 22 and name HE1) (resid 23 and name HN) ! 0.0856 72:10 ----- 5.60, 6.37 A assign (resid 21 and name HB) (resid 23 and name HN) 4.15 2.35 2.35 ! 0.3963 73:10 Ambig 6.71, 6.87 A or (resid 24 and name HB2) (resid 23 and name HN) ! 0.3323 73:10 ----- 6.91, 7.05 A or (resid 53 and name HB) (resid 23 and name HN) ! 0.2713 73:10 ----- 7.15, 7.40 A assign (resid 50 and name HB) (resid 50 and name HN) 2.30 0.50 0.50 ! 0.9843 74:10 Intra 2.62, 2.74 A assign (resid 39 and name HG*) (resid 80 and name HN) 3.15 1.35 1.35 ! 0.0000 75:10 Long 3.01, 3.74 A assign (resid 100 and name HB*) (resid 54 and name HN) 3.15 1.35 1.35 ! 0.9965 76:10 Long 2.67, 3.62 A assign (resid 53 and name HB) (resid 54 and name HN) 3.15 1.35 1.35 ! 0.0000 77:10 Seq 2.72, 2.90 A assign (resid 34 and name HB) (resid 34 and name HN) 2.65 0.85 0.85 ! 0.9963 78:10 Intra 2.67, 2.75 A assign (resid 6 and name HB) (resid 6 and name HN) 2.65 0.85 0.85 ! 0.9589 79:10 Intra 2.43, 2.59 A assign (resid 118 and name HB) (resid 118 and name HN) 2.30 0.50 0.50 ! 0.9954 84:10 Intra 2.52, 2.57 A assign (resid 37 and name HB) (resid 82 and name HN) 2.65 0.85 0.85 ! 0.9977 85:10 Long 2.30, 2.73 A assign (resid 36 and name HB1) (resid 126 and name HN) 2.65 0.85 0.85 ! 0.9741 86:10 Long 2.47, 3.13 A assign (resid 98 and name HB2) (resid 98 and name HN) 2.30 0.50 0.50 ! 0.0000 87:10 Intra 2.61, 2.70 A assign (resid 126 and name HB*) (resid 126 and name HN) 2.65 0.85 0.85 ! 0.0000 88:10 Intra 2.54, 3.09 A assign (resid 98 and name HB1) (resid 98 and name HN) 2.65 0.85 0.85 ! 0.0000 89:10 Intra 2.39, 2.44 A assign (resid 25 and name HB) (resid 98 and name HN) 3.65 1.85 1.85 ! 0.9702 90:10 Long 3.10, 3.29 A assign (resid 101 and name HG) (resid 23 and name HN) 3.65 1.85 1.85 ! 0.8654 91:10 Ambig 4.25, 4.49 A or (resid 24 and name HB1) (resid 23 and name HN) ! 0.1346 91:10 ----- 5.80, 6.06 A assign (resid 22 and name HB*) (resid 23 and name HN) 3.15 1.35 1.35 ! 0.9390 92:10 Seq 4.01, 4.25 A assign (resid 22 and name HG2) (resid 23 and name HN) 2.65 0.85 0.85 ! 0.7045 93:10 Ambig 3.00, 3.41 A or (resid 22 and name HD1) (resid 23 and name HN) ! 0.2955 93:10 ----- 3.47, 5.43 A assign (resid 22 and name HG1) (resid 23 and name HN) 2.65 0.85 0.85 ! 0.0000 94:10 Seq 3.17, 3.37 A assign (resid 104 and name HB) (resid 50 and name HN) 4.15 2.35 2.35 ! 0.0000 95:10 Long 5.78, 5.98 A assign (resid 49 and name HG2*) (resid 50 and name HN) 2.65 0.85 0.85 ! 0.9626 96:10 Seq 2.92, 4.00 A assign (resid 39 and name HB*) (resid 80 and name HN) 4.15 2.35 2.35 ! 0.6799 98:10 Ambig 4.97, 5.39 A or (resid 41 and name HB) (resid 80 and name HN) ! 0.3201 98:10 ----- 5.64, 5.92 A assign (resid 80 and name HB) (resid 80 and name HN) 2.30 0.50 0.50 ! 0.0000 99:10 Intra 2.53, 2.60 A assign (resid 54 and name HG) (resid 54 and name HN) 2.30 0.50 0.50 ! 0.5212 100:10 Ambig 2.41, 2.75 A or (resid 54 and name HB2) (resid 54 and name HN) ! 0.4781 100:10 ----- 2.45, 2.52 A assign (resid 92 and name HB) (resid 34 and name HN) 2.65 0.85 0.85 ! 0.9168 102:10 Ambig 2.36, 2.65 A or (resid 33 and name HB1) (resid 34 and name HN) ! 0.0727 102:10 ----- 3.59, 3.76 A assign (resid 148 and name HB*) (resid 148 and name HN) 2.65 0.85 0.85 ! 0.0000 104:10 Intra 2.41, 3.26 A assign (resid 134 and name HB2) (resid 136 and name HN) 3.65 1.85 1.85 ! 0.8800 105:10 Ambig 3.98, 5.02 A or (resid 7 and name HG2) (resid 136 and name HN) ! 0.1200 105:10 ----- 5.54, 5.99 A assign (resid 134 and name HD*) (resid 136 and name HN) 3.15 1.35 1.35 ! 0.8586 106:10 Ambig 2.92, 3.89 A or (resid 116 and name HB2) (resid 118 and name HN) ! 0.0743 106:10 ----- 4.39, 5.09 A assign (resid 81 and name HG2*) (resid 82 and name HN) 2.30 0.50 0.50 ! 0.9844 108:10 Seq 2.79, 3.53 A assign (resid 37 and name HG2*) (resid 82 and name HN) 3.15 1.35 1.35 ! 0.6083 109:10 Ambig 3.46, 4.57 A or (resid 69 and name HD1*) (resid 82 and name HN) ! 0.1891 109:10 ----- 4.21, 5.52 A or (resid 37 and name HD1*) (resid 82 and name HN) ! 0.1763 109:10 ----- 4.25, 5.27 A assign (resid 80 and name HG2*) (resid 82 and name HN) 3.15 1.35 1.35 ! 0.0000 110:10 Mid 3.74, 5.11 A assign (resid 125 and name HG1*) (resid 126 and name HN) 2.65 0.85 0.85 ! 0.5042 111:10 Ambig 3.50, 4.23 A or (resid 125 and name HG2*) (resid 126 and name HN) ! 0.4571 111:10 ----- 3.56, 5.01 A assign (resid 25 and name HG1*) (resid 98 and name HN) 2.65 0.85 0.85 ! 0.5592 112:10 Ambig 3.75, 4.74 A or (resid 97 and name HD1*) (resid 98 and name HN) ! 0.2620 112:10 ----- 4.25, 5.66 A or (resid 97 and name HG12) (resid 98 and name HN) ! 0.0999 112:10 ----- 4.99, 5.11 A assign (resid 124 and name HG2*) (resid 126 and name HN) 3.15 1.35 1.35 ! 0.4744 113:10 Ambig 3.02, 4.30 A or (resid 36 and name HD1*) (resid 126 and name HN) ! 0.4639 113:10 ----- 3.03, 5.25 A assign (resid 23 and name HG1*) (resid 23 and name HN) 2.30 0.50 0.50 ! 0.5226 114:10 Ambig 2.14, 4.49 A or (resid 23 and name HG2*) (resid 23 and name HN) ! 0.3437 114:10 ----- 2.30, 3.47 A or (resid 101 and name HB*) (resid 23 and name HN) ! 0.1219 114:10 ----- 2.73, 3.60 A assign (resid 104 and name HD1*) (resid 50 and name HN) 4.15 2.35 2.35 ! 0.0000 115:10 Long 5.75, 7.41 A assign (resid 50 and name HG1*) (resid 50 and name HN) 2.30 0.50 0.50 ! 0.0000 116:10 Intra 2.07, 3.08 A assign (resid 80 and name HG1*) (resid 80 and name HN) 2.30 0.50 0.50 ! 0.9521 117:10 Intra 2.57, 3.28 A assign (resid 80 and name HG2*) (resid 80 and name HN) 3.15 1.35 1.35 ! 0.0000 118:10 Intra 4.32, 4.63 A assign (resid 99 and name HB*) (resid 54 and name HN) 3.15 1.35 1.35 ! 0.0000 119:10 Long 3.63, 5.08 A assign (resid 53 and name HG2*) (resid 54 and name HN) 2.65 0.85 0.85 ! 0.4032 120:10 Ambig 3.67, 4.59 A or (resid 54 and name HD1*) (resid 54 and name HN) ! 0.2367 120:10 ----- 4.01, 4.77 A or (resid 53 and name HG1*) (resid 54 and name HN) ! 0.1823 120:10 ----- 4.19, 4.80 A or (resid 101 and name HD2*) (resid 54 and name HN) ! 0.1305 120:10 ----- 4.43, 5.71 A assign (resid 34 and name HG1*) (resid 34 and name HN) 2.65 0.85 0.85 ! 0.9969 121:10 Intra 1.98, 2.93 A assign (resid 30 and name HG2*) (resid 34 and name HN) 3.65 1.85 1.85 ! 0.0000 122:10 Mid 3.19, 4.00 A assign (resid 118 and name HG2*) (resid 118 and name HN) 2.30 0.50 0.50 ! 0.9309 123:10 Intra 2.18, 3.22 A assign (resid 97 and name HG2*) (resid 98 and name HN) 2.65 0.85 0.85 ! 0.0000 124:10 Seq 2.57, 3.30 A assign (resid 14 and name HA) (resid 143 and name HN) 2.65 0.85 0.85 ! 0.0000 126:10 Long 2.17, 2.40 A assign (resid 9 and name HA) (resid 10 and name HN) 3.15 1.35 1.35 ! 0.9980 129:10 Seq 2.15, 2.23 A assign (resid 1 and name HA) (resid 2 and name HN) 2.65 0.85 0.85 ! 0.0000 131:10 Seq 2.07, 2.26 A assign (resid 9 and name HB1) (resid 10 and name HN) 3.65 1.85 1.85 ! 0.0000 132:10 Seq 2.79, 3.66 A assign (resid 97 and name HA) (resid 27 and name HN) 2.65 0.85 0.85 ! 0.7805 133:10 Ambig 2.98, 3.23 A or (resid 26 and name HB) (resid 27 and name HN) ! 0.1698 133:10 ----- 3.85, 3.99 A assign (resid 143 and name HB) (resid 143 and name HN) 2.65 0.85 0.85 ! 0.0000 134:10 Intra 2.44, 2.53 A assign (resid 14 and name HB*) (resid 143 and name HN) 3.15 1.35 1.35 ! 0.0000 135:10 Long 3.77, 4.68 A assign (resid 79 and name HB1) (resid 71 and name HN) 3.65 1.85 1.85 ! 0.0000 136:10 Long 4.29, 4.55 A assign (resid 67 and name HB*) (resid 61 and name HN) 3.15 1.35 1.35 ! 0.0000 137:10 Long 3.53, 4.84 A assign (resid 9 and name HB2) (resid 10 and name HN) 3.15 1.35 1.35 ! 0.7470 138:10 Ambig 3.73, 3.93 A or (resid 138 and name HB1) (resid 10 and name HN) ! 0.1468 138:10 ----- 4.90, 5.95 A or (resid 11 and name HA1) (resid 10 and name HN) ! 0.1062 138:10 ----- 5.17, 5.31 A assign (resid 38 and name HB2) (resid 38 and name HN) 3.15 1.35 1.35 ! 0.0000 139:10 Intra 2.42, 3.14 A assign (resid 38 and name HB1) (resid 38 and name HN) 3.15 1.35 1.35 ! 0.0000 140:10 Intra 2.57, 2.76 A assign (resid 82 and name HB2) (resid 37 and name HN) 3.65 1.85 1.85 ! 0.0000 141:10 Long 2.99, 3.43 A assign (resid 82 and name HB1) (resid 37 and name HN) 3.65 1.85 1.85 ! 0.0000 142:10 Long 4.05, 4.59 A assign (resid 71 and name HB2) (resid 71 and name HN) 3.15 1.35 1.35 ! 0.0000 143:10 Intra 2.77, 2.97 A assign (resid 71 and name HB1) (resid 71 and name HN) 3.15 1.35 1.35 ! 0.0000 144:10 Intra 2.27, 2.50 A assign (resid 132 and name HB2) (resid 133 and name HN) 3.15 1.35 1.35 ! 0.0000 145:10 Seq 4.14, 4.28 A assign (resid 70 and name HB) (resid 71 and name HN) 3.15 1.35 1.35 ! 0.9188 147:10 Ambig 4.18, 4.27 A or (resid 78 and name HB) (resid 71 and name HN) ! 0.0812 147:10 ----- 6.26, 6.73 A assign (resid 70 and name HB) (resid 70 and name HN) 2.65 0.85 0.85 ! 0.0000 148:10 Intra 2.68, 2.74 A assign (resid 1 and name HB) (resid 2 and name HN) 3.15 1.35 1.35 ! 0.0000 149:10 Seq 4.00, 4.26 A assign (resid 10 and name HB) (resid 10 and name HN) 3.15 1.35 1.35 ! 0.0000 150:10 Intra 3.74, 3.83 A assign (resid 125 and name HB) (resid 125 and name HN) 3.15 1.35 1.35 ! 0.0000 151:10 Intra 2.74, 2.91 A assign (resid 141 and name HB2) (resid 116 and name HN) 4.15 2.35 2.35 ! 0.9492 152:10 Long 3.71, 4.19 A assign (resid 37 and name HB) (resid 38 and name HN) 3.15 1.35 1.35 ! 0.5337 153:10 Ambig 4.04, 4.14 A or (resid 39 and name HB*) (resid 38 and name HN) ! 0.3792 153:10 ----- 4.28, 5.31 A or (resid 123 and name HB1) (resid 38 and name HN) ! 0.0479 153:10 ----- 6.04, 6.40 A assign (resid 37 and name HG11) (resid 37 and name HN) 3.15 1.35 1.35 ! 0.8887 154:10 Ambig 2.53, 3.24 A or (resid 81 and name HG2*) (resid 37 and name HN) ! 0.0692 154:10 ----- 3.88, 4.68 A assign (resid 37 and name HB) (resid 37 and name HN) 2.65 0.85 0.85 ! 0.9590 156:10 Intra 2.53, 2.70 A assign (resid 36 and name HG) (resid 37 and name HN) 3.65 1.85 1.85 ! 0.0000 157:10 Seq 3.81, 4.57 A assign (resid 27 and name HB) (resid 27 and name HN) 2.65 0.85 0.85 ! 0.9822 158:10 Intra 3.04, 3.15 A assign (resid 12 and name HG2*) (resid 143 and name HN) 2.65 0.85 0.85 ! 0.7064 159:10 Ambig 3.13, 4.07 A or (resid 142 and name HB) (resid 143 and name HN) ! 0.1229 159:10 ----- 4.19, 4.26 A or (resid 143 and name HG2*) (resid 143 and name HN) ! 0.0954 159:10 ----- 4.38, 4.52 A assign (resid 69 and name HB) (resid 70 and name HN) 3.15 1.35 1.35 ! 0.0000 160:10 Seq 4.23, 4.30 A assign (resid 69 and name HG12) (resid 70 and name HN) 4.15 2.35 2.35 ! 0.0000 161:10 Seq 5.50, 5.60 A assign (resid 126 and name HB*) (resid 133 and name HN) 3.65 1.85 1.85 ! 0.0000 162:10 Long 4.69, 5.61 A assign (resid 133 and name HG12) (resid 133 and name HN) 3.15 1.35 1.35 ! 0.9996 163:10 Intra 1.85, 2.13 A assign (resid 134 and name HB1) (resid 133 and name HN) 2.65 0.85 0.85 ! 0.6499 164:10 Ambig 3.24, 3.74 A or (resid 133 and name HB) (resid 133 and name HN) ! 0.3157 164:10 ----- 3.66, 3.71 A assign (resid 61 and name HG2) (resid 61 and name HN) 3.65 1.85 1.85 ! 0.9922 165:10 Intra 2.66, 4.10 A assign (resid -1 and name HB*) (resid -1 and name HN) 3.15 1.35 1.35 ! 0.0000 166:10 Intra 2.45, 3.09 A assign (resid 2 and name HB2) (resid 2 and name HN) 2.65 0.85 0.85 ! 0.9215 167:10 Intra 2.36, 2.74 A assign (resid 2 and name HG2) (resid 2 and name HN) 3.15 1.35 1.35 ! 0.5639 168:10 Ambig 2.38, 3.82 A or (resid 2 and name HG1) (resid 2 and name HN) ! 0.4361 168:10 ----- 2.48, 3.17 A assign (resid 137 and name HB*) (resid 10 and name HN) 4.15 2.35 2.35 ! 0.8740 169:10 Ambig 4.21, 5.84 A or (resid 8 and name HB1) (resid 10 and name HN) ! 0.1260 169:10 ----- 5.82, 6.22 A assign (resid 124 and name HB) (resid 125 and name HN) 3.15 1.35 1.35 ! 0.6413 170:10 Ambig 4.03, 4.12 A or (resid 124 and name HG12) (resid 125 and name HN) ! 0.3587 170:10 ----- 4.44, 4.63 A assign (resid 116 and name HG) (resid 116 and name HN) 2.30 0.50 0.50 ! 0.5244 171:10 Ambig 2.28, 2.48 A or (resid 116 and name HB2) (resid 116 and name HN) ! 0.2734 171:10 ----- 2.54, 2.59 A or (resid 115 and name HB*) (resid 116 and name HN) ! 0.2021 171:10 ----- 2.67, 3.60 A assign (resid 123 and name HB1) (resid 123 and name HN) 2.65 0.85 0.85 ! 0.9929 172:10 Intra 2.43, 2.72 A assign (resid 123 and name HB2) (resid 123 and name HN) 2.65 0.85 0.85 ! 0.9791 173:10 Intra 2.09, 2.38 A assign (resid 81 and name HG2*) (resid 38 and name HN) 3.65 1.85 1.85 ! 0.4601 174:10 Ambig 4.35, 5.76 A or (resid 124 and name HG11) (resid 38 and name HN) ! 0.3889 174:10 ----- 4.48, 4.92 A or (resid 134 and name HG*) (resid 38 and name HN) ! 0.0759 174:10 ----- 5.88, 7.36 A assign (resid 36 and name HD2*) (resid 37 and name HN) 2.65 0.85 0.85 ! 0.0000 175:10 Seq 2.63, 4.18 A assign (resid 59 and name HD1*) (resid 27 and name HN) 3.65 1.85 1.85 ! 0.8446 176:10 Ambig 4.31, 5.38 A or (resid 98 and name HD1*) (resid 27 and name HN) ! 0.1554 176:10 ----- 5.72, 6.86 A assign (resid 142 and name HG2*) (resid 143 and name HN) 2.65 0.85 0.85 ! 0.0000 177:10 Seq 3.18, 3.82 A assign (resid 70 and name HG1*) (resid 71 and name HN) 2.30 0.50 0.50 ! 0.6504 178:10 Ambig 2.91, 3.69 A or (resid 69 and name HG2*) (resid 71 and name HN) ! 0.1634 178:10 ----- 3.66, 4.97 A or (resid 78 and name HG2*) (resid 71 and name HN) ! 0.1022 178:10 ----- 3.96, 5.24 A or (resid 70 and name HG2*) (resid 71 and name HN) ! 0.0734 178:10 ----- 4.18, 4.92 A assign (resid 69 and name HG11) (resid 70 and name HN) 4.15 2.35 2.35 ! 0.0000 179:10 Seq 4.52, 4.67 A assign (resid 70 and name HG2*) (resid 70 and name HN) 2.30 0.50 0.50 ! 0.6674 180:10 Ambig 2.88, 3.82 A or (resid 69 and name HG2*) (resid 70 and name HN) ! 0.3068 180:10 ----- 3.28, 3.96 A assign (resid 133 and name HD1*) (resid 133 and name HN) 3.15 1.35 1.35 ! 0.9969 182:10 Intra 2.21, 4.43 A assign (resid 61 and name HG1) (resid 61 and name HN) 3.15 1.35 1.35 ! 0.9977 183:10 Intra 2.08, 3.76 A assign (resid 1 and name HG2*) (resid 2 and name HN) 2.65 0.85 0.85 ! 0.7809 184:10 Ambig 2.21, 4.53 A or (resid 1 and name HG1*) (resid 2 and name HN) ! 0.2191 184:10 ----- 2.74, 4.43 A assign (resid 10 and name HG1*) (resid 10 and name HN) 2.65 0.85 0.85 ! 0.9835 185:10 Intra 3.02, 4.00 A assign (resid 10 and name HG2*) (resid 10 and name HN) 2.30 0.50 0.50 ! 0.9957 186:10 Intra 2.19, 3.08 A assign (resid 124 and name HG2*) (resid 125 and name HN) 2.30 0.50 0.50 ! 0.9349 187:10 Seq 2.79, 3.51 A assign (resid 141 and name HG1) (resid 116 and name HN) 3.65 1.85 1.85 ! 0.8284 188:10 Ambig 4.08, 4.58 A or (resid 142 and name HB) (resid 116 and name HN) ! 0.1102 188:10 ----- 5.71, 6.13 A assign (resid 116 and name HD2*) (resid 116 and name HN) 3.65 1.85 1.85 ! 0.0000 189:10 Intra 3.21, 4.22 A assign (resid 123 and name HD1*) (resid 123 and name HN) 3.15 1.35 1.35 ! 0.0000 190:10 Intra 4.16, 5.21 A assign (resid 40 and name HA) (resid 40 and name HN) 3.65 1.85 1.85 ! 0.9454 191:10 Intra 2.91, 2.94 A assign (resid 42 and name HA) (resid 42 and name HN) 3.65 1.85 1.85 ! 0.0000 192:10 Intra 2.90, 2.92 A assign (resid 40 and name HA) (resid 41 and name HN) 2.30 0.50 0.50 ! 0.0000 193:10 Seq 2.08, 2.11 A assign (resid 82 and name HA) (resid 83 and name HN) 2.30 0.50 0.50 ! 0.0000 194:10 Seq 2.08, 2.13 A assign (resid 79 and name HA) (resid 79 and name HN) 3.15 1.35 1.35 ! 0.0000 195:10 Intra 2.86, 2.91 A assign (resid 102 and name HA) (resid 102 and name HN) 3.15 1.35 1.35 ! 0.0000 196:10 Intra 2.92, 2.94 A assign (resid 81 and name HA) (resid 81 and name HN) 3.15 1.35 1.35 ! 0.9233 198:10 Intra 2.88, 2.89 A assign (resid 21 and name HN) (resid 22 and name HN) 3.15 1.35 1.35 ! 0.0000 199:10 Seq 4.33, 4.41 A assign (resid 68 and name HA) (resid 68 and name HN) 3.15 1.35 1.35 ! 0.0000 200:10 Intra 2.92, 2.93 A assign (resid 126 and name HA) (resid 36 and name HN) 4.15 2.35 2.35 ! 0.0000 201:10 Long 4.73, 5.05 A assign (resid 74 and name HB) (resid 74 and name HN) 2.65 0.85 0.85 ! 0.0000 202:10 Intra 2.53, 2.64 A assign (resid 14 and name HB*) (resid 145 and name HN) 3.65 1.85 1.85 ! 0.0000 203:10 Long 3.91, 5.11 A assign (resid 110 and name HA) (resid 109 and name HN) 3.65 1.85 1.85 ! 0.8365 205:10 Ambig 5.15, 5.33 A or (resid 110 and name HB) (resid 109 and name HN) ! 0.1635 205:10 ----- 6.76, 7.20 A assign (resid 42 and name HB*) (resid 42 and name HN) 2.65 0.85 0.85 ! 0.9985 206:10 Intra 2.45, 3.10 A assign (resid 30 and name HA) (resid 31 and name HN) 2.65 0.85 0.85 ! 0.0000 207:10 Seq 2.08, 2.17 A assign (resid 112 and name HA1) (resid 113 and name HN) 2.65 0.85 0.85 ! 0.9973 208:10 Seq 2.36, 2.67 A assign (resid 83 and name HB) (resid 83 and name HN) 3.65 1.85 1.85 ! 0.0000 209:10 Intra 3.26, 3.56 A assign (resid 81 and name HB) (resid 81 and name HN) 2.65 0.85 0.85 ! 0.8183 210:10 Ambig 2.74, 2.80 A or (resid 138 and name HB2) (resid 139 and name HN) ! 0.1327 210:10 ----- 3.71, 4.28 A assign (resid 138 and name HB1) (resid 139 and name HN) 3.15 1.35 1.35 ! 0.9216 211:10 Seq 3.66, 3.81 A assign (resid 73 and name HB*) (resid 79 and name HN) 3.15 1.35 1.35 ! 0.6099 212:10 Ambig 2.27, 3.54 A or (resid 79 and name HB2) (resid 79 and name HN) ! 0.3901 212:10 ----- 2.45, 2.50 A assign (resid 79 and name HB1) (resid 79 and name HN) 3.15 1.35 1.35 ! 0.0000 213:10 Intra 3.59, 3.64 A assign (resid 34 and name HA) (resid 36 and name HN) 4.15 2.35 2.35 ! 0.0000 214:10 Mid 3.65, 4.00 A assign (resid 113 and name HB2) (resid 113 and name HN) 2.65 0.85 0.85 ! 0.0000 216:10 Intra 2.27, 2.98 A assign (resid 82 and name HB1) (resid 83 and name HN) 3.15 1.35 1.35 ! 0.0000 217:10 Seq 3.46, 3.56 A assign (resid 82 and name HB2) (resid 83 and name HN) 3.15 1.35 1.35 ! 0.0000 218:10 Seq 4.20, 4.28 A assign (resid 139 and name HB2) (resid 139 and name HN) 2.65 0.85 0.85 ! 0.9966 219:10 Intra 2.41, 3.11 A assign (resid 139 and name HB1) (resid 139 and name HN) 2.65 0.85 0.85 ! 0.9945 220:10 Intra 2.69, 3.09 A assign (resid 71 and name HB2) (resid 79 and name HN) 3.65 1.85 1.85 ! 0.0000 221:10 Long 4.80, 5.19 A assign (resid 16 and name HB2) (resid 145 and name HN) 4.15 2.35 2.35 ! 0.8969 222:10 Ambig 4.36, 5.27 A or (resid 19 and name HB1) (resid 145 and name HN) ! 0.1031 222:10 ----- 6.25, 6.82 A assign (resid 22 and name HE2) (resid 22 and name HN) 3.15 1.35 1.35 ! 0.8413 223:10 Ambig 4.03, 4.47 A or (resid 103 and name HB2) (resid 22 and name HN) ! 0.1005 223:10 ----- 5.74, 5.93 A assign (resid 132 and name HB1) (resid 132 and name HN) 2.65 0.85 0.85 ! 0.9734 224:10 Intra 2.46, 2.57 A assign (resid 132 and name HB2) (resid 132 and name HN) 2.30 0.50 0.50 ! 0.0000 225:10 Intra 2.57, 2.67 A assign (resid 102 and name HB2) (resid 102 and name HN) 2.65 0.85 0.85 ! 0.9701 226:10 Intra 2.53, 2.69 A assign (resid 68 and name HB2) (resid 68 and name HN) 2.65 0.85 0.85 ! 0.0000 227:10 Intra 2.69, 2.89 A assign (resid 68 and name HB1) (resid 68 and name HN) 2.65 0.85 0.85 ! 0.9984 228:10 Intra 2.28, 2.41 A assign (resid 35 and name HA1) (resid 36 and name HN) 3.65 1.85 1.85 ! 0.0000 229:10 Seq 2.88, 3.14 A assign (resid 106 and name HB1) (resid 109 and name HN) 3.65 1.85 1.85 ! 0.9966 230:10 Mid 2.35, 2.84 A assign (resid 106 and name HB2) (resid 109 and name HN) 3.65 1.85 1.85 ! 0.0000 231:10 Mid 3.24, 4.27 A assign (resid 40 and name HB1) (resid 40 and name HN) 2.65 0.85 0.85 ! 0.0000 232:10 Intra 2.50, 2.63 A assign (resid 39 and name HG*) (resid 40 and name HN) 3.15 1.35 1.35 ! 0.0000 233:10 Seq 3.62, 4.59 A assign (resid 40 and name HB1) (resid 41 and name HN) 3.65 1.85 1.85 ! 0.0000 234:10 Seq 4.09, 4.22 A assign (resid 78 and name HB) (resid 41 and name HN) 3.15 1.35 1.35 ! 0.9955 235:10 Long 2.76, 2.99 A assign (resid 113 and name HB1) (resid 113 and name HN) 2.65 0.85 0.85 ! 0.9891 236:10 Intra 2.30, 2.78 A assign (resid 144 and name HB) (resid 145 and name HN) 3.15 1.35 1.35 ! 0.0000 237:10 Seq 4.12, 4.25 A assign (resid 78 and name HB) (resid 79 and name HN) 3.15 1.35 1.35 ! 0.0000 238:10 Seq 3.98, 4.17 A assign (resid 24 and name HB2) (resid 25 and name HN) 3.15 1.35 1.35 ! 0.9381 239:10 Seq 3.48, 3.60 A assign (resid 21 and name HB) (resid 22 and name HN) 3.15 1.35 1.35 ! 0.0000 240:10 Seq 4.01, 4.08 A assign (resid 131 and name HB1) (resid 132 and name HN) 2.65 0.85 0.85 ! 0.0000 241:10 Seq 3.04, 3.24 A assign (resid 144 and name HB) (resid 111 and name HN) 3.65 1.85 1.85 ! 0.0000 242:10 Long 4.50, 4.84 A assign (resid 102 and name HB1) (resid 102 and name HN) 2.65 0.85 0.85 ! 0.0000 243:10 Intra 2.48, 2.67 A assign (resid 17 and name HB1) (resid 109 and name HN) 3.15 1.35 1.35 ! 0.9075 245:10 Ambig 2.57, 3.30 A or (resid 17 and name HG1) (resid 109 and name HN) ! 0.0925 245:10 ----- 3.77, 4.76 A assign (resid 39 and name HB*) (resid 40 and name HN) 2.65 0.85 0.85 ! 0.9898 246:10 Seq 2.50, 3.57 A assign (resid 41 and name HB) (resid 42 and name HN) 3.15 1.35 1.35 ! 0.9718 248:10 Seq 3.86, 4.16 A assign (resid 41 and name HG12) (resid 42 and name HN) 3.65 1.85 1.85 ! 0.7650 249:10 Ambig 4.51, 4.90 A or (resid 77 and name HD*) (resid 42 and name HN) ! 0.2350 249:10 ----- 5.49, 7.19 A assign (resid 118 and name HB) (resid 42 and name HN) 4.15 2.35 2.35 ! 0.0000 250:10 Long 5.56, 5.83 A assign (resid 117 and name HG2*) (resid 42 and name HN) 3.65 1.85 1.85 ! 0.0000 251:10 Long 4.40, 5.41 A assign (resid 77 and name HG2) (resid 41 and name HN) 3.65 1.85 1.85 ! 0.0000 252:10 Long 4.48, 5.18 A assign (resid 41 and name HB) (resid 41 and name HN) 2.65 0.85 0.85 ! 0.9927 253:10 Intra 2.50, 2.58 A assign (resid 143 and name HG2*) (resid 113 and name HN) 3.15 1.35 1.35 ! 0.8438 254:10 Ambig 3.70, 5.04 A or (resid 144 and name HG2*) (resid 113 and name HN) ! 0.0914 254:10 ----- 5.37, 6.79 A assign (resid 74 and name HG2*) (resid 74 and name HN) 3.15 1.35 1.35 ! 0.0000 255:10 Intra 3.98, 4.36 A assign (resid 69 and name HB) (resid 81 and name HN) 3.15 1.35 1.35 ! 0.0000 256:10 Long 2.86, 3.12 A assign (resid 80 and name HB) (resid 81 and name HN) 3.15 1.35 1.35 ! 0.0000 258:10 Seq 3.92, 4.09 A assign (resid 145 and name HG2*) (resid 145 and name HN) 2.30 0.50 0.50 ! 0.9849 259:10 Intra 2.23, 3.33 A assign (resid 25 and name HB) (resid 25 and name HN) 2.30 0.50 0.50 ! 0.8748 261:10 Ambig 2.48, 2.52 A or (resid 24 and name HB1) (resid 25 and name HN) ! 0.0749 261:10 ----- 3.74, 4.04 A assign (resid 98 and name HB2) (resid 25 and name HN) 4.15 2.35 2.35 ! 0.7744 262:10 Ambig 5.78, 5.95 A or (resid 22 and name HD2) (resid 25 and name HN) ! 0.2256 262:10 ----- 7.10, 7.56 A assign (resid 22 and name HB*) (resid 22 and name HN) 2.30 0.50 0.50 ! 0.0000 263:10 Intra 2.42, 2.76 A assign (resid 22 and name HG2) (resid 22 and name HN) 3.15 1.35 1.35 ! 0.5983 264:10 Ambig 4.28, 4.42 A or (resid 22 and name HD1) (resid 22 and name HN) ! 0.4017 264:10 ----- 4.58, 5.57 A assign (resid 131 and name HD*) (resid 132 and name HN) 3.15 1.35 1.35 ! 0.8530 265:10 Ambig 3.68, 4.36 A or (resid 133 and name HG12) (resid 132 and name HN) ! 0.1470 265:10 ----- 4.94, 5.31 A assign (resid 32 and name HG2*) (resid 32 and name HN) 3.15 1.35 1.35 ! 0.7471 266:10 Ambig 4.30, 4.51 A or (resid 131 and name HG1) (resid 132 and name HN) ! 0.2529 266:10 ----- 5.16, 5.36 A assign (resid 110 and name HG2*) (resid 111 and name HN) 2.30 0.50 0.50 ! 0.7525 267:10 Ambig 2.02, 3.71 A or (resid 111 and name HB*) (resid 111 and name HN) ! 0.2442 267:10 ----- 2.44, 2.91 A assign (resid 54 and name HG) (resid 102 and name HN) 4.15 2.35 2.35 ! 0.8170 268:10 Ambig 4.25, 4.96 A or (resid 54 and name HB2) (resid 102 and name HN) ! 0.1830 268:10 ----- 5.45, 5.97 A assign (resid 51 and name HB*) (resid 102 and name HN) 4.15 2.35 2.35 ! 0.0000 269:10 Long 4.07, 5.42 A assign (resid 36 and name HB2) (resid 36 and name HN) 2.65 0.85 0.85 ! 0.5397 270:10 Ambig 2.49, 2.88 A or (resid 36 and name HB1) (resid 36 and name HN) ! 0.4592 270:10 ----- 2.56, 3.18 A assign (resid 126 and name HB*) (resid 36 and name HN) 4.15 2.35 2.35 ! 0.0000 271:10 Long 3.27, 4.69 A assign (resid 34 and name HG2*) (resid 36 and name HN) 2.65 0.85 0.85 ! 0.9552 272:10 Mid 1.99, 3.23 A assign (resid 109 and name HB*) (resid 109 and name HN) 2.30 0.50 0.50 ! 0.9961 273:10 Intra 2.35, 2.91 A assign (resid 105 and name HG2*) (resid 109 and name HN) 3.15 1.35 1.35 ! 0.6843 274:10 Ambig 4.19, 5.22 A or (resid 47 and name HG2) (resid 109 and name HN) ! 0.2600 274:10 ----- 4.93, 5.76 A assign (resid 118 and name HG1*) (resid 40 and name HN) 2.65 0.85 0.85 ! 0.7246 275:10 Ambig 2.87, 3.74 A or (resid 41 and name HD1*) (resid 40 and name HN) ! 0.1363 275:10 ----- 3.79, 6.00 A or (resid 41 and name HG11) (resid 40 and name HN) ! 0.0854 275:10 ----- 4.10, 4.58 A assign (resid 41 and name HG2*) (resid 42 and name HN) 2.65 0.85 0.85 ! 0.8810 276:10 Ambig 2.52, 3.59 A or (resid 118 and name HG2*) (resid 42 and name HN) ! 0.0572 276:10 ----- 3.98, 5.16 A assign (resid 6 and name HG1*) (resid 31 and name HN) 3.65 1.85 1.85 ! 0.0000 277:10 Long 4.80, 6.29 A assign (resid 41 and name HG12) (resid 41 and name HN) 3.15 1.35 1.35 ! 0.8250 278:10 Ambig 3.55, 3.88 A or (resid 77 and name HD*) (resid 41 and name HN) ! 0.1750 278:10 ----- 4.60, 6.69 A assign (resid 10 and name HG1*) (resid 139 and name HN) 3.15 1.35 1.35 ! 0.9933 280:10 Long 1.82, 4.19 A assign (resid 144 and name HG1*) (resid 145 and name HN) 2.65 0.85 0.85 ! 0.0000 281:10 Seq 3.08, 3.86 A assign (resid 10 and name HG2*) (resid 139 and name HN) 3.15 1.35 1.35 ! 0.0000 282:10 Long 1.79, 2.55 A assign (resid 78 and name HG2*) (resid 79 and name HN) 2.65 0.85 0.85 ! 0.9228 283:10 Seq 2.79, 3.86 A assign (resid 80 and name HG2*) (resid 81 and name HN) 2.30 0.50 0.50 ! 0.0000 284:10 Seq 2.59, 3.36 A assign (resid 99 and name HB*) (resid 25 and name HN) 3.15 1.35 1.35 ! 0.5990 285:10 Ambig 4.30, 5.22 A or (resid 10 and name HG1*) (resid 25 and name HN) ! 0.3623 285:10 ----- 4.68, 6.53 A assign (resid 25 and name HG2*) (resid 25 and name HN) 2.30 0.50 0.50 ! 0.8990 286:10 Ambig 2.32, 3.23 A or (resid 97 and name HD1*) (resid 25 and name HN) ! 0.0282 286:10 ----- 4.14, 6.67 A assign (resid 21 and name HG2*) (resid 22 and name HN) 2.30 0.50 0.50 ! 0.9985 287:10 Seq 2.26, 3.14 A assign (resid 124 and name HG2*) (resid 132 and name HN) 4.15 2.35 2.35 ! 0.8677 288:10 Ambig 4.52, 5.93 A or (resid 133 and name HD1*) (resid 132 and name HN) ! 0.1323 288:10 ----- 6.18, 7.30 A assign (resid 144 and name HG1*) (resid 111 and name HN) 3.15 1.35 1.35 ! 0.8715 289:10 Ambig 4.22, 5.07 A or (resid 47 and name HG1) (resid 111 and name HN) ! 0.1285 289:10 ----- 5.81, 6.60 A assign (resid 53 and name HG1*) (resid 102 and name HN) 2.65 0.85 0.85 ! 0.6498 290:10 Ambig 2.84, 4.05 A or (resid 101 and name HB*) (resid 102 and name HN) ! 0.2666 290:10 ----- 3.29, 3.82 A or (resid 101 and name HD2*) (resid 102 and name HN) ! 0.0503 290:10 ----- 4.34, 5.11 A assign (resid 37 and name HD1*) (resid 36 and name HN) 3.15 1.35 1.35 ! 0.9089 291:10 Ambig 2.89, 4.95 A or (resid 36 and name HD1*) (resid 36 and name HN) ! 0.0684 291:10 ----- 4.44, 5.39 A assign (resid 36 and name HD2*) (resid 36 and name HN) 3.65 1.85 1.85 ! 0.7086 292:10 Ambig 3.94, 5.15 A or (resid 87 and name HD2*) (resid 36 and name HN) ! 0.1533 292:10 ----- 5.08, 5.75 A or (resid 83 and name HG2*) (resid 36 and name HN) ! 0.1381 292:10 ----- 5.17, 7.38 A assign (resid 47 and name HG1) (resid 109 and name HN) 3.65 1.85 1.85 ! 0.6994 293:10 Ambig 4.65, 5.12 A or (resid 144 and name HG1*) (resid 109 and name HN) ! 0.3006 293:10 ----- 5.35, 6.63 A assign (resid 97 and name HG2*) (resid 25 and name HN) 3.65 1.85 1.85 ! 0.0000 294:10 Long 2.43, 3.49 A assign (resid 102 and name HA) (resid 103 and name HN) 2.30 0.50 0.50 ! 0.0000 295:10 Seq 2.10, 2.14 A assign (resid 137 and name HA) (resid 137 and name HN) 3.15 1.35 1.35 ! 0.0000 296:10 Intra 2.89, 2.91 A assign (resid 12 and name HA) (resid 141 and name HN) 2.65 0.85 0.85 ! 0.0000 297:10 Long 2.43, 2.65 A assign (resid 3 and name HA) (resid 3 and name HN) 2.65 0.85 0.85 ! 0.0000 299:10 Intra 2.18, 2.75 A assign (resid 96 and name HA2) (resid 97 and name HN) 3.15 1.35 1.35 ! 0.9651 302:10 Seq 2.84, 3.01 A assign (resid 3 and name HA) (resid 4 and name HN) 3.65 1.85 1.85 ! 0.0000 303:10 Seq 2.10, 2.68 A assign (resid 26 and name HB) (resid 26 and name HN) 3.15 1.35 1.35 ! 0.0000 305:10 Intra 2.50, 2.57 A assign (resid 49 and name HB) (resid 104 and name HN) 3.65 1.85 1.85 ! 0.9965 306:10 Long 2.56, 2.90 A assign (resid 50 and name HA) (resid 104 and name HN) 3.15 1.35 1.35 ! 0.0000 307:10 Long 3.40, 3.62 A assign (resid 28 and name HB2) (resid 28 and name HN) 3.15 1.35 1.35 ! 0.8948 308:10 Ambig 2.57, 2.80 A or (resid 28 and name HB1) (resid 28 and name HN) ! 0.0990 308:10 ----- 3.71, 3.86 A assign (resid 93 and name HB1) (resid 93 and name HN) 3.65 1.85 1.85 ! 0.9925 309:10 Intra 3.10, 3.22 A assign (resid 96 and name HA1) (resid 97 and name HN) 3.15 1.35 1.35 ! 0.8576 310:10 Ambig 2.14, 2.20 A or (resid 97 and name HA) (resid 97 and name HN) ! 0.1424 310:10 ----- 2.89, 2.91 A assign (resid 127 and name HB2) (resid 127 and name HN) 3.15 1.35 1.35 ! 0.0000 311:10 Intra 2.31, 3.47 A assign (resid 17 and name HA) (resid 19 and name HN) 3.65 1.85 1.85 ! 0.9858 312:10 Mid 3.37, 3.50 A assign (resid 18 and name HA1) (resid 19 and name HN) 3.65 1.85 1.85 ! 0.0000 313:10 Seq 2.99, 3.07 A assign (resid 140 and name HA1) (resid 141 and name HN) 3.15 1.35 1.35 ! 0.0000 314:10 Seq 2.63, 2.99 A assign (resid 60 and name HA) (resid 60 and name HN) 3.65 1.85 1.85 ! 0.9924 315:10 Intra 2.83, 2.89 A assign (resid 83 and name HB) (resid 84 and name HN) 3.65 1.85 1.85 ! 0.7029 316:10 Ambig 3.51, 3.95 A or (resid 67 and name HB*) (resid 84 and name HN) ! 0.2971 316:10 ----- 4.05, 5.61 A assign (resid 84 and name HB2) (resid 84 and name HN) 3.15 1.35 1.35 ! 0.0000 317:10 Intra 2.63, 2.93 A assign (resid 48 and name HB2) (resid 104 and name HN) 4.15 2.35 2.35 ! 0.0000 318:10 Long 5.59, 5.82 A assign (resid 103 and name HB2) (resid 104 and name HN) 3.15 1.35 1.35 ! 0.0000 319:10 Seq 3.83, 4.01 A assign (resid 102 and name HB2) (resid 103 and name HN) 3.15 1.35 1.35 ! 0.9580 320:10 Seq 4.39, 4.47 A assign (resid 103 and name HB2) (resid 103 and name HN) 2.65 0.85 0.85 ! 0.9877 321:10 Intra 2.54, 2.60 A assign (resid 64 and name HB1) (resid 64 and name HN) 2.65 0.85 0.85 ! 0.0000 322:10 Intra 2.38, 2.49 A assign (resid 90 and name HB2) (resid 90 and name HN) 2.65 0.85 0.85 ! 0.9104 323:10 Ambig 2.50, 2.67 A or (resid 91 and name HD*) (resid 90 and name HN) ! 0.0896 323:10 ----- 3.68, 4.44 A assign (resid 90 and name HB1) (resid 90 and name HN) 3.15 1.35 1.35 ! 0.0000 324:10 Intra 3.48, 3.72 A assign (resid 127 and name HB1) (resid 127 and name HN) 2.65 0.85 0.85 ! 0.9934 325:10 Intra 2.38, 2.49 A assign (resid 131 and name HE*) (resid 131 and name HN) 3.15 1.35 1.35 ! 0.8326 326:10 Ambig 3.51, 5.03 A or (resid 129 and name HB2) (resid 131 and name HN) ! 0.1674 326:10 ----- 4.58, 4.89 A assign (resid 3 and name HB1) (resid 4 and name HN) 3.15 1.35 1.35 ! 0.0000 328:10 Seq 1.79, 2.67 A assign (resid 19 and name HB2) (resid 19 and name HN) 2.30 0.50 0.50 ! 0.0000 329:10 Intra 2.61, 2.75 A assign (resid 16 and name HB1) (resid 19 and name HN) 4.15 2.35 2.35 ! 0.0000 330:10 Mid 4.33, 5.14 A assign (resid 3 and name HB1) (resid 3 and name HN) 3.15 1.35 1.35 ! 0.0000 331:10 Intra 2.68, 3.64 A assign (resid 58 and name HB1) (resid 60 and name HN) 4.15 2.35 2.35 ! 0.5317 332:10 Ambig 5.03, 5.49 A or (resid 58 and name HB2) (resid 60 and name HN) ! 0.4683 332:10 ----- 5.14, 5.88 A assign (resid 84 and name HB1) (resid 84 and name HN) 3.15 1.35 1.35 ! 0.0000 333:10 Intra 2.56, 2.69 A assign (resid 48 and name HB2) (resid 47 and name HN) 3.65 1.85 1.85 ! 0.6280 334:10 Ambig 4.50, 4.74 A or (resid 106 and name HB1) (resid 47 and name HN) ! 0.3720 334:10 ----- 4.91, 5.66 A assign (resid 100 and name HB*) (resid 101 and name HN) 2.65 0.85 0.85 ! 0.9838 335:10 Seq 3.17, 3.80 A assign (resid 23 and name HB) (resid 101 and name HN) 3.65 1.85 1.85 ! 0.9348 336:10 Long 3.02, 3.45 A assign (resid 53 and name HB) (resid 101 and name HN) 3.65 1.85 1.85 ! 0.0000 337:10 Long 4.71, 4.92 A assign (resid 102 and name HB1) (resid 104 and name HN) 4.15 2.35 2.35 ! 0.7080 338:10 Ambig 5.75, 6.21 A or (resid 105 and name HB) (resid 104 and name HN) ! 0.2920 338:10 ----- 6.66, 6.74 A assign (resid 103 and name HB1) (resid 103 and name HN) 3.15 1.35 1.35 ! 0.0000 339:10 Intra 3.71, 3.75 A assign (resid 102 and name HB1) (resid 103 and name HN) 3.15 1.35 1.35 ! 0.0000 340:10 Seq 3.96, 4.18 A assign (resid 131 and name HB2) (resid 127 and name HN) 3.15 1.35 1.35 ! 0.9522 341:10 Mid 3.51, 3.93 A assign (resid 131 and name HB1) (resid 131 and name HN) 3.15 1.35 1.35 ! 0.0000 342:10 Intra 3.59, 3.66 A assign (resid 3 and name HB2) (resid 4 and name HN) 3.15 1.35 1.35 ! 0.0000 343:10 Seq 1.90, 3.37 A assign (resid 4 and name HG2) (resid 4 and name HN) 2.65 0.85 0.85 ! 0.9585 344:10 Intra 1.89, 2.71 A assign (resid 4 and name HB1) (resid 4 and name HN) 2.65 0.85 0.85 ! 0.9682 345:10 Intra 2.71, 3.18 A assign (resid 105 and name HB) (resid 19 and name HN) 2.65 0.85 0.85 ! 0.9865 346:10 Long 2.73, 3.01 A assign (resid 105 and name HG1*) (resid 19 and name HN) 3.15 1.35 1.35 ! 0.7170 347:10 Ambig 4.49, 5.26 A or (resid 17 and name HB1) (resid 19 and name HN) ! 0.2830 347:10 ----- 5.25, 5.43 A assign (resid 141 and name HB2) (resid 141 and name HN) 3.15 1.35 1.35 ! 0.9221 349:10 Intra 2.59, 3.11 A assign (resid 1 and name HB) (resid 1 and name HN) 2.65 0.85 0.85 ! 0.0000 352:10 Intra 2.51, 2.68 A assign (resid 76 and name HA1) (resid 77 and name HN) 3.15 1.35 1.35 ! 0.0000 353:10 Seq 3.08, 3.21 A assign (resid 75 and name HB1) (resid 77 and name HN) 4.15 2.35 2.35 ! 0.6221 354:10 Ambig 5.27, 5.47 A or (resid 78 and name HB) (resid 77 and name HN) ! 0.2126 354:10 ----- 6.30, 6.47 A or (resid 50 and name HB) (resid 77 and name HN) ! 0.1653 354:10 ----- 6.57, 7.23 A assign (resid 101 and name HG) (resid 101 and name HN) 2.65 0.85 0.85 ! 0.9718 355:10 Intra 2.21, 2.32 A assign (resid 22 and name HG2) (resid 101 and name HN) 3.15 1.35 1.35 ! 0.7168 356:10 Ambig 3.88, 4.21 A or (resid 22 and name HD2) (resid 101 and name HN) ! 0.1898 356:10 ----- 4.84, 5.70 A or (resid 8 and name HB1) (resid 26 and name HN) ! 0.0933 356:10 ----- 5.45, 6.15 A assign (resid 104 and name HB) (resid 104 and name HN) 2.65 0.85 0.85 ! 0.0000 357:10 Intra 2.47, 2.60 A assign (resid 104 and name HG12) (resid 104 and name HN) 3.15 1.35 1.35 ! 0.0000 358:10 Intra 3.49, 3.66 A assign (resid 51 and name HG*) (resid 104 and name HN) 3.15 1.35 1.35 ! 0.0000 359:10 Long 2.98, 4.05 A assign (resid 51 and name HB*) (resid 103 and name HN) 4.15 2.35 2.35 ! 0.8187 361:10 Ambig 4.61, 6.14 A or (resid 104 and name HG12) (resid 103 and name HN) ! 0.1813 361:10 ----- 5.93, 6.08 A assign (resid 22 and name HD1) (resid 103 and name HN) 4.15 2.35 2.35 ! 0.8387 362:10 Ambig 4.41, 6.73 A or (resid 22 and name HG2) (resid 103 and name HN) ! 0.1613 362:10 ----- 5.81, 6.30 A assign (resid 27 and name HD1*) (resid 28 and name HN) 3.15 1.35 1.35 ! 0.0000 363:10 Seq 4.73, 5.16 A assign (resid 92 and name HB) (resid 93 and name HN) 3.65 1.85 1.85 ! 0.0000 364:10 Seq 4.35, 4.39 A assign (resid 137 and name HB*) (resid 137 and name HN) 2.30 0.50 0.50 ! 0.4343 366:10 Ambig 2.52, 3.21 A or (resid 8 and name HB1) (resid 137 and name HN) ! 0.3666 366:10 ----- 2.59, 3.96 A or (resid 136 and name HB*) (resid 137 and name HN) ! 0.1990 366:10 ----- 2.87, 3.82 A assign (resid 133 and name HG12) (resid 127 and name HN) 3.65 1.85 1.85 ! 0.9383 367:10 Long 2.89, 3.41 A assign (resid 97 and name HB) (resid 97 and name HN) 2.30 0.50 0.50 ! 0.9266 368:10 Intra 2.38, 2.47 A assign (resid 126 and name HB*) (resid 131 and name HN) 2.65 0.85 0.85 ! 0.0000 369:10 Long 3.00, 4.33 A assign (resid 116 and name HG) (resid 141 and name HN) 3.15 1.35 1.35 ! 0.5122 371:10 Ambig 4.06, 4.61 A or (resid 141 and name HG2) (resid 141 and name HN) ! 0.3157 371:10 ----- 4.40, 4.57 A or (resid 141 and name HD1) (resid 141 and name HN) ! 0.1721 371:10 ----- 4.87, 5.51 A assign (resid 12 and name HG2*) (resid 141 and name HN) 3.15 1.35 1.35 ! 0.7322 373:10 Ambig 3.57, 4.95 A or (resid 141 and name HG1) (resid 141 and name HN) ! 0.1908 373:10 ----- 4.47, 4.70 A assign (resid 2 and name HB1) (resid 3 and name HN) 2.65 0.85 0.85 ! 0.9465 374:10 Seq 1.84, 2.72 A assign (resid 60 and name HB) (resid 60 and name HN) 2.30 0.50 0.50 ! 0.7751 375:10 Ambig 2.46, 2.59 A or (resid 59 and name HB1) (resid 60 and name HN) ! 0.1873 375:10 ----- 3.12, 3.29 A assign (resid 77 and name HB2) (resid 77 and name HN) 2.30 0.50 0.50 ! 0.8962 377:10 Ambig 2.52, 2.64 A or (resid 77 and name HB1) (resid 77 and name HN) ! 0.1038 377:10 ----- 3.61, 3.73 A assign (resid 77 and name HG2) (resid 77 and name HN) 3.15 1.35 1.35 ! 0.0000 378:10 Intra 3.81, 4.31 A assign (resid 77 and name HG1) (resid 77 and name HN) 3.15 1.35 1.35 ! 0.9507 379:10 Intra 3.10, 3.47 A assign (resid 109 and name HB*) (resid 47 and name HN) 4.15 2.35 2.35 ! 0.0000 380:10 Long 4.89, 6.09 A assign (resid 47 and name HG2) (resid 47 and name HN) 3.15 1.35 1.35 ! 0.9581 381:10 Intra 4.00, 4.44 A assign (resid 10 and name HG1*) (resid 26 and name HN) 2.65 0.85 0.85 ! 0.8452 382:10 Ambig 3.13, 4.46 A or (resid 26 and name HG2*) (resid 26 and name HN) ! 0.1104 382:10 ----- 4.39, 4.57 A assign (resid 104 and name HG21) (resid 104 and name HN) 3.15 1.35 1.35 ! 0.7566 383:10 Ambig 3.57, 4.58 A or (resid 104 and name HD11) (resid 104 and name HN) ! 0.2434 383:10 ----- 4.31, 4.62 A assign (resid 63 and name HG2*) (resid 64 and name HN) 3.65 1.85 1.85 ! 0.0000 384:10 Seq 4.43, 5.08 A assign (resid 21 and name HG1*) (resid 103 and name HN) 2.65 0.85 0.85 ! 0.9686 385:10 Long 3.21, 4.03 A assign (resid 27 and name HG11) (resid 28 and name HN) 2.65 0.85 0.85 ! 0.9020 386:10 Ambig 2.82, 2.93 A or (resid 27 and name HG2*) (resid 28 and name HN) ! 0.0980 386:10 ----- 4.08, 4.93 A assign (resid 94 and name HG2*) (resid 93 and name HN) 2.65 0.85 0.85 ! 0.9024 387:10 Ambig 2.59, 3.94 A or (resid 92 and name HG2*) (resid 93 and name HN) ! 0.0976 387:10 ----- 3.76, 4.38 A assign (resid 123 and name HD1*) (resid 137 and name HN) 4.15 2.35 2.35 ! 0.0000 388:10 Long 4.34, 5.93 A assign (resid 133 and name HG11) (resid 127 and name HN) 3.15 1.35 1.35 ! 0.8416 389:10 Ambig 2.76, 4.82 A or (resid 133 and name HG2*) (resid 127 and name HN) ! 0.1252 389:10 ----- 3.80, 5.19 A assign (resid 97 and name HD1*) (resid 97 and name HN) 2.30 0.50 0.50 ! 0.6841 390:10 Ambig 2.22, 3.30 A or (resid 97 and name HG12) (resid 97 and name HN) ! 0.3140 390:10 ----- 2.53, 4.06 A assign (resid 133 and name HD1*) (resid 127 and name HN) 3.15 1.35 1.35 ! 0.9152 391:10 Ambig 2.76, 4.40 A or (resid 123 and name HD1*) (resid 137 and name HN) ! 0.0606 391:10 ----- 4.34, 5.93 A assign (resid 59 and name HD1*) (resid 97 and name HN) 3.15 1.35 1.35 ! 0.0000 392:10 Long 3.22, 4.96 A assign (resid 6 and name HG2*) (resid 4 and name HN) 4.15 2.35 2.35 ! 0.9447 393:10 Mid 3.93, 5.67 A assign (resid 105 and name HG2*) (resid 19 and name HN) 3.15 1.35 1.35 ! 0.0000 395:10 Long 4.36, 5.17 A assign (resid 105 and name HD1*) (resid 19 and name HN) 3.15 1.35 1.35 ! 0.7136 396:10 Ambig 3.86, 5.10 A or (resid 104 and name HG2*) (resid 19 and name HN) ! 0.2554 396:10 ----- 4.58, 5.63 A assign (resid 60 and name HG2*) (resid 60 and name HN) 2.30 0.50 0.50 ! 0.9842 398:10 Intra 2.03, 3.06 A assign (resid 1 and name HG2*) (resid 1 and name HN) 2.30 0.50 0.50 ! 0.5684 399:10 Ambig 1.91, 3.99 A or (resid 1 and name HG1*) (resid 1 and name HN) ! 0.4316 399:10 ----- 2.00, 3.72 A assign (resid 36 and name HD2*) (resid 84 and name HN) 3.15 1.35 1.35 ! 0.5137 400:10 Ambig 3.33, 6.45 A or (resid 87 and name HD2*) (resid 84 and name HN) ! 0.3915 400:10 ----- 3.48, 5.06 A or (resid 83 and name HG2*) (resid 84 and name HN) ! 0.0948 400:10 ----- 4.41, 5.09 A assign (resid 47 and name HG1) (resid 47 and name HN) 3.65 1.85 1.85 ! 0.0000 401:10 Intra 2.83, 4.34 A assign (resid 47 and name HB*) (resid 47 and name HN) 2.65 0.85 0.85 ! 0.0000 402:10 Intra 2.33, 2.63 A assign (resid 92 and name HD1*) (resid 93 and name HN) 4.15 2.35 2.35 ! 0.0000 404:10 Seq 6.37, 6.72 A assign (resid 97 and name HG2*) (resid 97 and name HN) 3.15 1.35 1.35 ! 0.0000 405:10 Intra 4.18, 4.56 A assign (resid 30 and name HG2*) (resid 4 and name HN) 3.65 1.85 1.85 ! 0.0000 407:10 Long 6.23, 7.63 A assign (resid 12 and name HA) (resid 13 and name HN) 2.30 0.50 0.50 ! 0.0000 409:10 Seq 2.09, 2.13 A assign (resid 22 and name HN) (resid 21 and name HN) 3.65 1.85 1.85 ! 0.0000 410:10 Seq 4.33, 4.41 A assign (resid 73 and name HN) (resid 72 and name HN) 3.15 1.35 1.35 ! 0.0000 411:10 Seq 3.74, 3.99 A assign (resid 73 and name HB*) (resid 72 and name HN) 4.15 2.35 2.35 ! 0.0000 412:10 Seq 5.15, 6.05 A assign (resid 7 and name HA) (resid 7 and name HN) 2.65 0.85 0.85 ! 0.9738 413:10 Intra 2.86, 2.89 A assign (resid 73 and name HB*) (resid 73 and name HN) 2.65 0.85 0.85 ! 0.9982 415:10 Intra 2.24, 2.60 A assign (resid 29 and name HA) (resid 30 and name HN) 2.65 0.85 0.85 ! 0.8947 416:10 Ambig 2.85, 2.98 A or (resid 28 and name HB1) (resid 30 and name HN) ! 0.0580 416:10 ----- 4.49, 4.91 A assign (resid 107 and name HA) (resid 107 and name HN) 2.65 0.85 0.85 ! 0.0000 417:10 Intra 2.76, 2.86 A assign (resid 15 and name HA1) (resid 16 and name HN) 2.65 0.85 0.85 ! 0.5142 418:10 Ambig 2.46, 2.62 A or (resid 107 and name HB*) (resid 107 and name HN) ! 0.4858 418:10 ----- 2.48, 2.99 A assign (resid 103 and name HB2) (resid 21 and name HN) 3.15 1.35 1.35 ! 0.9573 419:10 Long 3.41, 3.66 A assign (resid 44 and name HB2) (resid 44 and name HN) 2.65 0.85 0.85 ! 0.0000 420:10 Intra 2.36, 2.63 A assign (resid 43 and name HB*) (resid 44 and name HN) 2.65 0.85 0.85 ! 0.6770 421:10 Ambig 2.17, 3.03 A or (resid 44 and name HB1) (resid 44 and name HN) ! 0.3230 421:10 ----- 2.45, 2.78 A assign (resid 71 and name HB2) (resid 72 and name HN) 3.65 1.85 1.85 ! 0.0000 422:10 Seq 4.09, 4.32 A assign (resid 71 and name HB1) (resid 72 and name HN) 3.15 1.35 1.35 ! 0.0000 423:10 Seq 4.02, 4.32 A assign (resid 29 and name HB1) (resid 30 and name HN) 3.15 1.35 1.35 ! 0.0000 425:10 Seq 4.29, 4.36 A assign (resid 56 and name HB2) (resid 57 and name HN) 3.65 1.85 1.85 ! 0.0000 426:10 Seq 2.97, 4.23 A assign (resid 38 and name HB2) (resid 39 and name HN) 3.15 1.35 1.35 ! 0.0000 427:10 Seq 4.11, 4.20 A assign (resid 38 and name HB1) (resid 39 and name HN) 3.15 1.35 1.35 ! 0.8746 428:10 Ambig 3.55, 4.03 A or (resid 84 and name HB1) (resid 92 and name HN) ! 0.1118 428:10 ----- 5.00, 5.79 A assign (resid 113 and name HB2) (resid 142 and name HN) 3.65 1.85 1.85 ! 0.4492 429:10 Ambig 4.42, 5.79 A or (resid 58 and name HB2) (resid 57 and name HN) ! 0.3211 429:10 ----- 4.68, 4.94 A or (resid 58 and name HB1) (resid 57 and name HN) ! 0.2297 429:10 ----- 4.95, 5.50 A assign (resid 106 and name HB1) (resid 107 and name HN) 3.15 1.35 1.35 ! 0.0000 430:10 Seq 2.45, 3.41 A assign (resid 19 and name HB1) (resid 16 and name HN) 2.30 0.50 0.50 ! 0.8792 431:10 Ambig 1.79, 2.12 A or (resid 16 and name HB2) (resid 16 and name HN) ! 0.1114 431:10 ----- 2.52, 3.27 A assign (resid 71 and name HB1) (resid 73 and name HN) 3.65 1.85 1.85 ! 0.0000 432:10 Mid 3.94, 4.50 A assign (resid 58 and name HB2) (resid 58 and name HN) 2.30 0.50 0.50 ! 0.6116 433:10 Ambig 2.28, 2.53 A or (resid 58 and name HB1) (resid 58 and name HN) ! 0.3884 433:10 ----- 2.46, 2.92 A assign (resid 58 and name HB1) (resid 59 and name HN) 2.65 0.85 0.85 ! 0.5431 434:10 Ambig 2.61, 3.15 A or (resid 58 and name HB2) (resid 59 and name HN) ! 0.4569 434:10 ----- 2.69, 3.57 A assign (resid 103 and name HB1) (resid 21 and name HN) 3.65 1.85 1.85 ! 0.0000 435:10 Long 4.40, 4.58 A assign (resid 29 and name HB2) (resid 30 and name HN) 3.15 1.35 1.35 ! 0.7319 437:10 Ambig 3.87, 4.00 A or (resid 4 and name HG1) (resid 30 and name HN) ! 0.1954 437:10 ----- 4.82, 5.91 A assign (resid 39 and name HG*) (resid 39 and name HN) 2.65 0.85 0.85 ! 0.9951 438:10 Intra 2.47, 3.04 A assign (resid 16 and name HB1) (resid 16 and name HN) 3.15 1.35 1.35 ! 0.0000 439:10 Intra 3.06, 3.51 A assign (resid 17 and name HB1) (resid 107 and name HN) 3.65 1.85 1.85 ! 0.7389 440:10 Ambig 4.44, 5.09 A or (resid 17 and name HG1) (resid 16 and name HN) ! 0.1126 440:10 ----- 6.07, 6.43 A or (resid 17 and name HG1) (resid 107 and name HN) ! 0.0874 440:10 ----- 6.33, 7.23 A assign (resid 141 and name HB2) (resid 142 and name HN) 3.15 1.35 1.35 ! 0.9694 441:10 Seq 3.98, 4.14 A assign (resid 120 and name HB2) (resid 121 and name HN) 3.15 1.35 1.35 ! 0.9489 442:10 Seq 2.89, 3.22 A assign (resid 7 and name HB*) (resid 7 and name HN) 2.30 0.50 0.50 ! 0.9601 443:10 Intra 2.35, 3.05 A assign (resid 120 and name HG*) (resid 121 and name HN) 2.65 0.85 0.85 ! 0.3469 444:10 Ambig 4.11, 4.43 A or (resid 120 and name HB1) (resid 121 and name HN) ! 0.3267 444:10 ----- 4.15, 4.33 A or (resid 56 and name HB1) (resid 57 and name HN) ! 0.3264 444:10 ----- 4.16, 4.36 A assign (resid 4 and name HG1) (resid 5 and name HN) 3.15 1.35 1.35 ! 0.5721 445:10 Ambig 3.27, 4.07 A or (resid 13 and name HB) (resid 13 and name HN) ! 0.2511 445:10 ----- 3.75, 3.78 A or (resid 29 and name HB2) (resid 5 and name HN) ! 0.1021 445:10 ----- 4.35, 5.34 A assign (resid 22 and name HB*) (resid 21 and name HN) 3.65 1.85 1.85 ! 0.0000 446:10 Seq 5.13, 5.87 A assign (resid 72 and name HG2*) (resid 72 and name HN) 3.15 1.35 1.35 ! 0.0000 447:10 Intra 2.63, 3.82 A assign (resid 30 and name HB) (resid 30 and name HN) 2.30 0.50 0.50 ! 0.8150 448:10 Ambig 2.70, 2.80 A or (resid 87 and name HB1) (resid 92 and name HN) ! 0.1788 448:10 ----- 3.47, 4.81 A assign (resid 92 and name HB) (resid 92 and name HN) 2.65 0.85 0.85 ! 0.7527 449:10 Ambig 2.50, 2.62 A or (resid 91 and name HB2) (resid 92 and name HN) ! 0.2473 449:10 ----- 3.02, 3.74 A assign (resid 39 and name HB*) (resid 39 and name HN) 2.65 0.85 0.85 ! 0.9556 450:10 Intra 3.36, 3.71 A assign (resid 57 and name HG2*) (resid 57 and name HN) 2.30 0.50 0.50 ! 0.0000 451:10 Intra 2.00, 3.30 A assign (resid 109 and name HB*) (resid 107 and name HN) 3.65 1.85 1.85 ! 0.0000 452:10 Mid 4.75, 5.65 A assign (resid 105 and name HG2*) (resid 16 and name HN) 3.15 1.35 1.35 ! 0.7447 453:10 Ambig 3.90, 5.45 A or (resid 144 and name HG2*) (resid 16 and name HN) ! 0.1474 453:10 ----- 5.11, 6.67 A or (resid 105 and name HG2*) (resid 107 and name HN) ! 0.1079 453:10 ----- 5.39, 6.61 A assign (resid 59 and name HB2) (resid 60 and name HN) 2.65 0.85 0.85 ! 0.0000 454:10 Seq 1.98, 2.13 A assign (resid 7 and name HG1) (resid 7 and name HN) 3.65 1.85 1.85 ! 0.9746 456:10 Intra 2.45, 2.75 A assign (resid 72 and name HG2*) (resid 73 and name HN) 3.15 1.35 1.35 ! 0.0000 457:10 Seq 3.75, 4.80 A assign (resid 12 and name HG2*) (resid 13 and name HN) 2.30 0.50 0.50 ! 0.9855 458:10 Seq 2.76, 3.50 A assign (resid 61 and name HD2) (resid 58 and name HN) 3.65 1.85 1.85 ! 0.4842 459:10 Ambig 4.99, 7.07 A or (resid 60 and name HB) (resid 58 and name HN) ! 0.3133 459:10 ----- 5.37, 5.74 A or (resid 59 and name HB1) (resid 58 and name HN) ! 0.2025 459:10 ----- 5.77, 6.06 A assign (resid 59 and name HB2) (resid 58 and name HN) 3.65 1.85 1.85 ! 0.7316 460:10 Ambig 4.39, 4.76 A or (resid 61 and name HG1) (resid 58 and name HN) ! 0.2684 460:10 ----- 5.18, 6.66 A assign (resid 59 and name HB1) (resid 59 and name HN) 3.15 1.35 1.35 ! 0.6184 461:10 Ambig 3.64, 3.70 A or (resid 61 and name HD2) (resid 59 and name HN) ! 0.2121 461:10 ----- 4.35, 6.45 A or (resid 60 and name HB) (resid 59 and name HN) ! 0.1695 461:10 ----- 4.51, 4.68 A assign (resid 59 and name HB2) (resid 59 and name HN) 2.65 0.85 0.85 ! 0.9981 462:10 Intra 2.51, 2.58 A assign (resid 104 and name HG11) (resid 21 and name HN) 4.15 2.35 2.35 ! 0.0000 463:10 Long 5.10, 5.50 A assign (resid 21 and name HG1*) (resid 21 and name HN) 2.30 0.50 0.50 ! 0.9834 464:10 Intra 2.10, 3.04 A assign (resid 105 and name HG1*) (resid 21 and name HN) 3.65 1.85 1.85 ! 0.0000 465:10 Long 3.12, 4.09 A assign (resid 47 and name HG2) (resid 44 and name HN) 4.15 2.35 2.35 ! 0.7494 466:10 Ambig 5.72, 6.50 A or (resid 142 and name HB) (resid 44 and name HN) ! 0.2506 466:10 ----- 6.86, 7.46 A assign (resid 41 and name HG2*) (resid 44 and name HN) 4.15 2.35 2.35 ! 0.0000 467:10 Mid 6.21, 7.31 A assign (resid 70 and name HG1*) (resid 72 and name HN) 3.15 1.35 1.35 ! 0.8725 468:10 Ambig 3.47, 4.98 A or (resid 78 and name HG2*) (resid 72 and name HN) ! 0.0965 468:10 ----- 5.01, 6.44 A assign (resid 6 and name HG2*) (resid 30 and name HN) 3.15 1.35 1.35 ! 0.8926 469:10 Ambig 2.89, 5.05 A or (resid 92 and name HG2*) (resid 92 and name HN) ! 0.0719 469:10 ----- 4.40, 4.59 A assign (resid 30 and name HG1*) (resid 30 and name HN) 2.30 0.50 0.50 ! 0.5786 470:10 Ambig 1.92, 2.85 A or (resid 92 and name HG11) (resid 92 and name HN) ! 0.4167 470:10 ----- 2.03, 2.23 A assign (resid 37 and name HG2*) (resid 39 and name HN) 3.15 1.35 1.35 ! 0.3869 471:10 Ambig 4.22, 5.48 A or (resid 39 and name HE*) (resid 39 and name HN) ! 0.1543 471:10 ----- 4.92, 5.96 A or (resid 41 and name HD1*) (resid 39 and name HN) ! 0.1379 471:10 ----- 5.01, 6.71 A or (resid 124 and name HD1*) (resid 39 and name HN) ! 0.0860 471:10 ----- 5.42, 7.69 A or (resid 41 and name HG11) (resid 39 and name HN) ! 0.0771 471:10 ----- 5.52, 6.31 A or (resid 94 and name HG2*) (resid 92 and name HN) ! 0.0618 471:10 ----- 5.73, 7.19 A or (resid 118 and name HG1*) (resid 39 and name HN) ! 0.0536 471:10 ----- 5.87, 6.51 A assign (resid 81 and name HG2*) (resid 39 and name HN) 3.15 1.35 1.35 ! 0.6463 472:10 Ambig 4.65, 5.78 A or (resid 124 and name HG11) (resid 39 and name HN) ! 0.1397 472:10 ----- 6.00, 6.47 A or (resid 34 and name HG2*) (resid 92 and name HN) ! 0.1382 472:10 ----- 6.01, 7.43 A assign (resid 105 and name HD1*) (resid 16 and name HN) 2.30 0.50 0.50 ! 0.9828 473:10 Long 2.15, 3.40 A assign (resid 116 and name HD1*) (resid 142 and name HN) 3.65 1.85 1.85 ! 0.0000 474:10 Long 4.67, 5.71 A assign (resid 142 and name HG2*) (resid 142 and name HN) 3.15 1.35 1.35 ! 0.0000 475:10 Intra 4.32, 4.62 A assign (resid 5 and name HG2*) (resid 5 and name HN) 2.30 0.50 0.50 ! 0.4677 476:10 Ambig 2.09, 4.32 A or (resid 13 and name HG2*) (resid 13 and name HN) ! 0.4523 476:10 ----- 2.11, 2.98 A assign (resid 142 and name HG2*) (resid 13 and name HN) 3.15 1.35 1.35 ! 0.0000 477:10 Long 4.48, 5.53 A assign (resid 59 and name HD2*) (resid 59 and name HN) 2.65 0.85 0.85 ! 0.8570 479:10 Ambig 2.90, 4.22 A or (resid 60 and name HG2*) (resid 59 and name HN) ! 0.1358 479:10 ----- 3.94, 5.23 A assign (resid 142 and name HG11) (resid 142 and name HN) 3.15 1.35 1.35 ! 0.0000 480:10 Intra 2.58, 2.69 A assign (resid 42 and name HA) (resid 43 and name HN) 2.65 0.85 0.85 ! 0.0000 481:10 Seq 2.10, 2.17 A assign (resid 14 and name HA) (resid 14 and name HN) 3.15 1.35 1.35 ! 0.0000 482:10 Intra 2.89, 2.92 A assign (resid 43 and name HD*) (resid 43 and name HN) 3.65 1.85 1.85 ! 0.0000 483:10 Intra 2.34, 3.65 A assign (resid 61 and name HG2) (resid 62 and name HN) 3.65 1.85 1.85 ! 0.0000 484:10 Seq 2.12, 3.99 A assign (resid 92 and name HA) (resid 94 and name HN) 3.65 1.85 1.85 ! 0.9486 485:10 Mid 3.08, 3.26 A assign (resid 114 and name HB1) (resid 114 and name HN) 3.65 1.85 1.85 ! 0.0000 486:10 Intra 2.77, 3.66 A assign (resid 42 and name HB*) (resid 43 and name HN) 3.15 1.35 1.35 ! 0.0000 487:10 Seq 3.09, 3.74 A assign (resid 107 and name HA) (resid 108 and name HN) 2.65 0.85 0.85 ! 0.9822 488:10 Seq 3.25, 3.41 A assign (resid 14 and name HB*) (resid 14 and name HN) 2.65 0.85 0.85 ! 0.9975 489:10 Intra 2.59, 3.24 A assign (resid 55 and name HA) (resid 56 and name HN) 2.65 0.85 0.85 ! 0.0000 490:10 Seq 2.17, 2.22 A assign (resid 113 and name HB2) (resid 114 and name HN) 3.15 1.35 1.35 ! 0.0000 491:10 Seq 2.98, 3.78 A assign (resid 43 and name HB*) (resid 43 and name HN) 3.15 1.35 1.35 ! 0.0000 492:10 Intra 3.09, 3.55 A assign (resid 108 and name HB2) (resid 108 and name HN) 2.30 0.50 0.50 ! 0.0000 493:10 Intra 2.54, 2.69 A assign (resid 108 and name HB1) (resid 108 and name HN) 2.30 0.50 0.50 ! 0.0000 494:10 Intra 2.38, 2.53 A assign (resid 129 and name HB2) (resid 129 and name HN) 2.65 0.85 0.85 ! 0.9934 495:10 Intra 2.53, 2.68 A assign (resid 129 and name HB1) (resid 129 and name HN) 2.30 0.50 0.50 ! 0.9783 496:10 Intra 2.37, 2.47 A assign (resid 52 and name HB1) (resid 53 and name HN) 3.15 1.35 1.35 ! 0.0000 497:10 Seq 2.04, 3.57 A assign (resid 52 and name HB2) (resid 53 and name HN) 3.15 1.35 1.35 ! 0.0000 498:10 Seq 2.07, 2.25 A assign (resid 98 and name HG) (resid 56 and name HN) 4.15 2.35 2.35 ! 0.5702 499:10 Ambig 4.67, 4.80 A or (resid 59 and name HG) (resid 56 and name HN) ! 0.4298 499:10 ----- 4.90, 5.43 A assign (resid 65 and name HB2) (resid 65 and name HN) 3.15 1.35 1.35 ! 0.0000 500:10 Intra 2.11, 2.39 A assign (resid 95 and name HB1) (resid 95 and name HN) 3.15 1.35 1.35 ! 0.0000 501:10 Intra 2.33, 2.83 A assign (resid 64 and name HB1) (resid 65 and name HN) 3.15 1.35 1.35 ! 0.0000 502:10 Seq 2.60, 3.02 A assign (resid 141 and name HB2) (resid 114 and name HN) 4.15 2.35 2.35 ! 0.0000 504:10 Long 5.20, 5.82 A assign (resid 13 and name HB) (resid 14 and name HN) 2.30 0.50 0.50 ! 0.0000 505:10 Seq 2.36, 2.46 A assign (resid 53 and name HB) (resid 53 and name HN) 3.15 1.35 1.35 ! 0.0000 506:10 Intra 3.78, 3.83 A assign (resid 87 and name HB2) (resid 87 and name HN) 3.15 1.35 1.35 ! 0.9260 507:10 Intra 3.60, 3.62 A assign (resid 95 and name HB2) (resid 95 and name HN) 3.15 1.35 1.35 ! 0.0000 508:10 Intra 2.54, 3.65 A assign (resid 65 and name HB1) (resid 65 and name HN) 3.15 1.35 1.35 ! 0.0000 509:10 Intra 3.11, 3.57 A assign (resid 94 and name HB) (resid 95 and name HN) 2.30 0.50 0.50 ! 0.0000 510:10 Seq 2.34, 2.61 A assign (resid 56 and name HB1) (resid 56 and name HN) 2.65 0.85 0.85 ! 0.9984 511:10 Intra 2.36, 2.45 A assign (resid 94 and name HB) (resid 94 and name HN) 3.15 1.35 1.35 ! 0.0000 512:10 Intra 3.70, 3.79 A assign (resid 61 and name HB1) (resid 62 and name HN) 2.65 0.85 0.85 ! 0.0000 513:10 Seq 1.90, 3.10 A assign (resid 141 and name HG2) (resid 114 and name HN) 3.65 1.85 1.85 ! 0.7609 514:10 Ambig 2.98, 3.68 A or (resid 141 and name HD1) (resid 114 and name HN) ! 0.2028 514:10 ----- 3.71, 5.50 A assign (resid 62 and name HB1) (resid 62 and name HN) 3.15 1.35 1.35 ! 0.6445 515:10 Ambig 3.54, 3.76 A or (resid 57 and name HG2*) (resid 62 and name HN) ! 0.3555 515:10 ----- 3.91, 6.00 A assign (resid 141 and name HG1) (resid 114 and name HN) 2.65 0.85 0.85 ! 0.4978 516:10 Ambig 3.02, 3.50 A or (resid 144 and name HG2*) (resid 114 and name HN) ! 0.2650 516:10 ----- 3.35, 4.84 A or (resid 142 and name HB) (resid 114 and name HN) ! 0.1828 516:10 ----- 3.57, 3.79 A assign (resid 45 and name HB*) (resid 43 and name HN) 3.65 1.85 1.85 ! 0.9157 517:10 Ambig 5.08, 6.44 A or (resid 116 and name HG) (resid 43 and name HN) ! 0.0843 517:10 ----- 7.56, 7.88 A assign (resid 77 and name HB1) (resid 43 and name HN) 4.15 2.35 2.35 ! 0.7122 518:10 Ambig 5.51, 5.96 A or (resid 77 and name HD*) (resid 43 and name HN) ! 0.2878 518:10 ----- 6.41, 7.03 A assign (resid 128 and name HB1) (resid 129 and name HN) 3.65 1.85 1.85 ! 0.8428 520:10 Ambig 4.03, 4.25 A or (resid 133 and name HG12) (resid 129 and name HN) ! 0.0713 520:10 ----- 6.08, 6.91 A or (resid 131 and name HD*) (resid 129 and name HN) ! 0.0556 520:10 ----- 6.33, 7.40 A assign (resid 54 and name HG) (resid 53 and name HN) 3.65 1.85 1.85 ! 0.8446 521:10 Ambig 4.67, 5.15 A or (resid 54 and name HB2) (resid 53 and name HN) ! 0.1554 521:10 ----- 6.19, 6.42 A assign (resid 72 and name HG2*) (resid 53 and name HN) 4.15 2.35 2.35 ! 0.5197 522:10 Ambig 5.91, 7.08 A or (resid 99 and name HB*) (resid 53 and name HN) ! 0.4803 522:10 ----- 5.99, 7.30 A assign (resid 87 and name HB1) (resid 87 and name HN) 2.65 0.85 0.85 ! 0.9943 523:10 Intra 2.65, 2.71 A assign (resid 87 and name HG) (resid 87 and name HN) 2.65 0.85 0.85 ! 0.9891 524:10 Intra 2.00, 2.10 A assign (resid 88 and name HB*) (resid 87 and name HN) 3.65 1.85 1.85 ! 0.0000 525:10 Seq 4.99, 5.66 A assign (resid 60 and name HB) (resid 56 and name HN) 3.65 1.85 1.85 ! 0.8385 526:10 Ambig 3.76, 4.21 A or (resid 54 and name HB2) (resid 56 and name HN) ! 0.0926 526:10 ----- 5.43, 6.05 A assign (resid 30 and name HB) (resid 95 and name HN) 4.15 2.35 2.35 ! 0.0000 527:10 Long 6.09, 6.42 A assign (resid 94 and name HG2*) (resid 94 and name HN) 2.30 0.50 0.50 ! 0.9090 529:10 Ambig 2.10, 3.02 A or (resid 92 and name HG2*) (resid 94 and name HN) ! 0.0910 529:10 ----- 3.08, 3.96 A assign (resid 116 and name HD2*) (resid 43 and name HN) 3.65 1.85 1.85 ! 0.0000 530:10 Long 4.97, 6.12 A assign (resid 21 and name HG1*) (resid 14 and name HN) 4.15 2.35 2.35 ! 0.5323 531:10 Ambig 6.21, 7.43 A or (resid 105 and name HD1*) (resid 14 and name HN) ! 0.4677 531:10 ----- 6.35, 7.34 A assign (resid 53 and name HG2*) (resid 53 and name HN) 2.30 0.50 0.50 ! 0.7137 532:10 Ambig 2.23, 3.18 A or (resid 53 and name HG1*) (resid 53 and name HN) ! 0.1881 532:10 ----- 2.78, 3.72 A or (resid 70 and name HG1*) (resid 53 and name HN) ! 0.0913 532:10 ----- 3.14, 4.70 A assign (resid 87 and name HD1*) (resid 87 and name HN) 2.65 0.85 0.85 ! 0.7153 533:10 Ambig 3.21, 4.06 A or (resid 87 and name HD2*) (resid 87 and name HN) ! 0.2847 533:10 ----- 3.75, 4.34 A assign (resid 99 and name HB*) (resid 56 and name HN) 2.65 0.85 0.85 ! 0.9505 534:10 Long 3.71, 4.45 A assign (resid 94 and name HG2*) (resid 95 and name HN) 2.65 0.85 0.85 ! 0.5992 535:10 Ambig 3.49, 4.56 A or (resid 94 and name HG1*) (resid 95 and name HN) ! 0.4008 535:10 ----- 3.73, 4.51 A assign (resid 60 and name HG2*) (resid 56 and name HN) 2.65 0.85 0.85 ! 0.9395 536:10 Mid 3.20, 4.39 A assign (resid 30 and name HG1*) (resid 94 and name HN) 3.15 1.35 1.35 ! 0.7633 537:10 Ambig 3.11, 4.23 A or (resid 30 and name HG2*) (resid 94 and name HN) ! 0.2212 537:10 ----- 3.82, 5.01 A assign (resid 137 and name HA) (resid 138 and name HN) 2.30 0.50 0.50 ! 0.0000 539:10 Seq 2.18, 2.21 A assign (resid 48 and name HA) (resid 48 and name HN) 3.15 1.35 1.35 ! 0.0000 540:10 Intra 2.92, 2.94 A assign (resid 117 and name HB) (resid 117 and name HN) 3.15 1.35 1.35 ! 0.0000 542:10 Intra 2.47, 2.57 A assign (resid 87 and name HA) (resid 88 and name HN) 3.15 1.35 1.35 ! 0.0000 543:10 Seq 3.31, 3.37 A assign (resid 98 and name HA) (resid 99 and name HN) 3.65 1.85 1.85 ! 0.0000 544:10 Seq 3.55, 3.56 A assign (resid -2 and name HB*) (resid -2 and name HN) 2.65 0.85 0.85 ! 0.6235 545:10 Ambig 2.38, 3.26 A or (resid 138 and name HB2) (resid 138 and name HN) ! 0.3644 545:10 ----- 2.60, 2.90 A assign (resid 138 and name HB1) (resid 138 and name HN) 3.15 1.35 1.35 ! 0.0000 546:10 Intra 3.18, 3.76 A assign (resid 49 and name HB) (resid 49 and name HN) 2.65 0.85 0.85 ! 0.7532 547:10 Ambig 2.61, 2.72 A or (resid 26 and name HB) (resid 9 and name HN) ! 0.2420 547:10 ----- 3.16, 3.33 A assign (resid 9 and name HB1) (resid 9 and name HN) 3.15 1.35 1.35 ! 0.0000 548:10 Intra 2.55, 2.76 A assign (resid 20 and name HB) (resid 20 and name HN) 2.65 0.85 0.85 ! 0.9986 549:10 Intra 2.49, 2.58 A assign (resid 42 and name HB*) (resid 117 and name HN) 3.65 1.85 1.85 ! 0.9867 550:10 Long 3.19, 4.24 A assign (resid 17 and name HA) (resid 18 and name HN) 2.65 0.85 0.85 ! 0.9995 551:10 Seq 2.12, 2.17 A assign (resid 17 and name HB2) (resid 18 and name HN) 3.15 1.35 1.35 ! 0.9258 552:10 Seq 3.73, 3.99 A assign (resid 47 and name HA) (resid 48 and name HN) 3.65 1.85 1.85 ! 0.9407 553:10 Seq 3.45, 3.52 A assign (resid 97 and name HA) (resid 99 and name HN) 3.65 1.85 1.85 ! 0.9807 554:10 Mid 4.10, 4.25 A assign (resid 48 and name HB2) (resid 49 and name HN) 3.15 1.35 1.35 ! 0.9443 555:10 Seq 3.44, 3.84 A assign (resid 19 and name HB2) (resid 20 and name HN) 3.15 1.35 1.35 ! 0.0000 556:10 Seq 3.83, 4.02 A assign (resid 19 and name HB1) (resid 20 and name HN) 3.15 1.35 1.35 ! 0.9556 557:10 Seq 3.52, 3.90 A assign (resid 130 and name HB1) (resid 130 and name HN) 2.65 0.85 0.85 ! 0.0000 558:10 Intra 3.11, 3.27 A assign (resid 130 and name HB2) (resid 130 and name HN) 2.65 0.85 0.85 ! 0.6919 559:10 Ambig 3.07, 3.77 A or (resid 129 and name HB1) (resid 130 and name HN) ! 0.3081 559:10 ----- 3.51, 3.69 A assign (resid 16 and name HB2) (resid 16 and name HD21) 3.15 1.35 1.35 ! 0.7504 561:10 Ambig 2.28, 2.86 A or (resid 19 and name HB1) (resid 16 and name HD21) ! 0.2496 561:10 ----- 2.74, 3.53 A assign (resid 48 and name HB2) (resid 48 and name HN) 2.65 0.85 0.85 ! 0.9720 562:10 Intra 2.64, 2.73 A assign (resid 65 and name HB2) (resid 65 and name HD21) 2.65 0.85 0.85 ! 0.0000 563:10 Intra 2.13, 2.33 A assign (resid 139 and name HB2) (resid 139 and name HD22) 3.65 1.85 1.85 ! 0.0000 564:10 Intra 3.45, 3.69 A assign (resid 129 and name HB2) (resid 129 and name HD21) 2.65 0.85 0.85 ! 0.5274 565:10 Ambig 2.82, 2.97 A or (resid 131 and name HE*) (resid 129 and name HD21) ! 0.4726 565:10 ----- 2.88, 5.07 A assign (resid 139 and name HB1) (resid 139 and name HD22) 3.15 1.35 1.35 ! 0.9842 566:10 Intra 3.43, 3.92 A assign (resid 129 and name HB1) (resid 129 and name HD21) 2.30 0.50 0.50 ! 0.9874 567:10 Intra 2.15, 2.21 A assign (resid 19 and name HB1) (resid 16 and name HD22) 3.15 1.35 1.35 ! 0.6788 568:10 Ambig 3.10, 4.23 A or (resid 16 and name HB2) (resid 16 and name HD22) ! 0.3212 568:10 ----- 3.51, 3.77 A assign (resid 129 and name HB2) (resid 129 and name HD22) 3.15 1.35 1.35 ! 0.0000 569:10 Intra 3.73, 3.80 A assign (resid 129 and name HB1) (resid 129 and name HD22) 2.65 0.85 0.85 ! 0.0000 570:10 Intra 3.45, 3.48 A assign (resid 100 and name HB*) (resid 100 and name HN) 2.30 0.50 0.50 ! 0.9982 571:10 Intra 2.44, 3.13 A assign (resid 89 and name HB2) (resid 89 and name HN) 2.65 0.85 0.85 ! 0.9419 572:10 Intra 2.36, 2.51 A assign (resid 16 and name HB1) (resid 16 and name HD21) 2.65 0.85 0.85 ! 0.0000 574:10 Intra 2.14, 2.93 A assign (resid 105 and name HB) (resid 18 and name HN) 2.65 0.85 0.85 ! 0.9899 575:10 Long 2.44, 2.70 A assign (resid 17 and name HB1) (resid 18 and name HN) 3.15 1.35 1.35 ! 0.8589 576:10 Ambig 3.60, 3.84 A or (resid 17 and name HG1) (resid 18 and name HN) ! 0.1411 576:10 ----- 4.86, 5.27 A assign (resid 48 and name HB1) (resid 48 and name HN) 3.15 1.35 1.35 ! 0.0000 577:10 Intra 3.75, 3.81 A assign (resid 64 and name HB1) (resid 65 and name HD21) 4.15 2.35 2.35 ! 0.0000 578:10 Seq 2.91, 4.50 A assign (resid 65 and name HB1) (resid 65 and name HD21) 2.65 0.85 0.85 ! 0.0000 579:10 Intra 2.25, 3.20 A assign (resid 131 and name HB1) (resid 129 and name HD21) 3.65 1.85 1.85 ! 0.5336 580:10 Ambig 4.22, 4.88 A or (resid 118 and name HB) (resid 139 and name HD21) ! 0.3290 580:10 ----- 4.57, 5.87 A or (resid 141 and name HB2) (resid 139 and name HD21) ! 0.1374 580:10 ----- 5.29, 6.28 A assign (resid 16 and name HB1) (resid 16 and name HD22) 3.15 1.35 1.35 ! 0.0000 581:10 Intra 3.44, 3.79 A assign (resid 65 and name HB1) (resid 65 and name HD22) 3.15 1.35 1.35 ! 0.0000 582:10 Intra 3.49, 3.92 A assign (resid 131 and name HB2) (resid 129 and name HD22) 3.65 1.85 1.85 ! 0.5870 583:10 Ambig 4.43, 5.04 A or (resid 85 and name HG2) (resid 65 and name HD22) ! 0.3591 583:10 ----- 4.80, 5.90 A assign (resid 8 and name HB2) (resid 138 and name HN) 4.15 2.35 2.35 ! 0.4205 584:10 Ambig 5.67, 6.92 A or (resid 8 and name HG) (resid 138 and name HN) ! 0.3630 584:10 ----- 5.81, 7.32 A or (resid 123 and name HB1) (resid 138 and name HN) ! 0.2165 584:10 ----- 6.33, 7.34 A assign (resid 137 and name HB*) (resid 138 and name HN) 2.65 0.85 0.85 ! 0.7451 586:10 Ambig 3.61, 4.15 A or (resid 136 and name HB*) (resid 138 and name HN) ! 0.2549 586:10 ----- 4.31, 5.35 A assign (resid 88 and name HB*) (resid 89 and name HN) 2.30 0.50 0.50 ! 0.9818 587:10 Seq 2.78, 3.64 A assign (resid 104 and name HB) (resid 49 and name HN) 2.65 0.85 0.85 ! 0.7127 588:10 Ambig 2.85, 3.16 A or (resid 8 and name HG) (resid 9 and name HN) ! 0.2119 588:10 ----- 3.48, 4.96 A assign (resid 8 and name HB1) (resid 9 and name HN) 3.15 1.35 1.35 ! 0.7952 589:10 Ambig 3.12, 3.66 A or (resid 49 and name HG2*) (resid 49 and name HN) ! 0.0972 589:10 ----- 4.43, 4.64 A or (resid 51 and name HG*) (resid 49 and name HN) ! 0.0387 589:10 ----- 5.17, 6.33 A assign (resid 128 and name HB1) (resid 130 and name HN) 4.15 2.35 2.35 ! 0.4756 591:10 Ambig 5.16, 5.29 A or (resid 36 and name HB2) (resid 130 and name HN) ! 0.4366 591:10 ----- 5.23, 6.10 A or (resid 133 and name HG12) (resid 130 and name HN) ! 0.0877 591:10 ----- 6.84, 7.06 A assign (resid 126 and name HB*) (resid 130 and name HN) 3.15 1.35 1.35 ! 0.0000 592:10 Mid 3.71, 4.85 A assign (resid 116 and name HB2) (resid 117 and name HN) 3.15 1.35 1.35 ! 0.8025 594:10 Ambig 3.55, 4.05 A or (resid 115 and name HB*) (resid 117 and name HN) ! 0.1115 594:10 ----- 4.93, 5.83 A or (resid 116 and name HG) (resid 117 and name HN) ! 0.0860 594:10 ----- 5.15, 5.32 A assign (resid 117 and name HG2*) (resid 117 and name HN) 3.15 1.35 1.35 ! 0.0000 595:10 Intra 4.40, 4.56 A assign (resid 109 and name HB*) (resid 18 and name HN) 3.65 1.85 1.85 ! 0.0000 596:10 Long 4.23, 5.57 A assign (resid 109 and name HB*) (resid 48 and name HN) 3.65 1.85 1.85 ! 0.8337 597:10 Ambig 4.92, 6.07 A or (resid 49 and name HG2*) (resid 48 and name HN) ! 0.1663 597:10 ----- 6.43, 7.42 A assign (resid 47 and name HG2) (resid 48 and name HN) 3.65 1.85 1.85 ! 0.9104 598:10 Ambig 3.96, 4.30 A or (resid 105 and name HG2*) (resid 48 and name HN) ! 0.0896 598:10 ----- 5.83, 6.94 A assign (resid 87 and name HB1) (resid 88 and name HN) 3.65 1.85 1.85 ! 0.8916 599:10 Ambig 4.32, 4.41 A or (resid 128 and name HB1) (resid 88 and name HN) ! 0.1084 599:10 ----- 6.14, 6.77 A assign (resid 87 and name HG) (resid 88 and name HN) 3.15 1.35 1.35 ! 0.7857 600:10 Ambig 3.38, 3.51 A or (resid 86 and name HG2*) (resid 88 and name HN) ! 0.1752 600:10 ----- 4.34, 5.53 A assign (resid 88 and name HB*) (resid 88 and name HN) 2.30 0.50 0.50 ! 0.0000 601:10 Intra 2.45, 2.93 A assign (resid 131 and name HD*) (resid 129 and name HD21) 3.65 1.85 1.85 ! 0.9239 602:10 Mid 3.87, 4.99 A assign (resid 115 and name HB*) (resid 139 and name HD21) 3.15 1.35 1.35 ! 0.6354 603:10 Ambig 2.24, 4.43 A or (resid 131 and name HG1) (resid 129 and name HD21) ! 0.3421 603:10 ----- 2.49, 2.86 A assign (resid 117 and name HG2*) (resid 139 and name HD21) 3.15 1.35 1.35 ! 0.9931 604:10 Long 2.15, 4.20 A assign (resid 117 and name HG2*) (resid 139 and name HD22) 3.15 1.35 1.35 ! 0.9932 605:10 Long 2.34, 4.59 A assign (resid 25 and name HB) (resid 99 and name HN) 2.65 0.85 0.85 ! 0.9962 606:10 Long 2.20, 2.32 A assign (resid 98 and name HG) (resid 99 and name HN) 2.65 0.85 0.85 ! 0.6174 607:10 Ambig 3.35, 3.56 A or (resid 98 and name HB2) (resid 99 and name HN) ! 0.3826 607:10 ----- 3.63, 3.73 A assign (resid 99 and name HB*) (resid 99 and name HN) 2.65 0.85 0.85 ! 0.0000 608:10 Intra 2.87, 3.39 A assign (resid 131 and name HD*) (resid 129 and name HD22) 3.65 1.85 1.85 ! 0.8904 609:10 Ambig 3.55, 4.98 A or (resid 61 and name HB1) (resid 65 and name HD22) ! 0.1096 609:10 ----- 5.03, 7.76 A assign (resid 131 and name HG1) (resid 129 and name HD22) 3.65 1.85 1.85 ! 0.0000 610:10 Mid 2.87, 3.32 A assign (resid 99 and name HB*) (resid 100 and name HN) 2.30 0.50 0.50 ! 0.0000 611:10 Seq 2.51, 3.37 A assign (resid 10 and name HG2*) (resid 138 and name HN) 3.15 1.35 1.35 ! 0.5753 612:10 Ambig 4.63, 5.39 A or (resid 118 and name HG2*) (resid 138 and name HN) ! 0.2364 612:10 ----- 5.37, 6.13 A or (resid 118 and name HG1*) (resid 138 and name HN) ! 0.1883 612:10 ----- 5.58, 6.36 A assign (resid 8 and name HD1*) (resid 9 and name HN) 2.65 0.85 0.85 ! 0.8875 613:10 Ambig 2.18, 3.99 A or (resid 8 and name HD2*) (resid 9 and name HN) ! 0.0964 613:10 ----- 3.16, 5.32 A assign (resid 87 and name HD1*) (resid 89 and name HN) 3.65 1.85 1.85 ! 0.6969 614:10 Ambig 4.38, 5.60 A or (resid 87 and name HD2*) (resid 129 and name HN) ! 0.1789 614:10 ----- 5.50, 6.74 A or (resid 87 and name HD1*) (resid 129 and name HN) ! 0.0921 614:10 ----- 6.14, 7.50 A assign (resid 20 and name HG2*) (resid 20 and name HN) 3.15 1.35 1.35 ! 0.0000 615:10 Intra 4.37, 4.56 A assign (resid 104 and name HG2*) (resid 20 and name HN) 3.65 1.85 1.85 ! 0.8159 616:10 Ambig 4.65, 5.94 A or (resid 104 and name HD1*) (resid 20 and name HN) ! 0.0957 616:10 ----- 6.64, 7.77 A or (resid 21 and name HG2*) (resid 20 and name HN) ! 0.0884 616:10 ----- 6.73, 7.48 A assign (resid 1 and name HG2*) (resid 0 and name HN) 4.15 2.35 2.35 ! 0.5651 618:10 Ambig 3.34, 6.48 A or (resid 1 and name HG1*) (resid 0 and name HN) ! 0.4006 618:10 ----- 3.53, 6.83 A assign (resid 41 and name HG2*) (resid 117 and name HN) 3.15 1.35 1.35 ! 0.7187 619:10 Ambig 3.97, 4.75 A or (resid 118 and name HG2*) (resid 117 and name HN) ! 0.2145 619:10 ----- 4.85, 5.76 A assign (resid 116 and name HD2*) (resid 117 and name HN) 3.15 1.35 1.35 ! 0.0000 620:10 Seq 4.40, 5.12 A assign (resid 105 and name HG2*) (resid 18 and name HN) 2.65 0.85 0.85 ! 0.9929 621:10 Long 3.02, 4.15 A assign (resid 104 and name HG2*) (resid 18 and name HN) 3.15 1.35 1.35 ! 0.8178 622:10 Ambig 3.69, 4.82 A or (resid 105 and name HD1*) (resid 18 and name HN) ! 0.1822 622:10 ----- 4.74, 5.67 A assign (resid 47 and name HG1) (resid 48 and name HN) 3.65 1.85 1.85 ! 0.0000 623:10 Seq 4.55, 4.96 A assign (resid 47 and name HB*) (resid 48 and name HN) 2.30 0.50 0.50 ! 0.9955 624:10 Seq 2.63, 3.36 A assign (resid 87 and name HD1*) (resid 88 and name HN) 2.65 0.85 0.85 ! 0.9949 625:10 Seq 2.28, 3.49 A assign (resid 10 and name HG2*) (resid 139 and name HD21) 4.15 2.35 2.35 ! 0.0000 626:10 Long 5.42, 6.86 A assign (resid 25 and name HG2*) (resid 99 and name HN) 2.65 0.85 0.85 ! 0.5456 627:10 Ambig 3.68, 4.45 A or (resid 25 and name HG1*) (resid 99 and name HN) ! 0.2808 627:10 ----- 4.11, 4.65 A or (resid 97 and name HD1*) (resid 99 and name HN) ! 0.0514 627:10 ----- 5.45, 7.16 A or (resid 101 and name HD2*) (resid 99 and name HN) ! 0.0465 627:10 ----- 5.54, 6.45 A assign (resid 97 and name HG2*) (resid 100 and name HN) 3.65 1.85 1.85 ! 0.0000 628:10 Mid 4.23, 4.78 A assign (resid 97 and name HG2*) (resid 99 and name HN) 2.65 0.85 0.85 ! 0.0000 629:10 Mid 2.50, 3.30 A assign (resid 29 and name HA) (resid 29 and name HN) 2.30 0.50 0.50 ! 0.5481 630:10 Ambig 2.16, 2.21 A or (resid 28 and name HB1) (resid 29 and name HN) ! 0.4170 630:10 ----- 2.26, 2.65 A assign (resid 46 and name HB1) (resid 46 and name HN) 2.65 0.85 0.85 ! 0.5040 631:10 Ambig 2.44, 3.37 A or (resid 46 and name HB2) (resid 46 and name HN) ! 0.4960 631:10 ----- 2.45, 2.63 A assign (resid 127 and name HB2) (resid 128 and name HN) 2.65 0.85 0.85 ! 0.9896 632:10 Seq 1.98, 2.25 A assign (resid 29 and name HA) (resid 29 and name HE21) 3.65 1.85 1.85 ! 0.0000 633:10 Intra 3.89, 4.19 A assign (resid 50 and name HA) (resid 52 and name HN) 3.15 1.35 1.35 ! 0.0000 634:10 Mid 4.01, 4.17 A assign (resid 29 and name HA) (resid 29 and name HE22) 4.15 2.35 2.35 ! 0.0000 635:10 Intra 3.86, 5.34 A assign (resid 29 and name HB1) (resid 29 and name HN) 3.15 1.35 1.35 ! 0.0000 636:10 Intra 4.05, 4.10 A assign (resid 56 and name HB2) (resid 56 and name HD22) 3.15 1.35 1.35 ! 0.0000 637:10 Intra 3.47, 3.81 A assign (resid 58 and name HB2) (resid 56 and name HD22) 3.15 1.35 1.35 ! 0.5012 638:10 Ambig 1.80, 2.80 A or (resid 58 and name HB1) (resid 56 and name HD22) ! 0.4988 638:10 ----- 1.80, 2.49 A assign (resid 127 and name HB1) (resid 128 and name HN) 3.15 1.35 1.35 ! 0.0000 639:10 Seq 3.09, 3.55 A assign (resid 29 and name HB1) (resid 29 and name HE21) 2.65 0.85 0.85 ! 0.0000 640:10 Intra 1.79, 2.48 A assign (resid 47 and name HE*) (resid 110 and name HN) 2.65 0.85 0.85 ! 0.9940 641:10 Long 2.09, 3.47 A assign (resid 71 and name HB2) (resid 71 and name HD21) 3.15 1.35 1.35 ! 0.0000 642:10 Intra 2.19, 2.84 A assign (resid 3 and name HB1) (resid 3 and name HD21) 2.65 0.85 0.85 ! 0.0000 643:10 Intra 2.15, 2.58 A assign (resid 51 and name HE*) (resid 52 and name HN) 3.15 1.35 1.35 ! 0.5634 644:10 Ambig 3.30, 5.77 A or (resid 52 and name HB1) (resid 52 and name HN) ! 0.4366 644:10 ----- 3.45, 3.62 A assign (resid 52 and name HB2) (resid 52 and name HN) 3.15 1.35 1.35 ! 0.9956 645:10 Intra 2.88, 3.97 A assign (resid 56 and name HB2) (resid 56 and name HD21) 3.15 1.35 1.35 ! 0.0000 646:10 Intra 2.22, 2.95 A assign (resid 58 and name HB2) (resid 56 and name HD21) 2.65 0.85 0.85 ! 0.8371 647:10 Ambig 2.16, 4.06 A or (resid 58 and name HB1) (resid 56 and name HD21) ! 0.1629 647:10 ----- 2.84, 3.65 A assign (resid 71 and name HB2) (resid 71 and name HD22) 3.65 1.85 1.85 ! 0.0000 648:10 Intra 3.47, 3.74 A assign (resid 71 and name HB1) (resid 71 and name HD22) 3.15 1.35 1.35 ! 0.0000 649:10 Intra 3.47, 3.54 A assign (resid 29 and name HB1) (resid 29 and name HE22) 3.15 1.35 1.35 ! 0.0000 650:10 Intra 3.41, 3.68 A assign (resid 108 and name HB2) (resid 108 and name HD22) 3.15 1.35 1.35 ! 0.0000 651:10 Intra 3.44, 3.78 A assign (resid 29 and name HG*) (resid 29 and name HN) 2.65 0.85 0.85 ! 0.9912 652:10 Intra 2.86, 3.41 A assign (resid 56 and name HB1) (resid 56 and name HD22) 3.15 1.35 1.35 ! 0.0000 653:10 Intra 3.44, 3.50 A assign (resid 128 and name HG1) (resid 128 and name HN) 2.65 0.85 0.85 ! 0.9724 654:10 Intra 1.97, 2.66 A assign (resid 128 and name HB2) (resid 128 and name HN) 3.65 1.85 1.85 ! 0.9200 655:10 Intra 3.57, 3.64 A assign (resid 29 and name HG*) (resid 29 and name HE21) 2.30 0.50 0.50 ! 0.0000 656:10 Intra 2.20, 3.03 A assign (resid 50 and name HB) (resid 52 and name HN) 4.15 2.35 2.35 ! 0.0000 657:10 Mid 5.33, 5.52 A assign (resid 56 and name HB1) (resid 56 and name HD21) 3.65 1.85 1.85 ! 0.9733 658:10 Intra 2.13, 2.26 A assign (resid 29 and name HG*) (resid 29 and name HE22) 2.65 0.85 0.85 ! 0.0000 659:10 Intra 3.45, 3.83 A assign (resid 30 and name HB) (resid 29 and name HN) 3.65 1.85 1.85 ! 0.0000 660:10 Seq 4.93, 5.18 A assign (resid 59 and name HG) (resid 56 and name HD22) 2.65 0.85 0.85 ! 0.9943 661:10 Mid 1.74, 2.70 A assign (resid 45 and name HB*) (resid 46 and name HN) 2.65 0.85 0.85 ! 0.0000 662:10 Seq 2.85, 3.90 A assign (resid 150 and name HG2*) (resid 150 and name HN) 3.15 1.35 1.35 ! 0.0000 664:10 Intra 2.58, 4.27 A assign (resid 128 and name HB1) (resid 128 and name HN) 2.65 0.85 0.85 ! 0.9914 665:10 Intra 2.53, 2.71 A assign (resid 148 and name HB*) (resid 150 and name HN) 4.15 2.35 2.35 ! 0.0000 666:10 Mid 2.54, 4.69 A assign (resid 7 and name HD*) (resid 29 and name HE21) 4.15 2.35 2.35 ! 0.0000 667:10 Long 4.07, 5.53 A assign (resid 47 and name HD2) (resid 110 and name HN) 3.65 1.85 1.85 ! 0.0000 670:10 Long 3.96, 4.98 A assign (resid 109 and name HB*) (resid 110 and name HN) 2.30 0.50 0.50 ! 0.5300 671:10 Ambig 2.57, 3.67 A or (resid 110 and name HG2*) (resid 110 and name HN) ! 0.4173 671:10 ----- 2.68, 4.05 A assign (resid 53 and name HG1*) (resid 52 and name HN) 3.65 1.85 1.85 ! 0.5658 672:10 Ambig 4.37, 5.17 A or (resid 53 and name HG2*) (resid 52 and name HN) ! 0.0881 672:10 ----- 5.96, 6.79 A or (resid 101 and name HB*) (resid 52 and name HN) ! 0.0873 672:10 ----- 5.97, 6.96 A or (resid 70 and name HG1*) (resid 52 and name HN) ! 0.0826 672:10 ----- 6.02, 7.40 A or (resid 78 and name HG2*) (resid 52 and name HN) ! 0.0549 672:10 ----- 6.45, 7.50 A or (resid 54 and name HD1*) (resid 52 and name HN) ! 0.0484 672:10 ----- 6.58, 7.94 A assign (resid 59 and name HG) (resid 56 and name HD21) 2.65 0.85 0.85 ! 0.7743 673:10 Ambig 1.79, 2.07 A or (resid 134 and name HB1) (resid 134 and name HN) ! 0.1727 673:10 ----- 2.30, 2.89 A assign (resid 59 and name HB2) (resid 56 and name HD21) 3.65 1.85 1.85 ! 0.9831 674:10 Mid 2.66, 3.61 A assign (resid 7 and name HD*) (resid 29 and name HE22) 3.65 1.85 1.85 ! 0.0000 675:10 Long 3.45, 5.04 A assign (resid 6 and name HG2*) (resid 29 and name HN) 4.15 2.35 2.35 ! 0.0000 680:10 Long 4.14, 6.98 A assign (resid 30 and name HG1*) (resid 29 and name HN) 3.65 1.85 1.85 ! 0.9732 681:10 Seq 3.74, 4.93 A assign (resid 94 and name HG2*) (resid 56 and name HD22) 3.65 1.85 1.85 ! 0.3867 682:10 Ambig 4.78, 6.27 A or (resid 97 and name HD1*) (resid 56 and name HD22) ! 0.2310 682:10 ----- 5.20, 6.43 A or (resid 97 and name HG12) (resid 56 and name HD22) ! 0.2306 682:10 ----- 5.21, 6.63 A or (resid 92 and name HG2*) (resid 56 and name HD22) ! 0.1517 682:10 ----- 5.58, 7.73 A assign (resid 59 and name HD2*) (resid 56 and name HD22) 3.15 1.35 1.35 ! 0.9897 683:10 Mid 2.40, 4.44 A assign (resid 47 and name HB*) (resid 46 and name HN) 3.15 1.35 1.35 ! 0.0000 684:10 Seq 4.07, 4.48 A assign (resid 59 and name HD1*) (resid 56 and name HD22) 3.65 1.85 1.85 ! 0.0000 685:10 Mid 3.69, 4.77 A assign (resid 133 and name HD1*) (resid 128 and name HN) 4.15 2.35 2.35 ! 0.0000 686:10 Long 5.09, 6.11 A assign (resid 47 and name HG1) (resid 110 and name HN) 3.15 1.35 1.35 ! 0.9711 688:10 Long 2.49, 2.88 A assign (resid 51 and name HG*) (resid 52 and name HN) 3.65 1.85 1.85 ! 0.9372 689:10 Seq 4.03, 4.44 A assign (resid 50 and name HG2*) (resid 52 and name HN) 2.30 0.50 0.50 ! 0.9929 690:10 Mid 2.69, 3.66 A assign (resid 59 and name HD2*) (resid 56 and name HD21) 3.15 1.35 1.35 ! 0.8575 691:10 Ambig 3.50, 4.33 A or (resid 60 and name HG2*) (resid 56 and name HD21) ! 0.1425 691:10 ----- 4.72, 6.53 A assign (resid 59 and name HD1*) (resid 56 and name HD21) 3.65 1.85 1.85 ! 0.0000 692:10 Mid 2.46, 3.69 A assign (resid 97 and name HG2*) (resid 56 and name HD22) 3.65 1.85 1.85 ! 0.0000 695:10 Long 5.22, 6.23 A assign (resid 97 and name HG2*) (resid 56 and name HD21) 3.15 1.35 1.35 ! 0.0000 697:10 Long 4.03, 5.31 A assign (resid 12 and name HA) (resid 12 and name HN) 2.65 0.85 0.85 ! 0.0000 698:10 Intra 2.90, 2.92 A assign (resid 11 and name HN) (resid 12 and name HN) 3.15 1.35 1.35 ! 0.5068 701:10 Ambig 4.17, 4.29 A or (resid 13 and name HN) (resid 12 and name HN) ! 0.4735 701:10 ----- 4.22, 4.31 A assign (resid 67 and name HN) (resid 66 and name HN) 2.65 0.85 0.85 ! 0.9198 702:10 Ambig 2.29, 2.49 A or (resid 66 and name HD*) (resid 66 and name HN) ! 0.0802 702:10 ----- 3.44, 4.77 A assign (resid 49 and name HB) (resid 106 and name HD22) 3.65 1.85 1.85 ! 0.8941 703:10 Ambig 3.21, 7.18 A or (resid 47 and name HA) (resid 106 and name HD22) ! 0.1059 703:10 ----- 4.58, 5.09 A assign (resid 34 and name HA) (resid 35 and name HN) 3.15 1.35 1.35 ! 0.0000 704:10 Seq 2.16, 2.30 A assign (resid 11 and name HA1) (resid 11 and name HN) 3.15 1.35 1.35 ! 0.9948 705:10 Intra 2.52, 2.54 A assign (resid 11 and name HA1) (resid 12 and name HN) 2.65 0.85 0.85 ! 0.0000 706:10 Seq 2.29, 2.46 A assign (resid 47 and name HA) (resid 106 and name HD21) 3.65 1.85 1.85 ! 0.8741 707:10 Ambig 2.88, 3.61 A or (resid 88 and name HA) (resid 89 and name HD21) ! 0.0640 707:10 ----- 4.45, 6.13 A assign (resid 35 and name HA1) (resid 35 and name HN) 3.65 1.85 1.85 ! 0.9975 708:10 Intra 2.42, 2.52 A assign (resid 108 and name HB2) (resid 108 and name HD21) 2.65 0.85 0.85 ! 0.0000 709:10 Intra 2.17, 2.91 A assign (resid 108 and name HB1) (resid 108 and name HD21) 2.65 0.85 0.85 ! 0.0000 710:10 Intra 2.19, 2.60 A assign (resid 66 and name HB*) (resid 67 and name HN) 3.65 1.85 1.85 ! 0.0000 711:10 Seq 4.03, 4.34 A assign (resid 66 and name HB*) (resid 66 and name HN) 3.15 1.35 1.35 ! 0.0000 712:10 Intra 3.00, 3.55 A assign (resid 106 and name HB1) (resid 106 and name HD21) 2.65 0.85 0.85 ! 0.9947 713:10 Intra 2.14, 2.77 A assign (resid 106 and name HB2) (resid 106 and name HD21) 2.65 0.85 0.85 ! 0.9990 714:10 Intra 2.13, 2.28 A assign (resid 106 and name HB1) (resid 106 and name HD22) 3.15 1.35 1.35 ! 0.0000 715:10 Intra 3.38, 3.68 A assign (resid 106 and name HB2) (resid 106 and name HD22) 3.15 1.35 1.35 ! 0.0000 716:10 Intra 3.41, 3.46 A assign (resid 24 and name HG2) (resid 11 and name HN) 3.65 1.85 1.85 ! 0.6632 717:10 Ambig 4.58, 5.05 A or (resid 23 and name HB) (resid 11 and name HN) ! 0.1857 717:10 ----- 5.66, 6.39 A or (resid 24 and name HG1) (resid 11 and name HN) ! 0.1167 717:10 ----- 6.12, 6.58 A assign (resid 24 and name HG2) (resid 12 and name HN) 4.15 2.35 2.35 ! 0.5465 718:10 Ambig 5.79, 6.80 A or (resid 13 and name HB) (resid 12 and name HN) ! 0.2553 718:10 ----- 6.57, 6.73 A or (resid 24 and name HG1) (resid 12 and name HN) ! 0.1982 718:10 ----- 6.85, 7.89 A assign (resid 102 and name HB1) (resid 52 and name HN) 3.15 1.35 1.35 ! 0.0000 719:10 Long 2.47, 2.87 A assign (resid 89 and name HB2) (resid 89 and name HD22) 3.15 1.35 1.35 ! 0.0000 720:10 Intra 3.44, 3.49 A assign (resid 89 and name HB2) (resid 89 and name HD21) 3.15 1.35 1.35 ! 0.0000 721:10 Intra 2.17, 2.28 A assign (resid 36 and name HB1) (resid 35 and name HN) 4.15 2.35 2.35 ! 0.0000 722:10 Seq 3.83, 4.85 A assign (resid 12 and name HG2*) (resid 12 and name HN) 3.15 1.35 1.35 ! 0.0000 724:10 Intra 4.32, 4.58 A assign (resid 86 and name HG2*) (resid 89 and name HD22) 3.65 1.85 1.85 ! 0.0000 725:10 Mid 3.22, 4.59 A assign (resid 86 and name HG2*) (resid 89 and name HD21) 3.15 1.35 1.35 ! 0.0000 726:10 Mid 1.89, 3.37 A assign (resid 88 and name HB*) (resid 89 and name HD22) 3.15 1.35 1.35 ! 0.0000 727:10 Seq 3.26, 5.07 A assign (resid 49 and name HG2*) (resid 106 and name HD22) 3.65 1.85 1.85 ! 0.7321 728:10 Ambig 4.34, 7.46 A or (resid 109 and name HB*) (resid 106 and name HD22) ! 0.2679 728:10 ----- 5.13, 6.54 A assign (resid 34 and name HG2*) (resid 35 and name HN) 2.30 0.50 0.50 ! 0.9559 729:10 Seq 2.13, 3.09 A assign (resid 37 and name HD1*) (resid 35 and name HN) 3.65 1.85 1.85 ! 0.6713 730:10 Ambig 4.10, 5.62 A or (resid 36 and name HD1*) (resid 35 and name HN) ! 0.1749 730:10 ----- 5.13, 6.77 A or (resid 133 and name HD1*) (resid 35 and name HN) ! 0.1538 730:10 ----- 5.24, 7.13 A assign (resid 10 and name HG1*) (resid 11 and name HN) 3.15 1.35 1.35 ! 0.0000 731:10 Seq 3.90, 4.55 A assign (resid 23 and name HG2*) (resid 11 and name HN) 2.65 0.85 0.85 ! 0.3523 732:10 Ambig 3.43, 6.69 A or (resid 10 and name HG2*) (resid 11 and name HN) ! 0.3188 732:10 ----- 3.49, 4.31 A or (resid 23 and name HG1*) (resid 11 and name HN) ! 0.2851 732:10 ----- 3.55, 4.47 A assign (resid 10 and name HG2*) (resid 12 and name HN) 3.65 1.85 1.85 ! 0.5311 733:10 Ambig 5.56, 6.98 A or (resid 23 and name HG1*) (resid 12 and name HN) ! 0.4689 733:10 ----- 5.68, 7.10 A assign (resid 63 and name HG2*) (resid 67 and name HN) 3.65 1.85 1.85 ! 0.7626 734:10 Ambig 4.41, 5.71 A or (resid 69 and name HG11) (resid 67 and name HN) ! 0.2374 734:10 ----- 5.36, 5.87 A assign (resid 67 and name HN) (resid 63 and name HN) 4.15 2.35 2.35 ! 0.0000 735:10 Mid 5.05, 5.59 A assign (resid 111 and name HA) (resid 112 and name HN) 2.30 0.50 0.50 ! 0.0000 736:10 Seq 2.11, 2.28 A assign (resid 43 and name HE*) (resid 76 and name HN) 3.65 1.85 1.85 ! 0.0000 737:10 Long 2.90, 4.01 A assign (resid 64 and name HB1) (resid 63 and name HN) 3.65 1.85 1.85 ! 0.0000 738:10 Seq 4.63, 4.92 A assign (resid 144 and name HB) (resid 112 and name HN) 2.30 0.50 0.50 ! 0.9989 739:10 Long 1.78, 2.11 A assign (resid 76 and name HA1) (resid 76 and name HN) 2.65 0.85 0.85 ! 0.7752 740:10 Ambig 2.92, 2.93 A or (resid 75 and name HB2) (resid 76 and name HN) ! 0.2248 740:10 ----- 3.59, 3.85 A assign (resid 75 and name HB1) (resid 76 and name HN) 3.65 1.85 1.85 ! 0.9235 741:10 Seq 3.46, 3.72 A assign (resid 111 and name HB*) (resid 112 and name HN) 2.65 0.85 0.85 ! 0.9705 742:10 Seq 2.50, 3.42 A assign (resid 144 and name HG2*) (resid 112 and name HN) 3.15 1.35 1.35 ! 0.4899 743:10 Ambig 3.77, 4.53 A or (resid 143 and name HG2*) (resid 112 and name HN) ! 0.3734 743:10 ----- 3.94, 5.34 A or (resid 145 and name HG2*) (resid 112 and name HN) ! 0.0870 743:10 ----- 5.03, 6.66 A assign (resid 61 and name HB1) (resid 63 and name HN) 4.15 2.35 2.35 ! 0.6636 744:10 Ambig 5.23, 5.89 A or (resid 55 and name HG1) (resid 63 and name HN) ! 0.3364 744:10 ----- 5.85, 6.27 A assign (resid 57 and name HG2*) (resid 63 and name HN) 3.65 1.85 1.85 ! 0.5061 745:10 Ambig 3.75, 6.35 A or (resid 62 and name HB1) (resid 63 and name HN) ! 0.4939 745:10 ----- 3.77, 4.32 A assign (resid 45 and name HB*) (resid 76 and name HN) 3.15 1.35 1.35 ! 0.0000 746:10 Long 2.12, 3.65 A assign (resid 144 and name HG1*) (resid 112 and name HN) 3.15 1.35 1.35 ! 0.9890 747:10 Long 3.18, 4.15 A assign (resid 63 and name HG2*) (resid 63 and name HN) 2.30 0.50 0.50 ! 0.0000 748:10 Intra 2.09, 3.25 A assign (resid 14 and name HA) (resid 15 and name HN) 2.30 0.50 0.50 ! 0.0000 750:10 Seq 2.21, 2.30 A assign (resid 146 and name HA2) (resid 146 and name HN) 3.15 1.35 1.35 ! 0.9618 751:10 Intra 2.36, 2.71 A assign (resid 140 and name HA1) (resid 140 and name HN) 3.65 1.85 1.85 ! 0.9818 752:10 Intra 2.31, 2.39 A assign (resid 146 and name HA1) (resid 146 and name HN) 2.65 0.85 0.85 ! 0.5734 753:10 Ambig 2.26, 2.60 A or (resid 85 and name HD*) (resid 86 and name HN) ! 0.4138 753:10 ----- 2.38, 3.21 A assign (resid 14 and name HB*) (resid 15 and name HN) 2.30 0.50 0.50 ! 0.5063 754:10 Ambig 2.60, 3.28 A or (resid 15 and name HA1) (resid 15 and name HN) ! 0.4937 754:10 ----- 2.61, 2.68 A assign (resid 139 and name HB2) (resid 140 and name HN) 3.65 1.85 1.85 ! 0.0000 755:10 Seq 2.21, 4.29 A assign (resid 139 and name HB1) (resid 140 and name HN) 3.15 1.35 1.35 ! 0.0000 756:10 Seq 2.59, 4.16 A assign (resid 10 and name HB) (resid 140 and name HN) 3.15 1.35 1.35 ! 0.9384 757:10 Long 2.41, 4.07 A assign (resid 85 and name HB1) (resid 86 and name HN) 3.65 1.85 1.85 ! 0.0000 758:10 Seq 4.37, 4.44 A assign (resid 116 and name HB2) (resid 140 and name HN) 3.65 1.85 1.85 ! 0.9613 759:10 Long 2.43, 2.92 A assign (resid 111 and name HB*) (resid 146 and name HN) 3.15 1.35 1.35 ! 0.9947 760:10 Long 2.63, 4.37 A assign (resid 145 and name HG2*) (resid 146 and name HN) 3.15 1.35 1.35 ! 0.0000 761:10 Seq 3.87, 4.67 A assign (resid 87 and name HB1) (resid 86 and name HN) 3.65 1.85 1.85 ! 0.4087 762:10 Ambig 4.21, 4.37 A or (resid 85 and name HG1) (resid 86 and name HN) ! 0.3804 762:10 ----- 4.26, 4.41 A or (resid 61 and name HB2) (resid 86 and name HN) ! 0.1172 762:10 ----- 5.18, 7.69 A or (resid 61 and name HB1) (resid 86 and name HN) ! 0.0937 762:10 ----- 5.38, 7.95 A assign (resid 87 and name HD2*) (resid 86 and name HN) 3.65 1.85 1.85 ! 0.5577 763:10 Ambig 5.16, 6.11 A or (resid 87 and name HD1*) (resid 86 and name HN) ! 0.4423 763:10 ----- 5.36, 6.41 A assign (resid 105 and name HD1*) (resid 15 and name HN) 3.15 1.35 1.35 ! 0.8662 764:10 Ambig 3.89, 4.30 A or (resid 21 and name HG1*) (resid 15 and name HN) ! 0.1338 764:10 ----- 5.31, 6.67 A assign (resid 10 and name HG1*) (resid 140 and name HN) 3.15 1.35 1.35 ! 0.9880 765:10 Long 2.83, 4.79 A assign (resid 10 and name HG2*) (resid 140 and name HN) 2.65 0.85 0.85 ! 0.8515 766:10 Ambig 2.02, 4.19 A or (resid 118 and name HG2*) (resid 140 and name HN) ! 0.1303 766:10 ----- 2.77, 4.19 A assign (resid 142 and name HG2*) (resid 15 and name HN) 3.15 1.35 1.35 ! 0.0000 768:10 Long 3.34, 4.19 A assign (resid 96 and name HA1) (resid 96 and name HN) 3.15 1.35 1.35 ! 0.7297 769:10 Ambig 2.88, 2.91 A or (resid 143 and name HB) (resid 15 and name HN) ! 0.2246 769:10 ----- 3.51, 3.93 A assign (resid 95 and name HB1) (resid 96 and name HN) 3.15 1.35 1.35 ! 0.0000 770:10 Seq 3.44, 3.61 A assign (resid 95 and name HB2) (resid 96 and name HN) 3.15 1.35 1.35 ! 0.0000 771:10 Seq 1.88, 2.21 A assign (resid 120 and name HB1) (resid 122 and name HN) 4.15 2.35 2.35 ! 0.0000 772:10 Mid 5.94, 6.11 A assign (resid 123 and name HB1) (resid 122 and name HN) 3.65 1.85 1.85 ! 0.9235 773:10 Seq 4.50, 4.88 A assign (resid 121 and name HB*) (resid 122 and name HN) 2.30 0.50 0.50 ! 0.9167 774:10 Ambig 2.60, 3.45 A or (resid 123 and name HB2) (resid 122 and name HN) ! 0.0775 774:10 ----- 3.92, 4.13 A assign (resid 122 and name HG2*) (resid 122 and name HN) 2.65 0.85 0.85 ! 0.0000 775:10 Intra 2.63, 4.06 A assign (resid 124 and name HD1*) (resid 122 and name HN) 3.65 1.85 1.85 ! 0.4211 776:10 Ambig 5.29, 7.28 A or (resid 123 and name HD1*) (resid 122 and name HN) ! 0.3433 776:10 ----- 5.47, 6.97 A or (resid 118 and name HG1*) (resid 122 and name HN) ! 0.2355 776:10 ----- 5.83, 7.02 A assign (resid 117 and name HN) (resid 42 and name HN) 3.15 1.35 1.35 ! 0.9886 777:10 Long 3.33, 3.59 A assign (resid 114 and name HN) (resid 113 and name HN) 3.15 1.35 1.35 ! 0.0000 778:10 Seq 4.33, 4.42 A assign (resid 63 and name HN) (resid 64 and name HN) 3.15 1.35 1.35 ! 0.0000 779:10 Seq 2.36, 2.65 A assign (resid 116 and name HN) (resid 115 and name HN) 3.65 1.85 1.85 ! 0.8649 780:10 Ambig 4.44, 4.48 A or (resid 117 and name HN) (resid 115 and name HN) ! 0.1351 780:10 ----- 6.05, 6.57 A assign (resid 16 and name HD21) (resid 16 and name HN) 2.65 0.85 0.85 ! 0.9527 781:10 Intra 2.45, 2.84 A assign (resid 63 and name HN) (resid 62 and name HN) 3.15 1.35 1.35 ! 0.0000 782:10 Seq 2.64, 3.15 A assign (resid 10 and name HN) (resid 9 and name HN) 3.65 1.85 1.85 ! 0.9572 783:10 Seq 4.26, 4.33 A assign (resid 36 and name HN) (resid 126 and name HN) 3.65 1.85 1.85 ! 0.0000 784:10 Long 3.05, 3.28 A assign (resid 99 and name HN) (resid 98 and name HN) 2.65 0.85 0.85 ! 0.0000 785:10 Seq 2.33, 2.43 A assign (resid 47 and name HN) (resid 44 and name HN) 3.65 1.85 1.85 ! 0.0000 786:10 Mid 4.83, 5.17 A assign (resid 52 and name HN) (resid 51 and name HN) 2.65 0.85 0.85 ! 0.0000 787:10 Seq 2.27, 2.40 A assign (resid 108 and name HN) (resid 106 and name HN) 3.65 1.85 1.85 ! 0.8312 788:10 Ambig 4.72, 5.13 A or (resid 19 and name HN) (resid 106 and name HN) ! 0.1688 788:10 ----- 6.16, 6.51 A assign (resid 47 and name HN) (resid 106 and name HN) 4.15 2.35 2.35 ! 0.0000 789:10 Long 5.53, 5.81 A assign (resid 88 and name HN) (resid 90 and name HN) 3.65 1.85 1.85 ! 0.0000 791:10 Mid 3.66, 3.81 A assign (resid 65 and name HN) (resid 64 and name HN) 2.65 0.85 0.85 ! 0.9490 792:10 Seq 2.20, 2.62 A assign (resid 94 and name HN) (resid 93 and name HN) 2.30 0.50 0.50 ! 0.0000 793:10 Seq 2.02, 2.17 A assign (resid 90 and name HD*) (resid 90 and name HN) 3.15 1.35 1.35 ! 0.0000 794:10 Intra 2.64, 3.90 A assign (resid 56 and name HN) (resid 100 and name HN) 3.65 1.85 1.85 ! 0.0000 795:10 Long 4.20, 4.47 A assign (resid 99 and name HN) (resid 100 and name HN) 3.15 1.35 1.35 ! 0.9689 796:10 Seq 4.22, 4.25 A assign (resid 36 and name HN) (resid 35 and name HN) 3.15 1.35 1.35 ! 0.0000 797:10 Seq 1.79, 1.95 A assign (resid 47 and name HN) (resid 45 and name HN) 3.65 1.85 1.85 ! 0.0000 798:10 Mid 3.98, 4.16 A assign (resid 82 and name HD*) (resid 69 and name HN) 3.65 1.85 1.85 ! 0.8497 799:10 Ambig 3.18, 4.93 A or (resid 68 and name HD*) (resid 69 and name HN) ! 0.1434 799:10 ----- 4.28, 4.72 A assign (resid 109 and name HN) (resid 107 and name HN) 3.65 1.85 1.85 ! 0.9573 801:10 Mid 3.75, 3.92 A assign (resid 43 and name HD*) (resid 49 and name HN) 3.65 1.85 1.85 ! 0.7574 805:10 Ambig 5.05, 7.25 A or (resid 47 and name HN) (resid 49 and name HN) ! 0.2426 805:10 ----- 6.11, 6.46 A assign (resid 47 and name HN) (resid 46 and name HN) 3.15 1.35 1.35 ! 0.0000 807:10 Seq 2.07, 2.24 A assign (resid 100 and name HD*) (resid 101 and name HN) 3.65 1.85 1.85 ! 0.0000 809:10 Seq 4.27, 5.31 A assign (resid 103 and name HD*) (resid 104 and name HN) 3.15 1.35 1.35 ! 0.8285 810:10 Ambig 3.66, 4.90 A or (resid 48 and name HD*) (resid 104 and name HN) ! 0.1715 810:10 ----- 4.76, 6.42 A assign (resid 103 and name HD*) (resid 103 and name HN) 2.65 0.85 0.85 ! 0.9864 813:10 Intra 2.92, 4.09 A assign (resid 100 and name HD*) (resid 100 and name HN) 2.65 0.85 0.85 ! 0.9780 814:10 Intra 2.39, 3.73 A assign (resid 100 and name HD*) (resid 54 and name HN) 3.65 1.85 1.85 ! 0.8936 815:10 Ambig 3.68, 5.29 A or (resid 82 and name HZ) (resid 54 and name HN) ! 0.0589 815:10 ----- 5.79, 6.24 A assign (resid 66 and name HD*) (resid 83 and name HN) 4.15 2.35 2.35 ! 0.0000 816:10 Long 5.72, 7.35 A assign (resid 16 and name HD22) (resid 16 and name HN) 3.65 1.85 1.85 ! 0.8241 817:10 Ambig 3.41, 3.82 A or (resid 106 and name HD21) (resid 107 and name HN) ! 0.1759 817:10 ----- 4.42, 4.88 A assign (resid 42 and name HN) (resid 117 and name HN) 3.65 1.85 1.85 ! 0.9543 819:10 Long 3.33, 3.59 A assign (resid 37 and name HN) (resid 36 and name HN) 3.65 1.85 1.85 ! 0.0000 820:10 Seq 3.88, 3.99 A assign (resid 98 and name HN) (resid 99 and name HN) 2.30 0.50 0.50 ! 0.9869 821:10 Seq 2.33, 2.43 A assign (resid 9 and name HN) (resid 10 and name HN) 3.65 1.85 1.85 ! 0.0000 822:10 Seq 4.26, 4.33 A assign (resid 16 and name HN) (resid 16 and name HD21) 3.65 1.85 1.85 ! 0.9812 823:10 Intra 2.45, 2.84 A assign (resid 64 and name HN) (resid 63 and name HN) 2.65 0.85 0.85 ! 0.0000 824:10 Seq 2.36, 2.65 A assign (resid 62 and name HN) (resid 63 and name HN) 3.15 1.35 1.35 ! 0.0000 825:10 Seq 2.64, 3.15 A assign (resid 35 and name HN) (resid 36 and name HN) 3.15 1.35 1.35 ! 0.0000 826:10 Seq 1.79, 1.95 A assign (resid 106 and name HN) (resid 109 and name HN) 3.65 1.85 1.85 ! 0.0000 827:10 Mid 4.31, 4.53 A assign (resid 107 and name HN) (resid 109 and name HN) 3.65 1.85 1.85 ! 0.0000 828:10 Mid 3.75, 3.92 A assign (resid 64 and name HN) (resid 65 and name HN) 2.65 0.85 0.85 ! 0.0000 829:10 Seq 2.20, 2.62 A assign (resid 56 and name HD22) (resid 56 and name HN) 4.15 2.35 2.35 ! 0.0000 831:10 Intra 4.96, 5.76 A assign (resid 131 and name HN) (resid 129 and name HD21) 3.15 1.35 1.35 ! 0.6200 832:10 Ambig 3.54, 4.56 A or (resid 139 and name HN) (resid 139 and name HD21) ! 0.3800 832:10 ----- 3.84, 4.84 A assign (resid 106 and name HN) (resid 48 and name HN) 3.65 1.85 1.85 ! 0.0000 833:10 Long 4.49, 4.71 A assign (resid 49 and name HN) (resid 48 and name HN) 3.65 1.85 1.85 ! 0.0000 834:10 Seq 4.29, 4.37 A assign (resid 118 and name HN) (resid 139 and name HD21) 3.15 1.35 1.35 ! 0.6251 835:10 Ambig 2.86, 3.74 A or (resid 140 and name HN) (resid 139 and name HD21) ! 0.2973 835:10 ----- 3.23, 4.45 A assign (resid 56 and name HD22) (resid 59 and name HN) 3.15 1.35 1.35 ! 0.9987 836:10 Mid 2.44, 3.59 A assign (resid 100 and name HN) (resid 99 and name HN) 3.65 1.85 1.85 ! 0.0000 837:10 Seq 4.22, 4.25 A assign (resid 16 and name HN) (resid 16 and name HD22) 4.15 2.35 2.35 ! 0.8970 839:10 Ambig 3.41, 3.82 A or (resid 145 and name HN) (resid 16 and name HD22) ! 0.1030 839:10 ----- 4.90, 6.22 A assign (resid 49 and name HN) (resid 106 and name HD22) 3.65 1.85 1.85 ! 0.6811 841:10 Ambig 3.57, 6.88 A or (resid 107 and name HN) (resid 106 and name HD22) ! 0.3189 841:10 ----- 4.05, 4.69 A assign (resid 106 and name HN) (resid 49 and name HN) 3.15 1.35 1.35 ! 0.4259 843:10 Ambig 3.81, 4.17 A or (resid 50 and name HN) (resid 49 and name HN) ! 0.2976 843:10 ----- 4.04, 4.20 A or (resid 28 and name HN) (resid 9 and name HN) ! 0.2382 843:10 ----- 4.20, 4.59 A assign (resid 104 and name HN) (resid 49 and name HN) 2.65 0.85 0.85 ! 0.9958 844:10 Long 2.61, 2.83 A assign (resid 139 and name HN) (resid 10 and name HN) 4.15 2.35 2.35 ! 0.6397 845:10 Ambig 4.17, 4.89 A or (resid 137 and name HN) (resid 10 and name HN) ! 0.2305 845:10 ----- 4.94, 5.53 A or (resid 138 and name HN) (resid 10 and name HN) ! 0.0897 845:10 ----- 5.79, 6.61 A assign (resid 10 and name HB) (resid 11 and name HN) 3.65 1.85 1.85 ! 0.0000 848:10 Seq 2.36, 2.44 A assign (resid 12 and name HN) (resid 11 and name HN) 3.65 1.85 1.85 ! 0.0000 849:10 Seq 4.17, 4.29 A assign (resid 141 and name HN) (resid 12 and name HN) 4.15 2.35 2.35 ! 0.0000 850:10 Long 4.75, 4.93 A assign (resid 142 and name HG11) (resid 13 and name HN) 3.65 1.85 1.85 ! 0.0000 852:10 Long 4.51, 4.68 A assign (resid 141 and name HG2) (resid 13 and name HN) 3.65 1.85 1.85 ! 0.7710 854:10 Ambig 4.36, 4.94 A or (resid 141 and name HD1) (resid 13 and name HN) ! 0.1549 854:10 ----- 5.70, 7.09 A assign (resid 142 and name HD1*) (resid 13 and name HN) 3.65 1.85 1.85 ! 0.0000 855:10 Long 6.04, 6.51 A assign (resid 12 and name HN) (resid 13 and name HN) 3.15 1.35 1.35 ! 0.0000 856:10 Seq 4.22, 4.31 A assign (resid 143 and name HN) (resid 13 and name HN) 3.15 1.35 1.35 ! 0.0000 857:10 Long 3.53, 3.66 A assign (resid 17 and name HB1) (resid 108 and name HN) 3.65 1.85 1.85 ! 0.8701 859:10 Ambig 4.32, 4.89 A or (resid 17 and name HG1) (resid 108 and name HN) ! 0.1299 859:10 ----- 5.93, 6.82 A assign (resid 76 and name HA1) (resid 43 and name HN) 3.15 1.35 1.35 ! 0.0000 860:10 Long 3.49, 3.81 A assign (resid 13 and name HG2*) (resid 14 and name HN) 2.65 0.85 0.85 ! 0.6532 862:10 Ambig 3.51, 4.33 A or (resid 13 and name HG1*) (resid 14 and name HN) ! 0.3468 862:10 ----- 3.90, 4.56 A assign (resid 145 and name HG2*) (resid 15 and name HN) 2.65 0.85 0.85 ! 0.8088 864:10 Ambig 3.03, 4.43 A or (resid 144 and name HG2*) (resid 15 and name HN) ! 0.0879 864:10 ----- 4.39, 5.36 A or (resid 143 and name HG2*) (resid 15 and name HN) ! 0.0791 864:10 ----- 4.46, 5.56 A assign (resid 13 and name HB) (resid 15 and name HN) 4.15 2.35 2.35 ! 0.7216 865:10 Ambig 5.67, 5.90 A or (resid 105 and name HB) (resid 15 and name HN) ! 0.2784 865:10 ----- 6.65, 6.91 A assign (resid 95 and name HN) (resid 96 and name HN) 3.65 1.85 1.85 ! 0.0000 866:10 Seq 4.37, 4.48 A assign (resid 14 and name HN) (resid 15 and name HN) 3.65 1.85 1.85 ! 0.7477 867:10 Ambig 4.38, 4.43 A or (resid 146 and name HN) (resid 15 and name HN) ! 0.2523 867:10 ----- 5.25, 6.80 A assign (resid 145 and name HN) (resid 15 and name HN) 2.65 0.85 0.85 ! 0.9141 868:10 Ambig 2.83, 3.17 A or (resid 16 and name HN) (resid 15 and name HN) ! 0.0794 868:10 ----- 4.25, 4.33 A assign (resid 143 and name HN) (resid 15 and name HN) 3.65 1.85 1.85 ! 0.0000 869:10 Long 3.88, 4.07 A assign (resid 105 and name HB) (resid 16 and name HN) 3.65 1.85 1.85 ! 0.9619 870:10 Long 3.61, 4.16 A assign (resid 106 and name HD22) (resid 107 and name HN) 4.15 2.35 2.35 ! 0.0000 871:10 Seq 4.05, 4.69 A assign (resid 108 and name HN) (resid 107 and name HN) 2.65 0.85 0.85 ! 0.9347 872:10 Seq 2.24, 2.37 A assign (resid 106 and name HN) (resid 107 and name HN) 3.65 1.85 1.85 ! 0.0000 873:10 Seq 4.48, 4.56 A assign (resid 15 and name HN) (resid 16 and name HN) 3.15 1.35 1.35 ! 0.7670 874:10 Ambig 4.25, 4.33 A or (resid 20 and name HN) (resid 16 and name HN) ! 0.1990 874:10 ----- 5.32, 5.76 A assign (resid 18 and name HA1) (resid 18 and name HN) 3.15 1.35 1.35 ! 0.0000 875:10 Intra 2.91, 2.93 A assign (resid 18 and name HN) (resid 19 and name HN) 2.65 0.85 0.85 ! 0.7802 876:10 Ambig 2.29, 2.44 A or (resid 16 and name HD21) (resid 19 and name HN) ! 0.2198 876:10 ----- 2.83, 5.22 A assign (resid 16 and name HN) (resid 19 and name HN) 3.65 1.85 1.85 ! 0.9644 877:10 Mid 3.50, 3.84 A assign (resid 21 and name HN) (resid 20 and name HN) 3.65 1.85 1.85 ! 0.9593 878:10 Seq 4.33, 4.42 A assign (resid 20 and name HG2*) (resid 21 and name HN) 2.30 0.50 0.50 ! 0.9938 879:10 Seq 2.53, 3.55 A assign (resid 21 and name HB) (resid 21 and name HN) 3.65 1.85 1.85 ! 0.0000 881:10 Intra 2.88, 2.98 A assign (resid 103 and name HN) (resid 21 and name HN) 2.65 0.85 0.85 ! 0.6678 882:10 Ambig 3.05, 3.28 A or (resid 105 and name HN) (resid 21 and name HN) ! 0.3279 882:10 ----- 3.43, 3.77 A assign (resid 13 and name HG2*) (resid 22 and name HN) 3.15 1.35 1.35 ! 0.7523 883:10 Ambig 3.88, 5.20 A or (resid 20 and name HG2*) (resid 22 and name HN) ! 0.1897 883:10 ----- 4.88, 6.21 A assign (resid 23 and name HB) (resid 23 and name HN) 2.65 0.85 0.85 ! 0.9803 884:10 Intra 2.62, 2.70 A assign (resid 22 and name HN) (resid 23 and name HN) 3.65 1.85 1.85 ! 0.0000 885:10 Seq 4.14, 4.23 A assign (resid 103 and name HN) (resid 23 and name HN) 3.65 1.85 1.85 ! 0.0000 886:10 Long 4.20, 4.43 A assign (resid 101 and name HN) (resid 23 and name HN) 3.15 1.35 1.35 ! 0.0000 887:10 Long 2.83, 3.03 A assign (resid 99 and name HN) (resid 25 and name HN) 2.65 0.85 0.85 ! 0.0000 888:10 Long 2.95, 3.05 A assign (resid 100 and name HD*) (resid 25 and name HN) 3.65 1.85 1.85 ! 0.7658 889:10 Ambig 4.60, 5.62 A or (resid 100 and name HE*) (resid 25 and name HN) ! 0.2342 889:10 ----- 5.61, 6.60 A assign (resid 98 and name HN) (resid 25 and name HN) 2.65 0.85 0.85 ! 0.4625 890:10 Ambig 3.81, 3.96 A or (resid 101 and name HN) (resid 25 and name HN) ! 0.3322 890:10 ----- 4.03, 4.17 A or (resid 26 and name HN) (resid 25 and name HN) ! 0.1880 890:10 ----- 4.43, 4.47 A assign (resid 101 and name HB*) (resid 101 and name HN) 2.30 0.50 0.50 ! 0.4799 891:10 Ambig 2.51, 3.09 A or (resid 25 and name HG1*) (resid 26 and name HN) ! 0.1855 891:10 ----- 2.94, 3.61 A or (resid 23 and name HG1*) (resid 101 and name HN) ! 0.1060 891:10 ----- 3.22, 5.09 A or (resid 101 and name HD2*) (resid 101 and name HN) ! 0.1028 891:10 ----- 3.24, 4.08 A or (resid 25 and name HG2*) (resid 101 and name HN) ! 0.0605 891:10 ----- 3.54, 4.71 A assign (resid 9 and name HN) (resid 26 and name HN) 2.65 0.85 0.85 ! 0.8083 892:10 Ambig 3.30, 3.49 A or (resid 100 and name HN) (resid 101 and name HN) ! 0.1917 892:10 ----- 4.19, 4.28 A assign (resid 25 and name HN) (resid 101 and name HN) 3.65 1.85 1.85 ! 0.6142 893:10 Ambig 4.03, 4.17 A or (resid 25 and name HN) (resid 26 and name HN) ! 0.3476 893:10 ----- 4.43, 4.47 A assign (resid 23 and name HN) (resid 101 and name HN) 3.15 1.35 1.35 ! 0.0000 894:10 Long 2.83, 3.03 A assign (resid 27 and name HG2*) (resid 27 and name HN) 2.65 0.85 0.85 ! 0.9794 895:10 Intra 2.09, 2.96 A assign (resid 8 and name HA) (resid 27 and name HN) 4.15 2.35 2.35 ! 0.8864 896:10 Ambig 4.98, 5.14 A or (resid 9 and name HA) (resid 27 and name HN) ! 0.1136 896:10 ----- 7.02, 7.39 A assign (resid 96 and name HN) (resid 27 and name HN) 3.65 1.85 1.85 ! 0.9930 897:10 Long 2.89, 3.10 A assign (resid 27 and name HG12) (resid 28 and name HN) 3.15 1.35 1.35 ! 0.9098 898:10 Ambig 2.64, 2.93 A or (resid 27 and name HB) (resid 28 and name HN) ! 0.0609 898:10 ----- 4.15, 4.19 A assign (resid 89 and name HB2) (resid 90 and name HN) 3.65 1.85 1.85 ! 0.9847 899:10 Seq 2.51, 2.66 A assign (resid 89 and name HN) (resid 90 and name HN) 2.65 0.85 0.85 ! 0.0000 900:10 Seq 2.06, 2.19 A assign (resid 9 and name HN) (resid 28 and name HN) 3.65 1.85 1.85 ! 0.0000 901:10 Long 4.20, 4.59 A assign (resid 96 and name HN) (resid 28 and name HN) 3.65 1.85 1.85 ! 0.8818 902:10 Ambig 4.94, 5.12 A or (resid 6 and name HN) (resid 28 and name HN) ! 0.1182 902:10 ----- 6.91, 7.10 A assign (resid 30 and name HN) (resid 29 and name HN) 2.65 0.85 0.85 ! 0.0000 904:10 Seq 2.43, 2.63 A assign (resid 29 and name HN) (resid 30 and name HN) 2.65 0.85 0.85 ! 0.0000 905:10 Seq 2.43, 2.63 A assign (resid 30 and name HG2*) (resid 31 and name HN) 2.65 0.85 0.85 ! 0.9362 906:10 Seq 2.66, 3.92 A assign (resid 32 and name HN) (resid 31 and name HN) 3.65 1.85 1.85 ! 0.0000 907:10 Seq 1.83, 1.99 A assign (resid 34 and name HN) (resid 35 and name HN) 3.65 1.85 1.85 ! 0.0000 909:10 Seq 4.49, 4.58 A assign (resid 84 and name HN) (resid 36 and name HN) 4.15 2.35 2.35 ! 0.0000 910:10 Long 4.88, 5.35 A assign (resid 124 and name HB) (resid 38 and name HN) 3.15 1.35 1.35 ! 0.9514 911:10 Long 2.81, 3.23 A assign (resid 37 and name HG2*) (resid 38 and name HN) 2.30 0.50 0.50 ! 0.6673 912:10 Ambig 2.83, 3.57 A or (resid 36 and name HD1*) (resid 38 and name HN) ! 0.1908 912:10 ----- 3.49, 7.07 A or (resid 124 and name HG2*) (resid 38 and name HN) ! 0.0613 912:10 ----- 4.22, 5.20 A or (resid 124 and name HD1*) (resid 38 and name HN) ! 0.0351 912:10 ----- 4.63, 6.07 A assign (resid 124 and name HN) (resid 38 and name HN) 3.15 1.35 1.35 ! 0.9981 913:10 Long 2.56, 2.70 A assign (resid 39 and name HN) (resid 38 and name HN) 3.65 1.85 1.85 ! 0.0000 914:10 Seq 4.23, 4.31 A assign (resid 80 and name HG1*) (resid 39 and name HN) 3.65 1.85 1.85 ! 0.5464 915:10 Ambig 5.16, 5.80 A or (resid 80 and name HD1*) (resid 39 and name HN) ! 0.3277 915:10 ----- 5.62, 6.56 A or (resid 98 and name HD2*) (resid 39 and name HN) ! 0.1259 915:10 ----- 6.59, 7.72 A assign (resid 80 and name HG2*) (resid 39 and name HN) 3.65 1.85 1.85 ! 0.0000 916:10 Long 4.25, 5.28 A assign (resid 80 and name HN) (resid 39 and name HN) 2.65 0.85 0.85 ! 0.9160 917:10 Ambig 3.11, 3.26 A or (resid 124 and name HN) (resid 39 and name HN) ! 0.0840 917:10 ----- 4.63, 4.75 A assign (resid 38 and name HN) (resid 39 and name HN) 3.15 1.35 1.35 ! 0.8939 918:10 Ambig 4.23, 4.31 A or (resid 41 and name HN) (resid 39 and name HN) ! 0.1061 918:10 ----- 6.03, 6.22 A assign (resid 41 and name HD1*) (resid 41 and name HN) 2.30 0.50 0.50 ! 0.5570 919:10 Ambig 2.15, 3.89 A or (resid 41 and name HG11) (resid 41 and name HN) ! 0.4154 919:10 ----- 2.26, 2.84 A assign (resid 39 and name HG*) (resid 41 and name HN) 3.65 1.85 1.85 ! 0.0000 920:10 Mid 4.19, 5.42 A assign (resid 80 and name HN) (resid 41 and name HN) 3.65 1.85 1.85 ! 0.0000 921:10 Long 4.06, 4.24 A assign (resid 78 and name HN) (resid 41 and name HN) 3.15 1.35 1.35 ! 0.0000 922:10 Long 2.68, 2.84 A assign (resid 116 and name HD2*) (resid 42 and name HN) 4.15 2.35 2.35 ! 0.0000 923:10 Long 6.10, 7.14 A assign (resid 41 and name HG2*) (resid 43 and name HN) 3.15 1.35 1.35 ! 0.9776 924:10 Mid 3.94, 5.30 A assign (resid 77 and name HG1) (resid 43 and name HN) 3.65 1.85 1.85 ! 0.0000 925:10 Long 4.40, 4.79 A assign (resid 43 and name HE*) (resid 43 and name HN) 3.65 1.85 1.85 ! 0.0000 926:10 Intra 4.13, 5.11 A assign (resid 42 and name HN) (resid 43 and name HN) 3.15 1.35 1.35 ! 0.5006 927:10 Ambig 4.26, 4.33 A or (resid 44 and name HN) (resid 43 and name HN) ! 0.4531 927:10 ----- 4.33, 4.38 A assign (resid 78 and name HN) (resid 43 and name HN) 3.65 1.85 1.85 ! 0.0000 928:10 Long 4.57, 5.01 A assign (resid 116 and name HD2*) (resid 44 and name HN) 3.15 1.35 1.35 ! 0.9328 929:10 Long 2.51, 4.12 A assign (resid 47 and name HD1) (resid 44 and name HN) 4.15 2.35 2.35 ! 0.8033 930:10 Ambig 4.34, 6.46 A or (resid 116 and name HG) (resid 44 and name HN) ! 0.1967 930:10 ----- 5.48, 6.19 A assign (resid 48 and name HN) (resid 46 and name HN) 3.15 1.35 1.35 ! 0.0000 931:10 Mid 3.36, 3.80 A assign (resid 47 and name HA) (resid 47 and name HN) 3.65 1.85 1.85 ! 0.9915 932:10 Intra 2.87, 2.90 A assign (resid 106 and name HD21) (resid 47 and name HN) 3.65 1.85 1.85 ! 0.5456 933:10 Ambig 4.37, 4.73 A or (resid 43 and name HE*) (resid 47 and name HN) ! 0.4544 933:10 ----- 4.51, 7.15 A assign (resid 48 and name HN) (resid 47 and name HN) 2.30 0.50 0.50 ! 0.9982 934:10 Seq 1.95, 2.25 A assign (resid 46 and name HN) (resid 47 and name HN) 2.65 0.85 0.85 ! 0.9804 935:10 Seq 2.07, 2.24 A assign (resid 43 and name HE*) (resid 48 and name HN) 3.65 1.85 1.85 ! 0.7013 939:10 Ambig 3.19, 5.74 A or (resid 106 and name HD21) (resid 48 and name HN) ! 0.2987 939:10 ----- 3.68, 4.84 A assign (resid 47 and name HN) (resid 48 and name HN) 2.30 0.50 0.50 ! 0.0000 940:10 Seq 1.95, 2.25 A assign (resid 46 and name HN) (resid 48 and name HN) 3.15 1.35 1.35 ! 0.8814 941:10 Ambig 3.36, 3.80 A or (resid 45 and name HN) (resid 48 and name HN) ! 0.1186 941:10 ----- 4.70, 4.86 A assign (resid 9 and name HB2) (resid 9 and name HN) 2.65 0.85 0.85 ! 0.9941 943:10 Intra 2.32, 3.00 A assign (resid 51 and name HD1) (resid 50 and name HN) 4.15 2.35 2.35 ! 0.7940 944:10 Ambig 4.83, 7.01 A or (resid 51 and name HB*) (resid 50 and name HN) ! 0.1376 944:10 ----- 6.46, 6.95 A assign (resid 49 and name HN) (resid 50 and name HN) 3.65 1.85 1.85 ! 0.0000 945:10 Seq 4.04, 4.20 A assign (resid 50 and name HG1*) (resid 51 and name HN) 3.15 1.35 1.35 ! 0.0000 946:10 Seq 4.04, 4.85 A assign (resid 102 and name HB1) (resid 51 and name HN) 3.65 1.85 1.85 ! 0.0000 947:10 Long 3.42, 3.74 A assign (resid 104 and name HN) (resid 51 and name HN) 3.65 1.85 1.85 ! 0.9772 948:10 Long 3.77, 4.12 A assign (resid 102 and name HN) (resid 52 and name HN) 3.15 1.35 1.35 ! 0.0000 949:10 Long 3.33, 3.65 A assign (resid 53 and name HN) (resid 52 and name HN) 3.65 1.85 1.85 ! 0.0000 950:10 Seq 4.17, 4.19 A assign (resid 52 and name HN) (resid 53 and name HN) 3.15 1.35 1.35 ! 0.0000 951:10 Seq 4.17, 4.19 A assign (resid 101 and name HG) (resid 54 and name HN) 4.15 2.35 2.35 ! 0.6542 952:10 Ambig 5.99, 6.16 A or (resid 55 and name HG2) (resid 54 and name HN) ! 0.3458 952:10 ----- 6.66, 6.76 A assign (resid 53 and name HN) (resid 54 and name HN) 3.15 1.35 1.35 ! 0.0000 954:10 Seq 4.25, 4.32 A assign (resid 78 and name HD1*) (resid 50 and name HN) 3.15 1.35 1.35 ! 0.5321 956:10 Ambig 4.38, 6.00 A or (resid 50 and name HG2*) (resid 50 and name HN) ! 0.4679 956:10 ----- 4.47, 4.63 A assign (resid 51 and name HB*) (resid 52 and name HN) 2.30 0.50 0.50 ! 0.0000 957:10 Seq 1.98, 2.66 A assign (resid 51 and name HN) (resid 52 and name HN) 2.30 0.50 0.50 ! 0.9959 958:10 Seq 2.27, 2.40 A assign (resid 30 and name HG1*) (resid 95 and name HN) 2.65 0.85 0.85 ! 0.9552 959:10 Long 3.57, 4.26 A assign (resid 56 and name HB2) (resid 56 and name HN) 2.65 0.85 0.85 ! 0.9973 960:10 Intra 2.69, 2.81 A assign (resid 100 and name HE*) (resid 56 and name HN) 3.65 1.85 1.85 ! 0.7711 961:10 Ambig 3.87, 6.10 A or (resid 82 and name HZ) (resid 56 and name HN) ! 0.2289 961:10 ----- 4.74, 5.16 A assign (resid 82 and name HE*) (resid 56 and name HN) 3.65 1.85 1.85 ! 0.0000 963:10 Long 4.97, 5.92 A assign (resid 58 and name HN) (resid 57 and name HN) 2.65 0.85 0.85 ! 0.9479 964:10 Seq 2.59, 2.70 A assign (resid 59 and name HN) (resid 58 and name HN) 2.30 0.50 0.50 ! 0.0000 965:10 Seq 2.19, 2.41 A assign (resid 56 and name HD21) (resid 58 and name HN) 3.65 1.85 1.85 ! 0.0000 966:10 Mid 3.11, 3.94 A assign (resid 56 and name HD22) (resid 58 and name HN) 3.15 1.35 1.35 ! 0.0000 967:10 Mid 2.99, 3.46 A assign (resid 60 and name HN) (resid 58 and name HN) 3.15 1.35 1.35 ! 0.0000 968:10 Mid 3.98, 4.22 A assign (resid 57 and name HN) (resid 58 and name HN) 2.65 0.85 0.85 ! 0.9939 969:10 Seq 2.59, 2.70 A assign (resid 59 and name HD1*) (resid 59 and name HN) 3.15 1.35 1.35 ! 0.0000 970:10 Intra 4.31, 4.91 A assign (resid 57 and name HN) (resid 59 and name HN) 3.65 1.85 1.85 ! 0.7910 971:10 Ambig 4.13, 4.28 A or (resid 61 and name HN) (resid 59 and name HN) ! 0.1348 971:10 ----- 5.54, 5.88 A assign (resid 60 and name HN) (resid 59 and name HN) 2.30 0.50 0.50 ! 0.0000 972:10 Seq 2.24, 2.38 A assign (resid 58 and name HN) (resid 59 and name HN) 2.30 0.50 0.50 ! 0.9884 973:10 Seq 2.19, 2.41 A assign (resid 56 and name HD21) (resid 59 and name HN) 3.65 1.85 1.85 ! 0.0000 974:10 Mid 2.53, 3.43 A assign (resid 59 and name HN) (resid 60 and name HN) 2.30 0.50 0.50 ! 0.0000 975:10 Seq 2.24, 2.38 A assign (resid 61 and name HB1) (resid 61 and name HN) 3.65 1.85 1.85 ! 0.6865 976:10 Ambig 2.56, 3.36 A or (resid 61 and name HD1) (resid 61 and name HN) ! 0.3115 976:10 ----- 2.92, 4.66 A assign (resid 61 and name HD2) (resid 61 and name HN) 3.65 1.85 1.85 ! 0.8968 977:10 Ambig 2.77, 4.52 A or (resid 60 and name HB) (resid 61 and name HN) ! 0.0894 977:10 ----- 4.06, 4.24 A assign (resid 62 and name HB2) (resid 62 and name HN) 3.65 1.85 1.85 ! 0.9477 978:10 Intra 2.71, 3.07 A assign (resid 63 and name HG2*) (resid 62 and name HN) 3.65 1.85 1.85 ! 0.0000 979:10 Seq 3.66, 5.19 A assign (resid 62 and name HB2) (resid 63 and name HN) 3.65 1.85 1.85 ! 0.0000 980:10 Seq 4.34, 4.56 A assign (resid 65 and name HN) (resid 63 and name HN) 3.65 1.85 1.85 ! 0.7245 981:10 Ambig 4.03, 4.42 A or (resid 65 and name HD21) (resid 63 and name HN) ! 0.2755 981:10 ----- 4.74, 5.95 A assign (resid 65 and name HD22) (resid 65 and name HN) 3.65 1.85 1.85 ! 0.0000 982:10 Intra 3.40, 4.17 A assign (resid 66 and name HN) (resid 65 and name HN) 2.65 0.85 0.85 ! 0.0000 983:10 Seq 2.49, 2.77 A assign (resid 96 and name HN) (resid 95 and name HN) 3.65 1.85 1.85 ! 0.0000 984:10 Seq 4.37, 4.48 A assign (resid 65 and name HN) (resid 66 and name HN) 2.65 0.85 0.85 ! 0.9658 985:10 Seq 2.49, 2.77 A assign (resid 66 and name HN) (resid 67 and name HN) 3.15 1.35 1.35 ! 0.9966 986:10 Seq 2.29, 2.49 A assign (resid 64 and name HN) (resid 67 and name HN) 3.65 1.85 1.85 ! 0.0000 987:10 Mid 4.66, 4.93 A assign (resid 69 and name HD1*) (resid 68 and name HN) 3.15 1.35 1.35 ! 0.9914 988:10 Seq 3.05, 4.30 A assign (resid 63 and name HG2*) (resid 68 and name HN) 3.15 1.35 1.35 ! 0.6995 989:10 Ambig 3.80, 5.04 A or (resid 69 and name HG11) (resid 68 and name HN) ! 0.3005 989:10 ----- 4.37, 4.67 A assign (resid 82 and name HE*) (resid 69 and name HN) 3.65 1.85 1.85 ! 0.7995 990:10 Ambig 4.10, 5.67 A or (resid 68 and name HE*) (resid 69 and name HN) ! 0.1015 990:10 ----- 5.79, 6.11 A or (resid 66 and name HE*) (resid 69 and name HN) ! 0.0990 990:10 ----- 5.81, 7.68 A assign (resid 68 and name HN) (resid 69 and name HN) 3.65 1.85 1.85 ! 0.0000 991:10 Seq 3.97, 4.13 A assign (resid 81 and name HN) (resid 69 and name HN) 2.65 0.85 0.85 ! 0.7370 992:10 Ambig 3.35, 3.53 A or (resid 70 and name HN) (resid 69 and name HN) ! 0.2630 992:10 ----- 3.98, 4.06 A assign (resid 71 and name HN) (resid 70 and name HN) 3.65 1.85 1.85 ! 0.0000 994:10 Seq 3.96, 4.11 A assign (resid 69 and name HN) (resid 70 and name HN) 3.65 1.85 1.85 ! 0.0000 995:10 Seq 3.98, 4.06 A assign (resid 80 and name HB) (resid 71 and name HN) 4.15 2.35 2.35 ! 0.0000 996:10 Long 5.85, 6.10 A assign (resid 72 and name HG2*) (resid 71 and name HN) 4.15 2.35 2.35 ! 0.8745 997:10 Ambig 5.19, 6.60 A or (resid 69 and name HG11) (resid 71 and name HN) ! 0.1255 997:10 ----- 7.18, 7.48 A assign (resid 79 and name HN) (resid 71 and name HN) 3.15 1.35 1.35 ! 0.6357 998:10 Ambig 3.33, 3.69 A or (resid 70 and name HN) (resid 71 and name HN) ! 0.2232 998:10 ----- 3.96, 4.11 A or (resid 81 and name HN) (resid 71 and name HN) ! 0.1410 998:10 ----- 4.27, 4.61 A assign (resid 72 and name HN) (resid 71 and name HN) 3.65 1.85 1.85 ! 0.0000 999:10 Seq 4.08, 4.24 A assign (resid 74 and name HN) (resid 73 and name HN) 3.15 1.35 1.35 ! 0.0000 1001:10 Seq 4.40, 4.48 A assign (resid 72 and name HN) (resid 73 and name HN) 3.15 1.35 1.35 ! 0.0000 1002:10 Seq 3.74, 3.99 A assign (resid 73 and name HN) (resid 74 and name HN) 3.15 1.35 1.35 ! 0.0000 1004:10 Seq 4.40, 4.48 A assign (resid 75 and name HA) (resid 74 and name HN) 4.15 2.35 2.35 ! 0.0000 1005:10 Seq 5.74, 5.93 A assign (resid 77 and name HB1) (resid 76 and name HN) 4.15 2.35 2.35 ! 0.6793 1006:10 Ambig 5.89, 6.07 A or (resid 77 and name HD*) (resid 76 and name HN) ! 0.3207 1006:10 ----- 6.68, 7.36 A assign (resid 77 and name HG1) (resid 76 and name HN) 3.65 1.85 1.85 ! 0.7020 1007:10 Ambig 5.03, 5.42 A or (resid 74 and name HG2*) (resid 76 and name HN) ! 0.2980 1007:10 ----- 5.80, 6.92 A assign (resid 76 and name HA2) (resid 76 and name HN) 3.65 1.85 1.85 ! 0.0000 1008:10 Intra 2.38, 2.40 A assign (resid 77 and name HN) (resid 76 and name HN) 2.65 0.85 0.85 ! 0.0000 1009:10 Seq 2.14, 2.39 A assign (resid 50 and name HG1*) (resid 78 and name HN) 4.15 2.35 2.35 ! 0.0000 1012:10 Long 5.67, 7.03 A assign (resid 41 and name HN) (resid 78 and name HN) 2.65 0.85 0.85 ! 0.0000 1013:10 Long 2.68, 2.84 A assign (resid 72 and name HG2*) (resid 79 and name HN) 3.65 1.85 1.85 ! 0.0000 1014:10 Long 5.29, 6.43 A assign (resid 71 and name HN) (resid 79 and name HN) 3.15 1.35 1.35 ! 0.0000 1015:10 Long 3.33, 3.69 A assign (resid 41 and name HD1*) (resid 80 and name HN) 3.15 1.35 1.35 ! 0.4283 1016:10 Ambig 3.58, 5.24 A or (resid 78 and name HG2*) (resid 80 and name HN) ! 0.2305 1016:10 ----- 3.97, 5.25 A or (resid 41 and name HG11) (resid 80 and name HN) ! 0.1955 1016:10 ----- 4.08, 5.14 A or (resid 70 and name HG2*) (resid 80 and name HN) ! 0.0480 1016:10 ----- 5.16, 6.63 A or (resid 39 and name HE*) (resid 80 and name HN) ! 0.0232 1016:10 ----- 5.82, 6.91 A assign (resid 79 and name HB1) (resid 80 and name HN) 3.65 1.85 1.85 ! 0.0000 1017:10 Seq 3.54, 3.64 A assign (resid 79 and name HN) (resid 80 and name HN) 3.15 1.35 1.35 ! 0.5360 1018:10 Ambig 4.19, 4.28 A or (resid 81 and name HN) (resid 80 and name HN) ! 0.4640 1018:10 ----- 4.29, 4.39 A assign (resid 39 and name HN) (resid 80 and name HN) 2.65 0.85 0.85 ! 0.0000 1019:10 Long 3.11, 3.26 A assign (resid 41 and name HN) (resid 80 and name HN) 3.65 1.85 1.85 ! 0.9706 1020:10 Long 4.06, 4.24 A assign (resid 40 and name HN) (resid 80 and name HN) 3.65 1.85 1.85 ! 0.0000 1021:10 Long 4.70, 4.87 A assign (resid 82 and name HN) (resid 81 and name HN) 3.15 1.35 1.35 ! 0.0000 1022:10 Seq 4.03, 4.14 A assign (resid 69 and name HN) (resid 81 and name HN) 3.15 1.35 1.35 ! 0.9917 1023:10 Long 3.35, 3.53 A assign (resid 83 and name HN) (resid 82 and name HN) 3.65 1.85 1.85 ! 0.7839 1024:10 Ambig 4.01, 4.10 A or (resid 39 and name HN) (resid 82 and name HN) ! 0.2161 1024:10 ----- 4.97, 5.23 A assign (resid 81 and name HN) (resid 82 and name HN) 3.65 1.85 1.85 ! 0.0000 1025:10 Seq 4.03, 4.14 A assign (resid 37 and name HN) (resid 82 and name HN) 2.65 0.85 0.85 ! 0.0000 1026:10 Long 2.85, 3.07 A assign (resid 81 and name HG2*) (resid 83 and name HN) 3.65 1.85 1.85 ! 0.8971 1028:10 Ambig 3.50, 4.81 A or (resid 69 and name HG11) (resid 83 and name HN) ! 0.1029 1028:10 ----- 5.03, 5.32 A assign (resid 83 and name HG2*) (resid 83 and name HN) 2.65 0.85 0.85 ! 0.9893 1030:10 Intra 2.36, 3.41 A assign (resid 36 and name HB2) (resid 84 and name HN) 4.15 2.35 2.35 ! 0.7966 1031:10 Ambig 4.76, 5.90 A or (resid 36 and name HB1) (resid 84 and name HN) ! 0.2034 1031:10 ----- 5.97, 6.64 A assign (resid 36 and name HN) (resid 84 and name HN) 4.15 2.35 2.35 ! 0.0000 1032:10 Long 4.88, 5.35 A assign (resid 36 and name HA) (resid 84 and name HN) 3.65 1.85 1.85 ! 0.0000 1033:10 Long 3.68, 4.22 A assign (resid 86 and name HN) (resid 87 and name HN) 3.15 1.35 1.35 ! 0.0000 1034:10 Seq 2.25, 2.46 A assign (resid 88 and name HN) (resid 87 and name HN) 3.65 1.85 1.85 ! 0.0000 1035:10 Seq 2.73, 2.90 A assign (resid 87 and name HB2) (resid 88 and name HN) 3.65 1.85 1.85 ! 0.6291 1036:10 Ambig 4.01, 4.08 A or (resid 141 and name HB2) (resid 139 and name HD22) ! 0.1636 1036:10 ----- 5.02, 6.03 A or (resid 118 and name HB) (resid 139 and name HD22) ! 0.1062 1036:10 ----- 5.40, 7.11 A or (resid 91 and name HG1) (resid 88 and name HN) ! 0.0423 1036:10 ----- 6.29, 7.10 A assign (resid 89 and name HB2) (resid 88 and name HN) 3.65 1.85 1.85 ! 0.8799 1037:10 Ambig 4.29, 4.54 A or (resid 128 and name HB2) (resid 88 and name HN) ! 0.1201 1037:10 ----- 5.98, 6.94 A assign (resid 89 and name HN) (resid 88 and name HN) 2.65 0.85 0.85 ! 0.9897 1039:10 Seq 2.17, 2.31 A assign (resid 89 and name HB1) (resid 89 and name HN) 3.15 1.35 1.35 ! 0.8647 1040:10 Ambig 3.60, 3.68 A or (resid 91 and name HB1) (resid 89 and name HN) ! 0.0701 1040:10 ----- 5.48, 5.90 A assign (resid 88 and name HN) (resid 89 and name HN) 2.65 0.85 0.85 ! 0.9721 1041:10 Seq 2.17, 2.31 A assign (resid 90 and name HN) (resid 89 and name HN) 3.65 1.85 1.85 ! 0.9975 1042:10 Seq 2.06, 2.19 A assign (resid 30 and name HB) (resid 28 and name HN) 4.15 2.35 2.35 ! 0.6469 1043:10 Ambig 4.37, 4.80 A or (resid 7 and name HD*) (resid 28 and name HN) ! 0.2973 1043:10 ----- 4.98, 6.46 A assign (resid 88 and name HB*) (resid 90 and name HN) 3.65 1.85 1.85 ! 0.0000 1044:10 Mid 4.94, 5.65 A assign (resid 6 and name HG1*) (resid 30 and name HN) 3.65 1.85 1.85 ! 0.0000 1046:10 Long 3.35, 4.95 A assign (resid 92 and name HG12) (resid 93 and name HN) 3.65 1.85 1.85 ! 0.0000 1047:10 Seq 4.74, 4.85 A assign (resid 94 and name HG1*) (resid 93 and name HN) 2.65 0.85 0.85 ! 0.5556 1048:10 Ambig 3.21, 4.50 A or (resid 59 and name HD2*) (resid 93 and name HN) ! 0.4444 1048:10 ----- 3.33, 5.21 A assign (resid 92 and name HN) (resid 93 and name HN) 3.65 1.85 1.85 ! 0.0000 1049:10 Seq 3.81, 4.00 A assign (resid 59 and name HD2*) (resid 94 and name HN) 2.65 0.85 0.85 ! 0.6166 1050:10 Ambig 2.71, 3.99 A or (resid 94 and name HG1*) (resid 94 and name HN) ! 0.3714 1050:10 ----- 2.95, 3.96 A assign (resid 93 and name HB2) (resid 94 and name HN) 3.65 1.85 1.85 ! 0.9739 1051:10 Seq 3.84, 4.31 A assign (resid 93 and name HN) (resid 94 and name HN) 2.30 0.50 0.50 ! 0.0000 1052:10 Seq 2.02, 2.17 A assign (resid 59 and name HD1*) (resid 96 and name HN) 3.65 1.85 1.85 ! 0.0000 1053:10 Long 3.18, 4.90 A assign (resid 27 and name HN) (resid 96 and name HN) 3.15 1.35 1.35 ! 0.9770 1054:10 Long 2.89, 3.10 A assign (resid 27 and name HG2*) (resid 96 and name HN) 2.65 0.85 0.85 ! 0.9955 1055:10 Long 2.15, 3.30 A assign (resid 105 and name HD1*) (resid 15 and name HN) 3.15 1.35 1.35 ! 0.5193 1056:10 Ambig 3.89, 4.30 A or (resid 59 and name HD2*) (resid 96 and name HN) ! 0.2885 1056:10 ----- 4.29, 5.79 A or (resid 27 and name HD1*) (resid 96 and name HN) ! 0.1121 1056:10 ----- 5.03, 6.19 A or (resid 21 and name HG1*) (resid 15 and name HN) ! 0.0802 1056:10 ----- 5.31, 6.67 A assign (resid 97 and name HG11) (resid 97 and name HN) 3.15 1.35 1.35 ! 0.9525 1057:10 Intra 3.75, 3.94 A assign (resid 56 and name HD21) (resid 97 and name HN) 3.15 1.35 1.35 ! 0.0000 1058:10 Long 3.12, 3.45 A assign (resid 98 and name HD2*) (resid 98 and name HN) 3.15 1.35 1.35 ! 0.4655 1059:10 Ambig 4.74, 5.27 A or (resid 98 and name HD1*) (resid 98 and name HN) ! 0.4653 1059:10 ----- 4.74, 5.22 A assign (resid 97 and name HG11) (resid 98 and name HN) 4.15 2.35 2.35 ! 0.9489 1060:10 Seq 3.97, 4.19 A assign (resid 25 and name HN) (resid 98 and name HN) 3.65 1.85 1.85 ! 0.6881 1061:10 Ambig 3.81, 3.96 A or (resid 97 and name HN) (resid 98 and name HN) ! 0.3119 1061:10 ----- 4.35, 4.46 A assign (resid 25 and name HN) (resid 99 and name HN) 3.15 1.35 1.35 ! 0.9879 1062:10 Long 2.95, 3.05 A assign (resid 48 and name HN) (resid 49 and name HN) 3.65 1.85 1.85 ! 0.0000 1064:10 Seq 4.29, 4.37 A assign (resid 54 and name HB2) (resid 100 and name HN) 3.15 1.35 1.35 ! 0.9516 1065:10 Long 2.85, 3.25 A assign (resid 52 and name HN) (resid 102 and name HN) 3.15 1.35 1.35 ! 0.0000 1066:10 Long 3.33, 3.65 A assign (resid 54 and name HN) (resid 102 and name HN) 3.65 1.85 1.85 ! 0.0000 1067:10 Long 3.77, 4.19 A assign (resid 103 and name HN) (resid 102 and name HN) 3.15 1.35 1.35 ! 0.0000 1068:10 Seq 4.19, 4.28 A assign (resid 101 and name HN) (resid 102 and name HN) 3.65 1.85 1.85 ! 0.0000 1069:10 Seq 4.30, 4.42 A assign (resid 22 and name HB*) (resid 103 and name HN) 3.65 1.85 1.85 ! 0.0000 1071:10 Long 3.92, 5.33 A assign (resid 20 and name HG2*) (resid 103 and name HN) 3.15 1.35 1.35 ! 0.9535 1072:10 Long 3.54, 4.26 A assign (resid 103 and name HE*) (resid 103 and name HN) 3.65 1.85 1.85 ! 0.0000 1073:10 Intra 5.12, 5.96 A assign (resid 21 and name HN) (resid 103 and name HN) 2.65 0.85 0.85 ! 0.8905 1074:10 Ambig 3.05, 3.28 A or (resid 104 and name HN) (resid 103 and name HN) ! 0.1095 1074:10 ----- 4.32, 4.37 A assign (resid 104 and name HG11) (resid 104 and name HN) 2.65 0.85 0.85 ! 0.0000 1075:10 Intra 2.22, 2.41 A assign (resid 103 and name HB1) (resid 104 and name HN) 3.15 1.35 1.35 ! 0.0000 1076:10 Seq 2.67, 2.95 A assign (resid 49 and name HN) (resid 104 and name HN) 3.15 1.35 1.35 ! 0.0000 1077:10 Long 2.61, 2.83 A assign (resid 51 and name HN) (resid 104 and name HN) 3.15 1.35 1.35 ! 0.5326 1078:10 Ambig 3.77, 4.12 A or (resid 103 and name HN) (resid 104 and name HN) ! 0.2350 1078:10 ----- 4.32, 4.37 A or (resid 105 and name HN) (resid 104 and name HN) ! 0.2323 1078:10 ----- 4.33, 4.41 A assign (resid 103 and name HB2) (resid 105 and name HN) 4.15 2.35 2.35 ! 0.8869 1079:10 Ambig 5.00, 5.23 A or (resid 17 and name HB2) (resid 105 and name HN) ! 0.1131 1079:10 ----- 7.04, 7.67 A assign (resid 21 and name HN) (resid 105 and name HN) 3.15 1.35 1.35 ! 0.8015 1080:10 Ambig 3.43, 3.77 A or (resid 104 and name HN) (resid 105 and name HN) ! 0.1985 1080:10 ----- 4.33, 4.41 A assign (resid 47 and name HB*) (resid 106 and name HN) 3.65 1.85 1.85 ! 0.0000 1081:10 Long 4.56, 5.62 A assign (resid 106 and name HD21) (resid 106 and name HN) 3.65 1.85 1.85 ! 0.0000 1082:10 Intra 2.32, 4.23 A assign (resid 49 and name HN) (resid 106 and name HN) 3.15 1.35 1.35 ! 0.7252 1083:10 Ambig 3.81, 4.17 A or (resid 107 and name HN) (resid 106 and name HN) ! 0.2748 1083:10 ----- 4.48, 4.56 A assign (resid 109 and name HB*) (resid 108 and name HN) 3.15 1.35 1.35 ! 0.0000 1085:10 Seq 3.95, 4.93 A assign (resid 109 and name HN) (resid 108 and name HN) 2.30 0.50 0.50 ! 0.9857 1087:10 Seq 2.16, 2.49 A assign (resid 107 and name HN) (resid 108 and name HN) 2.65 0.85 0.85 ! 0.0000 1088:10 Seq 2.24, 2.37 A assign (resid 108 and name HN) (resid 109 and name HN) 2.65 0.85 0.85 ! 0.9991 1089:10 Seq 2.16, 2.49 A assign (resid 47 and name HG2) (resid 110 and name HN) 3.15 1.35 1.35 ! 0.9656 1090:10 Long 2.56, 4.27 A assign (resid 47 and name HB*) (resid 110 and name HN) 3.65 1.85 1.85 ! 0.0000 1091:10 Long 3.67, 4.91 A assign (resid 111 and name HN) (resid 110 and name HN) 3.65 1.85 1.85 ! 0.0000 1092:10 Seq 4.41, 4.48 A assign (resid 144 and name HG2*) (resid 111 and name HN) 4.15 2.35 2.35 ! 0.6238 1094:10 Ambig 5.68, 6.69 A or (resid 47 and name HG2) (resid 111 and name HN) ! 0.3762 1094:10 ----- 6.18, 7.46 A assign (resid 112 and name HN) (resid 111 and name HN) 3.65 1.85 1.85 ! 0.9337 1095:10 Seq 4.47, 4.57 A assign (resid 47 and name HE*) (resid 112 and name HN) 4.15 2.35 2.35 ! 0.0000 1096:10 Long 4.89, 6.66 A assign (resid 144 and name HN) (resid 112 and name HN) 3.15 1.35 1.35 ! 0.9928 1097:10 Long 2.84, 3.14 A assign (resid 111 and name HN) (resid 112 and name HN) 3.65 1.85 1.85 ! 0.0000 1098:10 Seq 4.47, 4.57 A assign (resid 141 and name HD1) (resid 113 and name HN) 4.15 2.35 2.35 ! 0.5581 1100:10 Ambig 5.08, 7.10 A or (resid 141 and name HG2) (resid 113 and name HN) ! 0.2635 1100:10 ----- 5.76, 6.22 A or (resid 111 and name HB*) (resid 113 and name HN) ! 0.1784 1100:10 ----- 6.15, 7.15 A assign (resid 144 and name HN) (resid 113 and name HN) 3.65 1.85 1.85 ! 0.9752 1101:10 Long 3.85, 4.51 A assign (resid 113 and name HB1) (resid 114 and name HN) 3.15 1.35 1.35 ! 0.9720 1102:10 Seq 2.77, 3.99 A assign (resid 142 and name HN) (resid 114 and name HN) 2.65 0.85 0.85 ! 0.9950 1103:10 Long 2.92, 3.13 A assign (resid 23 and name HG1*) (resid 116 and name HN) 3.65 1.85 1.85 ! 0.2534 1104:10 Ambig 5.35, 7.22 A or (resid 118 and name HG2*) (resid 116 and name HN) ! 0.2526 1104:10 ----- 5.35, 6.57 A or (resid 23 and name HG2*) (resid 116 and name HN) ! 0.1863 1104:10 ----- 5.63, 7.52 A or (resid 41 and name HG2*) (resid 116 and name HN) ! 0.1791 1104:10 ----- 5.67, 6.47 A or (resid 10 and name HG2*) (resid 116 and name HN) ! 0.1285 1104:10 ----- 5.99, 7.20 A assign (resid 115 and name HN) (resid 116 and name HN) 3.65 1.85 1.85 ! 0.0000 1105:10 Seq 4.44, 4.48 A assign (resid 142 and name HN) (resid 116 and name HN) 3.65 1.85 1.85 ! 0.0000 1106:10 Long 4.22, 4.43 A assign (resid 136 and name HB*) (resid 136 and name HN) 2.65 0.85 0.85 ! 0.9534 1107:10 Intra 2.59, 3.18 A assign (resid 39 and name HB*) (resid 119 and name HN) 3.65 1.85 1.85 ! 0.8309 1108:10 Ambig 4.79, 5.91 A or (resid 123 and name HB1) (resid 119 and name HN) ! 0.1691 1108:10 ----- 6.24, 6.59 A assign (resid 119 and name HB1) (resid 119 and name HN) 3.15 1.35 1.35 ! 0.0000 1109:10 Intra 2.34, 2.51 A assign (resid 118 and name HN) (resid 119 and name HN) 3.65 1.85 1.85 ! 0.0000 1111:10 Seq 4.25, 4.38 A assign (resid 121 and name HB*) (resid 121 and name HN) 2.30 0.50 0.50 ! 0.9025 1112:10 Ambig 2.46, 2.94 A or (resid 141 and name HB1) (resid 142 and name HN) ! 0.0526 1112:10 ----- 3.95, 4.05 A assign (resid 122 and name HN) (resid 121 and name HN) 2.65 0.85 0.85 ! 0.0000 1113:10 Seq 2.22, 2.42 A assign (resid 123 and name HN) (resid 121 and name HN) 3.15 1.35 1.35 ! 0.0000 1114:10 Mid 3.23, 3.49 A assign (resid 123 and name HN) (resid 122 and name HN) 2.65 0.85 0.85 ! 0.0000 1116:10 Seq 2.24, 2.39 A assign (resid 121 and name HN) (resid 122 and name HN) 2.30 0.50 0.50 ! 0.0000 1117:10 Seq 2.22, 2.42 A assign (resid 123 and name HD2*) (resid 123 and name HN) 3.15 1.35 1.35 ! 0.0000 1118:10 Intra 4.47, 5.22 A assign (resid 122 and name HN) (resid 123 and name HN) 2.65 0.85 0.85 ! 0.0000 1119:10 Seq 2.24, 2.39 A assign (resid 121 and name HN) (resid 123 and name HN) 3.65 1.85 1.85 ! 0.0000 1120:10 Mid 3.23, 3.49 A assign (resid 124 and name HN) (resid 123 and name HN) 3.65 1.85 1.85 ! 0.0000 1121:10 Seq 4.07, 4.28 A assign (resid 124 and name HG11) (resid 124 and name HN) 2.65 0.85 0.85 ! 0.9835 1122:10 Intra 2.45, 2.88 A assign (resid 123 and name HG) (resid 124 and name HN) 3.65 1.85 1.85 ! 0.0000 1123:10 Seq 3.51, 4.14 A assign (resid 40 and name HN) (resid 124 and name HN) 4.15 2.35 2.35 ! 0.7417 1124:10 Ambig 5.50, 5.84 A or (resid 37 and name HN) (resid 124 and name HN) ! 0.2583 1124:10 ----- 6.56, 6.81 A assign (resid 125 and name HN) (resid 124 and name HN) 3.65 1.85 1.85 ! 0.0000 1125:10 Seq 4.14, 4.26 A assign (resid 38 and name HN) (resid 124 and name HN) 3.15 1.35 1.35 ! 0.9942 1126:10 Long 2.56, 2.70 A assign (resid 125 and name HG1*) (resid 125 and name HN) 2.65 0.85 0.85 ! 0.8319 1127:10 Ambig 2.31, 4.60 A or (resid 125 and name HG2*) (resid 125 and name HN) ! 0.1656 1127:10 ----- 3.02, 4.02 A assign (resid 127 and name HN) (resid 126 and name HN) 3.65 1.85 1.85 ! 0.9027 1128:10 Ambig 4.33, 4.39 A or (resid 131 and name HN) (resid 126 and name HN) ! 0.0973 1128:10 ----- 6.28, 6.44 A assign (resid 130 and name HN) (resid 127 and name HN) 3.15 1.35 1.35 ! 0.7765 1129:10 Ambig 3.51, 3.86 A or (resid 128 and name HN) (resid 127 and name HN) ! 0.2235 1129:10 ----- 4.32, 4.43 A assign (resid 128 and name HG2) (resid 128 and name HN) 2.65 0.85 0.85 ! 0.7711 1130:10 Ambig 1.99, 2.76 A or (resid 149 and name HB2) (resid 150 and name HN) ! 0.2289 1130:10 ----- 2.44, 3.54 A assign (resid 87 and name HB2) (resid 89 and name HN) 4.15 2.35 2.35 ! 0.3358 1131:10 Ambig 5.23, 5.43 A or (resid 33 and name HG2) (resid 129 and name HN) ! 0.2756 1131:10 ----- 5.41, 6.86 A or (resid 91 and name HG1) (resid 89 and name HN) ! 0.2690 1131:10 ----- 5.43, 6.10 A or (resid 131 and name HB1) (resid 129 and name HN) ! 0.1195 1131:10 ----- 6.21, 6.70 A assign (resid 87 and name HN) (resid 89 and name HN) 3.15 1.35 1.35 ! 0.5538 1133:10 Ambig 4.16, 4.31 A or (resid 129 and name HD21) (resid 129 and name HN) ! 0.4196 1133:10 ----- 4.35, 4.63 A assign (resid 130 and name HN) (resid 129 and name HN) 2.30 0.50 0.50 ! 0.6166 1134:10 Ambig 2.08, 2.42 A or (resid 128 and name HN) (resid 129 and name HN) ! 0.3834 1134:10 ----- 2.26, 2.60 A assign (resid 131 and name HD*) (resid 131 and name HN) 3.15 1.35 1.35 ! 0.0000 1135:10 Intra 3.24, 4.51 A assign (resid 130 and name HB1) (resid 131 and name HN) 3.65 1.85 1.85 ! 0.0000 1136:10 Seq 3.89, 4.47 A assign (resid 130 and name HN) (resid 131 and name HN) 2.65 0.85 0.85 ! 0.9817 1137:10 Seq 2.56, 2.77 A assign (resid 133 and name HN) (resid 132 and name HN) 3.65 1.85 1.85 ! 0.8340 1139:10 Ambig 4.16, 4.32 A or (resid 30 and name HN) (resid 32 and name HN) ! 0.1660 1139:10 ----- 5.44, 6.06 A assign (resid 10 and name HG1*) (resid 138 and name HN) 3.65 1.85 1.85 ! 0.7489 1140:10 Ambig 4.94, 6.19 A or (resid 117 and name HG2*) (resid 138 and name HN) ! 0.2511 1140:10 ----- 5.92, 7.44 A assign (resid 120 and name HG*) (resid 138 and name HN) 3.65 1.85 1.85 ! 0.0000 1142:10 Long 2.53, 5.07 A assign (resid 139 and name HD22) (resid 139 and name HN) 4.15 2.35 2.35 ! 0.0000 1146:10 Intra 4.65, 5.86 A assign (resid 139 and name HD21) (resid 139 and name HN) 3.65 1.85 1.85 ! 0.0000 1147:10 Intra 3.84, 4.84 A assign (resid 116 and name HD1*) (resid 140 and name HN) 3.65 1.85 1.85 ! 0.9354 1148:10 Long 3.61, 5.33 A assign (resid 116 and name HN) (resid 140 and name HN) 3.65 1.85 1.85 ! 0.9063 1149:10 Ambig 3.20, 3.55 A or (resid 117 and name HN) (resid 140 and name HN) ! 0.0563 1149:10 ----- 5.09, 5.57 A assign (resid 139 and name HN) (resid 140 and name HN) 3.65 1.85 1.85 ! 0.9963 1150:10 Seq 2.29, 3.32 A assign (resid 142 and name HD1*) (resid 142 and name HN) 3.15 1.35 1.35 ! 0.0000 1151:10 Intra 4.19, 4.82 A assign (resid 15 and name HN) (resid 143 and name HN) 2.65 0.85 0.85 ! 0.4099 1152:10 Ambig 3.88, 4.07 A or (resid 142 and name HN) (resid 143 and name HN) ! 0.3308 1152:10 ----- 4.02, 4.14 A or (resid 144 and name HN) (resid 143 and name HN) ! 0.2594 1152:10 ----- 4.19, 4.23 A assign (resid 13 and name HN) (resid 143 and name HN) 3.15 1.35 1.35 ! 0.0000 1153:10 Long 3.53, 3.66 A assign (resid 6 and name HG2*) (resid 6 and name HN) 2.65 0.85 0.85 ! 0.9072 1154:10 Ambig 2.14, 3.46 A or (resid 5 and name HG2*) (resid 6 and name HN) ! 0.0765 1154:10 ----- 3.23, 4.17 A assign (resid 112 and name HN) (resid 144 and name HN) 2.65 0.85 0.85 ! 0.9049 1155:10 Ambig 2.84, 3.14 A or (resid 145 and name HN) (resid 144 and name HN) ! 0.0852 1155:10 ----- 4.20, 4.31 A assign (resid 105 and name HD1*) (resid 145 and name HN) 3.65 1.85 1.85 ! 0.0000 1156:10 Long 4.49, 5.42 A assign (resid 111 and name HB*) (resid 145 and name HN) 3.65 1.85 1.85 ! 0.0000 1157:10 Long 4.56, 5.82 A assign (resid 15 and name HN) (resid 145 and name HN) 2.65 0.85 0.85 ! 0.9155 1158:10 Ambig 2.83, 3.17 A or (resid 144 and name HN) (resid 145 and name HN) ! 0.0845 1158:10 ----- 4.20, 4.31 A assign (resid 146 and name HN) (resid 145 and name HN) 3.65 1.85 1.85 ! 0.9468 1159:10 Seq 2.52, 3.84 A assign (resid 87 and name HN) (resid 86 and name HN) 2.65 0.85 0.85 ! 0.0000 1160:10 Seq 2.25, 2.46 A assign (resid 145 and name HN) (resid 146 and name HN) 3.15 1.35 1.35 ! 0.9617 1161:10 Seq 2.52, 3.84 A assign (resid 128 and name HG1) (resid 130 and name HN) 3.65 1.85 1.85 ! 0.8733 1162:10 Ambig 4.43, 4.87 A or (resid 131 and name HB1) (resid 130 and name HN) ! 0.1267 1162:10 ----- 6.12, 6.38 A assign (resid 133 and name HG11) (resid 128 and name HN) 4.15 2.35 2.35 ! 0.5924 1163:10 Ambig 6.30, 7.67 A or (resid 34 and name HG1*) (resid 128 and name HN) ! 0.4076 1163:10 ----- 6.71, 7.29 A assign (resid 4 and name HB2) (resid 4 and name HN) 3.15 1.35 1.35 ! 0.0000 1164:10 Intra 2.29, 3.40 A assign (resid 7 and name HD*) (resid 7 and name HN) 3.65 1.85 1.85 ! 0.5055 1165:10 Ambig 4.11, 4.76 A or (resid 30 and name HB) (resid 7 and name HN) ! 0.3918 1165:10 ----- 4.29, 5.05 A or (resid 8 and name HB2) (resid 7 and name HN) ! 0.0834 1165:10 ----- 5.55, 6.21 A assign (resid 59 and name HB2) (resid 56 and name HD22) 3.65 1.85 1.85 ! 0.0000 1166:10 Mid 3.61, 4.61 A assign (resid 59 and name HB1) (resid 56 and name HD22) 3.65 1.85 1.85 ! 0.8241 1167:10 Ambig 4.44, 5.62 A or (resid 97 and name HG11) (resid 56 and name HD22) ! 0.1047 1167:10 ----- 6.27, 7.03 A assign (resid 97 and name HN) (resid 56 and name HD21) 3.15 1.35 1.35 ! 0.8974 1168:10 Ambig 3.12, 3.45 A or (resid 57 and name HN) (resid 56 and name HD21) ! 0.1026 1168:10 ----- 4.47, 5.30 A assign (resid 89 and name HB1) (resid 89 and name HD21) 2.65 0.85 0.85 ! 0.0000 1169:10 Intra 2.86, 3.22 A assign (resid 89 and name HB1) (resid 89 and name HD22) 3.15 1.35 1.35 ! 0.0000 1170:10 Intra 3.75, 3.92 A assign (resid 88 and name HB*) (resid 89 and name HD21) 3.65 1.85 1.85 ! 0.0000 1171:10 Seq 2.48, 5.12 A assign (resid 106 and name HN) (resid 106 and name HD21) 3.65 1.85 1.85 ! 0.0000 1172:10 Intra 2.32, 4.23 A assign (resid 89 and name HN) (resid 89 and name HD21) 3.15 1.35 1.35 ! 0.0000 1173:10 Intra 2.07, 3.19 A assign (resid 78 and name HD1*) (resid 78 and name HN) 3.15 1.35 1.35 ! 0.7294 1175:10 Ambig 4.15, 4.86 A or (resid 80 and name HG1*) (resid 78 and name HN) ! 0.1553 1175:10 ----- 5.37, 6.23 A or (resid 80 and name HD1*) (resid 78 and name HN) ! 0.0578 1175:10 ----- 6.34, 7.17 A assign (resid 78 and name HG1*) (resid 78 and name HN) 3.15 1.35 1.35 ! 0.9983 1176:10 Intra 2.47, 3.27 A assign (resid 3 and name HD21) (resid 3 and name HN) 3.65 1.85 1.85 ! 0.0000 1178:10 Intra 2.60, 4.30 A assign (resid 3 and name HD22) (resid 3 and name HN) 4.15 2.35 2.35 ! 0.8215 1179:10 Ambig 3.76, 4.80 A or (resid 129 and name HD22) (resid 3 and name HN) ! 0.1785 1179:10 ----- 4.85, 7.12 A assign (resid 5 and name HB) (resid 5 and name HN) 3.15 1.35 1.35 ! 0.0000 1184:10 Intra 2.48, 2.63 A assign (resid 141 and name HN) (resid 13 and name HN) 3.15 1.35 1.35 ! 0.4867 1185:10 Ambig 3.59, 3.81 A or (resid 6 and name HN) (resid 5 and name HN) ! 0.2963 1185:10 ----- 3.90, 4.18 A or (resid 4 and name HN) (resid 5 and name HN) ! 0.2106 1185:10 ----- 4.13, 4.39 A assign (resid 4 and name HB2) (resid 5 and name HN) 3.15 1.35 1.35 ! 0.0000 1186:10 Seq 1.86, 2.50 A assign (resid 5 and name HN) (resid 6 and name HN) 3.65 1.85 1.85 ! 0.5924 1187:10 Ambig 3.90, 4.18 A or (resid 7 and name HN) (resid 6 and name HN) ! 0.4076 1187:10 ----- 4.15, 4.34 A assign (resid 7 and name HG2) (resid 7 and name HN) 3.15 1.35 1.35 ! 0.9573 1188:10 Intra 3.15, 3.77 A assign (resid 6 and name HG2*) (resid 7 and name HN) 3.15 1.35 1.35 ! 0.7105 1189:10 Ambig 2.92, 4.82 A or (resid 5 and name HG2*) (resid 7 and name HN) ! 0.1138 1189:10 ----- 3.97, 5.68 A or (resid 8 and name HD2*) (resid 7 and name HN) ! 0.0884 1189:10 ----- 4.14, 6.28 A or (resid 27 and name HG11) (resid 7 and name HN) ! 0.0634 1189:10 ----- 4.37, 4.80 A assign (resid 12 and name HB) (resid 12 and name HN) 3.15 1.35 1.35 ! 0.0000 1192:10 Intra 2.48, 2.54 A assign (resid 12 and name HB) (resid 13 and name HN) 3.65 1.85 1.85 ! 0.0000 1193:10 Seq 4.03, 4.12 A assign (resid 14 and name HA) (resid 13 and name HN) 3.65 1.85 1.85 ! 0.0000 1194:10 Seq 4.63, 4.72 A assign (resid 106 and name HD21) (resid 108 and name HN) 3.65 1.85 1.85 ! 0.9542 1195:10 Mid 3.41, 4.33 A assign (resid 12 and name HG2*) (resid 14 and name HN) 4.15 2.35 2.35 ! 0.6792 1196:10 Ambig 4.98, 6.21 A or (resid 145 and name HG2*) (resid 14 and name HN) ! 0.2507 1196:10 ----- 5.88, 7.01 A assign (resid 21 and name HB) (resid 15 and name HN) 3.65 1.85 1.85 ! 0.0000 1197:10 Long 4.90, 5.28 A assign (resid 19 and name HB1) (resid 18 and name HN) 3.65 1.85 1.85 ! 0.6335 1198:10 Ambig 4.42, 4.67 A or (resid 16 and name HB2) (resid 18 and name HN) ! 0.2224 1198:10 ----- 5.27, 5.75 A or (resid 106 and name HB2) (resid 18 and name HN) ! 0.1442 1198:10 ----- 5.66, 6.03 A assign (resid 105 and name HN) (resid 19 and name HN) 3.15 1.35 1.35 ! 0.0000 1199:10 Long 3.78, 4.08 A assign (resid 19 and name HB1) (resid 19 and name HN) 2.65 0.85 0.85 ! 0.9138 1200:10 Ambig 2.25, 2.44 A or (resid 16 and name HB2) (resid 19 and name HN) ! 0.0862 1200:10 ----- 3.34, 4.28 A assign (resid 16 and name HN) (resid 20 and name HN) 4.15 2.35 2.35 ! 0.0000 1201:10 Mid 5.32, 5.76 A assign (resid 25 and name HG1*) (resid 27 and name HN) 3.65 1.85 1.85 ! 0.6690 1202:10 Ambig 4.65, 5.99 A or (resid 27 and name HD1*) (resid 27 and name HN) ! 0.3310 1202:10 ----- 5.23, 5.70 A assign (resid 28 and name HN) (resid 27 and name HN) 3.65 1.85 1.85 ! 0.0000 1203:10 Seq 4.21, 4.35 A assign (resid 27 and name HN) (resid 28 and name HN) 3.15 1.35 1.35 ! 0.0000 1205:10 Seq 4.21, 4.35 A assign (resid 131 and name HE*) (resid 132 and name HN) 4.15 2.35 2.35 ! 0.0000 1206:10 Seq 3.43, 5.54 A assign (resid 37 and name HG12) (resid 36 and name HN) 3.65 1.85 1.85 ! 0.0000 1208:10 Seq 4.40, 5.13 A assign (resid 126 and name HN) (resid 36 and name HN) 3.65 1.85 1.85 ! 0.0000 1209:10 Long 3.05, 3.28 A assign (resid 38 and name HN) (resid 37 and name HN) 3.65 1.85 1.85 ! 0.7171 1210:10 Ambig 4.10, 4.22 A or (resid 126 and name HN) (resid 37 and name HN) ! 0.2829 1210:10 ----- 4.79, 4.88 A assign (resid 82 and name HN) (resid 37 and name HN) 3.15 1.35 1.35 ! 0.0000 1211:10 Long 2.85, 3.07 A assign (resid 37 and name HN) (resid 38 and name HN) 3.65 1.85 1.85 ! 0.9571 1212:10 Seq 4.10, 4.22 A assign (resid 80 and name HB) (resid 39 and name HN) 3.15 1.35 1.35 ! 0.9695 1213:10 Long 3.39, 3.55 A assign (resid 80 and name HG1*) (resid 41 and name HN) 3.15 1.35 1.35 ! 0.5140 1214:10 Ambig 4.06, 5.21 A or (resid 78 and name HD1*) (resid 41 and name HN) ! 0.2983 1214:10 ----- 4.45, 5.68 A or (resid 80 and name HD1*) (resid 41 and name HN) ! 0.1572 1214:10 ----- 4.95, 5.86 A assign (resid 47 and name HD2) (resid 44 and name HN) 4.15 2.35 2.35 ! 0.9172 1215:10 Ambig 4.13, 5.29 A or (resid 116 and name HB2) (resid 44 and name HN) ! 0.0828 1215:10 ----- 6.16, 7.02 A assign (resid 44 and name HB1) (resid 48 and name HN) 3.15 1.35 1.35 ! 0.7921 1216:10 Ambig 3.17, 3.94 A or (resid 106 and name HB2) (resid 48 and name HN) ! 0.1478 1216:10 ----- 4.20, 4.47 A assign (resid 26 and name HN) (resid 9 and name HN) 3.15 1.35 1.35 ! 0.7042 1217:10 Ambig 3.30, 3.49 A or (resid 101 and name HN) (resid 100 and name HN) ! 0.1670 1217:10 ----- 4.19, 4.28 A or (resid 27 and name HN) (resid 9 and name HN) ! 0.1020 1217:10 ----- 4.55, 4.75 A assign (resid 51 and name HG*) (resid 51 and name HN) 2.65 0.85 0.85 ! 0.0000 1218:10 Intra 2.26, 3.23 A assign (resid 51 and name HD2) (resid 51 and name HN) 3.65 1.85 1.85 ! 0.9732 1219:10 Intra 3.80, 4.34 A assign (resid 51 and name HE*) (resid 51 and name HN) 3.65 1.85 1.85 ! 0.0000 1220:10 Intra 2.55, 5.46 A assign (resid 50 and name HG1*) (resid 52 and name HN) 4.15 2.35 2.35 ! 0.0000 1221:10 Mid 4.77, 5.76 A assign (resid 51 and name HD2) (resid 52 and name HN) 4.15 2.35 2.35 ! 0.5451 1222:10 Ambig 5.00, 5.48 A or (resid 54 and name HG) (resid 52 and name HN) ! 0.4056 1222:10 ----- 5.25, 5.85 A assign (resid 100 and name HN) (resid 54 and name HN) 3.15 1.35 1.35 ! 0.0000 1223:10 Long 2.69, 2.98 A assign (resid 55 and name HG2) (resid 56 and name HN) 3.65 1.85 1.85 ! 0.8936 1224:10 Ambig 4.66, 4.84 A or (resid 25 and name HB) (resid 56 and name HN) ! 0.1064 1224:10 ----- 6.65, 6.83 A assign (resid 100 and name HN) (resid 56 and name HN) 3.65 1.85 1.85 ! 0.0000 1225:10 Long 4.20, 4.47 A assign (resid 141 and name HG2) (resid 142 and name HN) 3.15 1.35 1.35 ! 0.8302 1226:10 Ambig 2.67, 3.13 A or (resid 116 and name HG) (resid 142 and name HN) ! 0.1483 1226:10 ----- 3.56, 3.81 A assign (resid 100 and name HE*) (resid 57 and name HN) 3.65 1.85 1.85 ! 0.8807 1227:10 Ambig 3.67, 6.53 A or (resid 100 and name HD*) (resid 57 and name HN) ! 0.1193 1227:10 ----- 5.12, 7.60 A assign (resid 57 and name HG2*) (resid 58 and name HN) 3.15 1.35 1.35 ! 0.0000 1228:10 Seq 2.81, 5.04 A assign (resid 59 and name HD2*) (resid 58 and name HN) 3.65 1.85 1.85 ! 0.7865 1229:10 Ambig 4.57, 5.96 A or (resid 60 and name HG2*) (resid 58 and name HN) ! 0.2135 1229:10 ----- 5.67, 6.92 A assign (resid 57 and name HG2*) (resid 59 and name HN) 3.65 1.85 1.85 ! 0.5039 1230:10 Ambig 5.05, 6.28 A or (resid 92 and name HG12) (resid 59 and name HN) ! 0.4961 1230:10 ----- 5.06, 5.49 A assign (resid 55 and name HB2) (resid 59 and name HN) 4.15 2.35 2.35 ! 0.8049 1231:10 Ambig 5.72, 6.05 A or (resid 27 and name HG2*) (resid 59 and name HN) ! 0.1951 1231:10 ----- 7.25, 7.84 A assign (resid 59 and name HD1*) (resid 60 and name HN) 3.65 1.85 1.85 ! 0.0000 1233:10 Seq 4.37, 5.21 A assign (resid 56 and name HN) (resid 60 and name HN) 3.15 1.35 1.35 ! 0.5112 1234:10 Ambig 3.95, 4.35 A or (resid 58 and name HN) (resid 60 and name HN) ! 0.4888 1234:10 ----- 3.98, 4.22 A assign (resid 61 and name HN) (resid 62 and name HN) 3.15 1.35 1.35 ! 0.9659 1235:10 Seq 4.18, 4.36 A assign (resid 64 and name HB2) (resid 64 and name HN) 2.65 0.85 0.85 ! 0.9745 1236:10 Intra 2.50, 2.58 A assign (resid 65 and name HB1) (resid 66 and name HN) 3.65 1.85 1.85 ! 0.0000 1237:10 Seq 4.02, 4.28 A assign (resid 69 and name HD1*) (resid 66 and name HN) 3.65 1.85 1.85 ! 0.0000 1238:10 Mid 5.61, 6.65 A assign (resid 68 and name HN) (resid 67 and name HN) 3.15 1.35 1.35 ! 0.0000 1240:10 Seq 1.92, 2.24 A assign (resid 2 and name HG1) (resid 1 and name HN) 4.15 2.35 2.35 ! 0.7724 1241:10 Ambig 3.35, 5.01 A or (resid 2 and name HG2) (resid 1 and name HN) ! 0.1945 1241:10 ----- 4.21, 5.65 A assign (resid 66 and name HN) (resid 68 and name HN) 3.15 1.35 1.35 ! 0.6416 1242:10 Ambig 3.56, 3.81 A or (resid 68 and name HD*) (resid 68 and name HN) ! 0.1883 1242:10 ----- 4.37, 4.73 A or (resid 82 and name HD*) (resid 68 and name HN) ! 0.1701 1242:10 ----- 4.44, 6.76 A assign (resid 67 and name HN) (resid 68 and name HN) 2.65 0.85 0.85 ! 0.9882 1243:10 Seq 1.92, 2.24 A assign (resid 69 and name HN) (resid 68 and name HN) 3.65 1.85 1.85 ! 0.0000 1244:10 Seq 3.97, 4.13 A assign (resid 71 and name HN) (resid 73 and name HN) 4.15 2.35 2.35 ! 0.0000 1245:10 Mid 4.79, 5.19 A assign (resid 78 and name HG1*) (resid 77 and name HN) 3.65 1.85 1.85 ! 0.0000 1246:10 Seq 4.32, 4.89 A assign (resid 76 and name HA2) (resid 77 and name HN) 3.65 1.85 1.85 ! 0.6719 1247:10 Ambig 3.19, 3.39 A or (resid 73 and name HB*) (resid 77 and name HN) ! 0.3281 1247:10 ----- 3.60, 4.76 A assign (resid 76 and name HN) (resid 77 and name HN) 2.65 0.85 0.85 ! 0.0000 1248:10 Seq 2.14, 2.39 A assign (resid 78 and name HN) (resid 77 and name HN) 3.65 1.85 1.85 ! 0.0000 1249:10 Seq 4.22, 4.35 A assign (resid 77 and name HG2) (resid 78 and name HN) 3.15 1.35 1.35 ! 0.0000 1250:10 Seq 3.40, 3.76 A assign (resid 80 and name HN) (resid 79 and name HN) 3.65 1.85 1.85 ! 0.0000 1251:10 Seq 4.19, 4.28 A assign (resid 80 and name HN) (resid 81 and name HN) 3.15 1.35 1.35 ! 0.0000 1252:10 Seq 4.29, 4.39 A assign (resid 82 and name HA) (resid 82 and name HN) 3.65 1.85 1.85 ! 0.0000 1254:10 Intra 2.92, 2.94 A assign (resid 37 and name HB) (resid 83 and name HN) 4.15 2.35 2.35 ! 0.8229 1255:10 Ambig 5.19, 5.69 A or (resid 85 and name HG1) (resid 83 and name HN) ! 0.1771 1255:10 ----- 6.71, 7.41 A assign (resid 86 and name HG2*) (resid 86 and name HN) 3.15 1.35 1.35 ! 0.9627 1256:10 Intra 2.25, 4.29 A assign (resid 87 and name HA) (resid 87 and name HN) 2.65 0.85 0.85 ! 0.0000 1257:10 Intra 2.70, 2.76 A assign (resid 86 and name HG2*) (resid 89 and name HN) 3.15 1.35 1.35 ! 0.8197 1259:10 Ambig 3.15, 4.65 A or (resid 131 and name HG2) (resid 129 and name HN) ! 0.1324 1259:10 ----- 4.26, 4.85 A assign (resid 3 and name HD22) (resid 129 and name HN) 3.15 1.35 1.35 ! 0.5965 1260:10 Ambig 3.37, 4.04 A or (resid 89 and name HD22) (resid 89 and name HN) ! 0.3773 1260:10 ----- 3.64, 4.18 A assign (resid 92 and name HG12) (resid 92 and name HN) 2.65 0.85 0.85 ! 0.9771 1261:10 Intra 3.22, 3.44 A assign (resid 92 and name HD1*) (resid 92 and name HN) 3.15 1.35 1.35 ! 0.0000 1263:10 Intra 3.97, 4.53 A assign (resid 92 and name HG11) (resid 93 and name HN) 3.65 1.85 1.85 ! 0.0000 1264:10 Seq 5.04, 5.13 A assign (resid 92 and name HB) (resid 94 and name HN) 3.65 1.85 1.85 ! 0.6705 1265:10 Ambig 4.76, 4.97 A or (resid 59 and name HG) (resid 94 and name HN) ! 0.3295 1265:10 ----- 5.36, 6.23 A assign (resid 27 and name HB) (resid 96 and name HN) 3.65 1.85 1.85 ! 0.6018 1269:10 Ambig 4.79, 5.05 A or (resid 59 and name HG) (resid 96 and name HN) ! 0.2856 1269:10 ----- 5.42, 6.01 A or (resid 97 and name HB) (resid 96 and name HN) ! 0.1125 1269:10 ----- 6.33, 6.47 A assign (resid 26 and name HG2*) (resid 97 and name HN) 3.65 1.85 1.85 ! 0.0000 1270:10 Long 4.17, 5.80 A assign (resid 59 and name HD2*) (resid 97 and name HN) 3.65 1.85 1.85 ! 0.0000 1271:10 Long 4.42, 5.98 A assign (resid 98 and name HN) (resid 97 and name HN) 3.15 1.35 1.35 ! 0.5988 1273:10 Ambig 4.35, 4.46 A or (resid 27 and name HN) (resid 97 and name HN) ! 0.3745 1273:10 ----- 4.70, 4.83 A assign (resid 56 and name HD22) (resid 97 and name HN) 3.65 1.85 1.85 ! 0.0000 1274:10 Long 3.44, 3.69 A assign (resid 26 and name HG2*) (resid 98 and name HN) 3.15 1.35 1.35 ! 0.5431 1275:10 Ambig 4.96, 5.98 A or (resid 99 and name HB*) (resid 98 and name HN) ! 0.4569 1275:10 ----- 5.11, 5.67 A assign (resid 98 and name HD2*) (resid 99 and name HN) 3.65 1.85 1.85 ! 0.7080 1276:10 Ambig 3.98, 5.01 A or (resid 98 and name HD1*) (resid 99 and name HN) ! 0.2319 1276:10 ----- 4.80, 5.39 A assign (resid 110 and name HN) (resid 109 and name HN) 3.65 1.85 1.85 ! 0.9477 1277:10 Seq 4.48, 4.54 A assign (resid 102 and name HN) (resid 103 and name HN) 3.65 1.85 1.85 ! 0.6725 1278:10 Ambig 4.19, 4.28 A or (resid 22 and name HN) (resid 103 and name HN) ! 0.3275 1278:10 ----- 4.72, 4.90 A assign (resid 20 and name HG2*) (resid 104 and name HN) 3.65 1.85 1.85 ! 0.0000 1281:10 Long 3.63, 5.06 A assign (resid 112 and name HA2) (resid 112 and name HN) 3.65 1.85 1.85 ! 0.9690 1285:10 Intra 2.42, 2.52 A assign (resid 141 and name HD2) (resid 114 and name HN) 3.65 1.85 1.85 ! 0.7082 1286:10 Ambig 3.89, 4.94 A or (resid 47 and name HD2) (resid 114 and name HN) ! 0.1955 1286:10 ----- 4.82, 6.03 A or (resid 141 and name HB1) (resid 114 and name HN) ! 0.0963 1286:10 ----- 5.42, 5.79 A assign (resid 142 and name HG2*) (resid 114 and name HN) 3.65 1.85 1.85 ! 0.0000 1287:10 Long 4.47, 5.48 A assign (resid 113 and name HN) (resid 114 and name HN) 3.65 1.85 1.85 ! 0.0000 1289:10 Seq 4.33, 4.42 A assign (resid 116 and name HB1) (resid 116 and name HN) 3.15 1.35 1.35 ! 0.9561 1290:10 Intra 3.61, 3.66 A assign (resid 116 and name HD1*) (resid 116 and name HN) 3.15 1.35 1.35 ! 0.0000 1291:10 Intra 4.10, 4.66 A assign (resid 134 and name HE2) (resid 136 and name HN) 4.15 2.35 2.35 ! 0.9594 1293:10 Mid 3.88, 5.17 A assign (resid 139 and name HD22) (resid 118 and name HN) 3.65 1.85 1.85 ! 0.0000 1294:10 Long 3.32, 4.91 A assign (resid 117 and name HN) (resid 118 and name HN) 3.65 1.85 1.85 ! 0.8915 1296:10 Ambig 4.01, 4.30 A or (resid 116 and name HN) (resid 118 and name HN) ! 0.1085 1296:10 ----- 5.69, 5.93 A assign (resid 123 and name HG) (resid 123 and name HN) 3.15 1.35 1.35 ! 0.0000 1297:10 Intra 3.25, 4.36 A assign (resid 37 and name HG12) (resid 126 and name HN) 4.15 2.35 2.35 ! 0.9708 1298:10 Long 3.89, 5.23 A assign (resid 125 and name HB) (resid 126 and name HN) 3.65 1.85 1.85 ! 0.0000 1299:10 Seq 4.27, 4.37 A assign (resid -1 and name HN) (resid 0 and name HN) 2.30 0.50 0.50 ! 0.4754 1301:10 Ambig 2.03, 3.48 A or (resid 129 and name HN) (resid 130 and name HN) ! 0.4075 1301:10 ----- 2.08, 2.42 A or (resid 131 and name HN) (resid 130 and name HN) ! 0.1171 1301:10 ----- 2.56, 2.77 A assign (resid 129 and name HB1) (resid 131 and name HN) 2.65 0.85 0.85 ! 0.8918 1302:10 Ambig 3.00, 3.34 A or (resid 130 and name HB2) (resid 131 and name HN) ! 0.0816 1302:10 ----- 4.47, 4.53 A assign (resid 34 and name HG2*) (resid 131 and name HN) 4.15 2.35 2.35 ! 0.0000 1303:10 Long 6.71, 7.95 A assign (resid 132 and name HB1) (resid 133 and name HN) 3.65 1.85 1.85 ! 0.8978 1305:10 Ambig 4.08, 4.21 A or (resid 3 and name HB2) (resid 133 and name HN) ! 0.1022 1305:10 ----- 5.86, 6.68 A assign (resid 133 and name HG11) (resid 133 and name HN) 2.30 0.50 0.50 ! 0.6048 1306:10 Ambig 2.38, 2.75 A or (resid 125 and name HG1*) (resid 133 and name HN) ! 0.3099 1306:10 ----- 2.66, 4.90 A or (resid 125 and name HG2*) (resid 133 and name HN) ! 0.0724 1306:10 ----- 3.39, 6.29 A assign (resid 139 and name HD21) (resid 140 and name HN) 3.65 1.85 1.85 ! 0.0000 1308:10 Seq 3.23, 4.45 A assign (resid 116 and name HD1*) (resid 141 and name HN) 3.65 1.85 1.85 ! 0.9400 1309:10 Long 4.03, 5.67 A assign (resid 23 and name HG1*) (resid 141 and name HN) 2.65 0.85 0.85 ! 0.4649 1310:10 Ambig 3.73, 4.85 A or (resid 23 and name HG2*) (resid 141 and name HN) ! 0.3181 1310:10 ----- 3.97, 5.74 A or (resid 10 and name HG2*) (resid 141 and name HN) ! 0.2170 1310:10 ----- 4.24, 5.56 A assign (resid 141 and name HB1) (resid 141 and name HN) 2.65 0.85 0.85 ! 0.9633 1311:10 Intra 2.56, 2.80 A assign (resid 142 and name HD1*) (resid 143 and name HN) 3.65 1.85 1.85 ! 0.0000 1312:10 Seq 5.97, 6.44 A assign (resid 142 and name HG11) (resid 143 and name HN) 3.65 1.85 1.85 ! 0.0000 1313:10 Seq 5.05, 5.08 A assign (resid 13 and name HG2*) (resid 143 and name HN) 3.15 1.35 1.35 ! 0.7955 1314:10 Ambig 3.60, 4.73 A or (resid 142 and name HG12) (resid 143 and name HN) ! 0.2045 1314:10 ----- 4.51, 4.59 A assign (resid 105 and name HD1*) (resid 143 and name HN) 3.65 1.85 1.85 ! 0.5533 1315:10 Ambig 5.75, 6.62 A or (resid 21 and name HG1*) (resid 143 and name HN) ! 0.4467 1315:10 ----- 5.96, 7.38 A assign (resid 141 and name HG2) (resid 143 and name HN) 4.15 2.35 2.35 ! 0.9104 1316:10 Ambig 3.59, 4.24 A or (resid 141 and name HD1) (resid 143 and name HN) ! 0.0768 1316:10 ----- 5.42, 6.96 A assign (resid 143 and name HN) (resid 144 and name HN) 3.65 1.85 1.85 ! 0.0000 1317:10 Seq 4.19, 4.23 A assign (resid 85 and name HB1) (resid 86 and name HN) 3.65 1.85 1.85 ! 0.0000 1318:10 Seq 4.37, 4.44 A assign (resid 146 and name HA1) (resid 147 and name HN) 3.15 1.35 1.35 ! 0.9890 1320:10 Seq 2.09, 2.94 A assign (resid 146 and name HA2) (resid 147 and name HN) 2.65 0.85 0.85 ! 0.9967 1321:10 Seq 2.21, 2.70 A assign (resid 151 and name HN) (resid 150 and name HN) 3.15 1.35 1.35 ! 0.0000 1323:10 Seq 2.21, 3.48 A assign (resid 5 and name HG2*) (resid 134 and name HN) 3.15 1.35 1.35 ! 0.4838 1324:10 Ambig 3.88, 6.45 A or (resid 8 and name HD2*) (resid 134 and name HN) ! 0.0985 1324:10 ----- 5.06, 7.19 A or (resid 97 and name HG12) (resid 56 and name HD21) ! 0.0963 1324:10 ----- 5.08, 6.30 A or (resid 94 and name HG2*) (resid 56 and name HD21) ! 0.0823 1324:10 ----- 5.22, 6.69 A or (resid 97 and name HD1*) (resid 56 and name HD21) ! 0.0697 1324:10 ----- 5.36, 6.35 A or (resid 6 and name HG2*) (resid 134 and name HN) ! 0.0650 1324:10 ----- 5.43, 6.70 A or (resid 92 and name HG2*) (resid 56 and name HD21) ! 0.0577 1324:10 ----- 5.54, 7.01 A assign (resid 134 and name HB2) (resid 134 and name HN) 3.65 1.85 1.85 ! 0.8444 1325:10 Ambig 2.98, 3.64 A or (resid 59 and name HB1) (resid 56 and name HD21) ! 0.1269 1325:10 ----- 4.09, 4.76 A assign (resid 58 and name HN) (resid 56 and name HD21) 3.65 1.85 1.85 ! 0.8824 1326:10 Ambig 3.11, 3.94 A or (resid 56 and name HN) (resid 56 and name HD21) ! 0.1176 1326:10 ----- 4.34, 4.62 A assign (resid 3 and name HB1) (resid 3 and name HD22) 3.15 1.35 1.35 ! 0.0000 1327:10 Intra 3.43, 3.63 A assign (resid 3 and name HB2) (resid 3 and name HD21) 2.65 0.85 0.85 ! 0.0000 1328:10 Intra 2.10, 2.85 A assign (resid 3 and name HB2) (resid 3 and name HD22) 3.15 1.35 1.35 ! 0.9687 1329:10 Intra 3.43, 3.76 A assign (resid 145 and name HG2*) (resid 16 and name HD22) 4.15 2.35 2.35 ! 0.0000 1330:10 Long 4.25, 6.81 A assign (resid 97 and name HN) (resid 56 and name HD22) 3.65 1.85 1.85 ! 0.8885 1331:10 Ambig 3.44, 3.69 A or (resid 57 and name HN) (resid 56 and name HD22) ! 0.1115 1331:10 ----- 4.86, 5.30 A assign (resid 71 and name HB1) (resid 71 and name HD21) 3.15 1.35 1.35 ! 0.0000 1332:10 Intra 2.18, 2.37 A assign (resid 69 and name HG2*) (resid 71 and name HD21) 4.15 2.35 2.35 ! 0.0000 1334:10 Mid 5.09, 6.68 A assign (resid 108 and name HB1) (resid 108 and name HD22) 3.15 1.35 1.35 ! 0.0000 1335:10 Intra 3.46, 3.65 A assign (resid 108 and name HN) (resid 108 and name HD21) 3.65 1.85 1.85 ! 0.0000 1336:10 Intra 4.37, 4.63 A assign (resid 4 and name HN) (resid 3 and name HD22) 4.15 2.35 2.35 ! 0.8157 1337:10 Ambig 4.42, 5.38 A or (resid 108 and name HN) (resid 108 and name HD22) ! 0.1843 1337:10 ----- 5.66, 5.81 A assign (resid 129 and name HN) (resid 129 and name HD22) 4.15 2.35 2.35 ! 0.0000 1338:10 Intra 5.68, 5.81 A assign (resid 86 and name HB) (resid 87 and name HN) 3.65 1.85 1.85 ! 0.0000 1339:10 Seq 3.20, 3.98 A assign (resid 63 and name HB) (resid 67 and name HN) 3.65 1.85 1.85 ! 0.6644 1341:10 Ambig 4.10, 4.70 A or (resid 64 and name HA) (resid 67 and name HN) ! 0.3113 1341:10 ----- 4.65, 5.08 A assign (resid 19 and name HA) (resid 16 and name HN) 3.65 1.85 1.85 ! 0.5695 1343:10 Ambig 4.74, 5.09 A or (resid 108 and name HA) (resid 107 and name HN) ! 0.4305 1343:10 ----- 4.97, 5.07 A assign (resid 37 and name HD1*) (resid 37 and name HN) 2.65 0.85 0.85 ! 0.8918 1349:10 Ambig 2.21, 4.05 A or (resid 36 and name HD1*) (resid 37 and name HN) ! 0.0903 1349:10 ----- 3.24, 5.89 A assign (resid 39 and name HG*) (resid 38 and name HN) 3.65 1.85 1.85 ! 0.0000 1350:10 Seq 4.76, 5.80 A assign (resid 123 and name HB2) (resid 40 and name HN) 3.65 1.85 1.85 ! 0.9202 1351:10 Long 3.73, 4.07 A assign (resid 41 and name HG12) (resid 40 and name HN) 4.15 2.35 2.35 ! 0.9296 1352:10 Seq 4.73, 5.58 A assign (resid 67 and name HN) (resid 65 and name HN) 3.65 1.85 1.85 ! 0.9530 1357:10 Mid 3.11, 3.54 A assign (resid 74 and name HA) (resid 74 and name HN) 3.15 1.35 1.35 ! 0.0000 1359:10 Intra 2.66, 2.71 A assign (resid 6 and name HG1*) (resid 6 and name HN) 3.15 1.35 1.35 ! 0.0000 1361:10 Intra 1.94, 4.29 A assign (resid 137 and name HN) (resid 136 and name HN) 3.65 1.85 1.85 ! 0.3631 1363:10 Ambig 4.17, 4.27 A or (resid 8 and name HN) (resid 136 and name HN) ! 0.2249 1363:10 ----- 4.52, 4.74 A or (resid 139 and name HN) (resid 118 and name HN) ! 0.2062 1363:10 ----- 4.59, 4.94 A or (resid 138 and name HN) (resid 118 and name HN) ! 0.1753 1363:10 ----- 4.71, 5.17 A assign (resid 101 and name HD2*) (resid 100 and name HN) 3.15 1.35 1.35 ! 0.3412 1366:10 Ambig 4.38, 5.61 A or (resid 53 and name HG2*) (resid 100 and name HN) ! 0.2203 1366:10 ----- 4.71, 5.82 A or (resid 54 and name HD1*) (resid 100 and name HN) ! 0.1711 1366:10 ----- 4.92, 6.14 A or (resid 25 and name HG2*) (resid 100 and name HN) ! 0.1316 1366:10 ----- 5.14, 6.24 A or (resid 53 and name HG1*) (resid 100 and name HN) ! 0.0764 1366:10 ----- 5.62, 6.25 A assign (resid 131 and name HG2) (resid 131 and name HN) 2.65 0.85 0.85 ! 0.9916 1368:10 Intra 2.47, 2.67 A assign (resid 59 and name HD1*) (resid 98 and name HN) 3.65 1.85 1.85 ! 0.0000 1369:10 Long 3.75, 4.90 A assign (resid 103 and name HD*) (resid 49 and name HN) 3.15 1.35 1.35 ! 0.6460 1370:10 Ambig 3.42, 5.30 A or (resid 48 and name HD*) (resid 49 and name HN) ! 0.3540 1370:10 ----- 3.78, 4.90 A assign (resid 131 and name HB2) (resid 131 and name HN) 2.30 0.50 0.50 ! 0.9962 1371:10 Intra 2.37, 2.51 A assign (resid 27 and name HB) (resid 9 and name HN) 4.15 2.35 2.35 ! 0.6196 1373:10 Ambig 4.40, 4.88 A or (resid 104 and name HG12) (resid 49 and name HN) ! 0.1784 1373:10 ----- 5.41, 5.74 A or (resid 51 and name HD1) (resid 49 and name HN) ! 0.1740 1373:10 ----- 5.43, 6.64 A assign (resid 78 and name HD1*) (resid 42 and name HN) 4.15 2.35 2.35 ! 0.5223 1375:10 Ambig 5.73, 7.08 A or (resid 116 and name HD1*) (resid 42 and name HN) ! 0.3331 1375:10 ----- 6.17, 7.55 A or (resid 101 and name HD1*) (resid 42 and name HN) ! 0.1447 1375:10 ----- 7.09, 7.97 A assign (resid 3 and name HD22) (resid 129 and name HN) 3.65 1.85 1.85 ! 0.5965 1378:10 Ambig 3.37, 4.04 A or (resid 89 and name HD22) (resid 89 and name HN) ! 0.3773 1378:10 ----- 3.64, 4.18 A assign (resid 128 and name HB1) (resid 129 and name HN) 3.65 1.85 1.85 ! 0.7494 1380:10 Ambig 4.03, 4.25 A or (resid 87 and name HB1) (resid 89 and name HN) ! 0.1108 1380:10 ----- 5.54, 5.74 A or (resid 133 and name HG12) (resid 129 and name HN) ! 0.0634 1380:10 ----- 6.08, 6.91 A assign (resid 87 and name HB2) (resid 89 and name HN) 3.65 1.85 1.85 ! 0.3358 1381:10 Ambig 5.23, 5.43 A or (resid 33 and name HG2) (resid 129 and name HN) ! 0.2756 1381:10 ----- 5.41, 6.86 A or (resid 91 and name HG1) (resid 89 and name HN) ! 0.2690 1381:10 ----- 5.43, 6.10 A or (resid 131 and name HB1) (resid 129 and name HN) ! 0.1195 1381:10 ----- 6.21, 6.70 A assign (resid 79 and name HN) (resid 72 and name HN) 4.15 2.35 2.35 ! 0.0000 1382:10 Long 5.01, 5.26 A assign (resid 43 and name HB*) (resid 117 and name HN) 3.15 1.35 1.35 ! 0.0000 1390:10 Long 4.04, 4.86 A assign (resid 17 and name HG2) (resid 148 and name HN) 3.65 1.85 1.85 ! 0.0000 1393:10 Long 1.94, 4.86 A assign (resid 134 and name HD*) (resid 137 and name HN) 3.65 1.85 1.85 ! 0.4575 1395:10 Ambig 4.70, 6.08 A or (resid 131 and name HG2) (resid 127 and name HN) ! 0.3852 1395:10 ----- 4.84, 5.27 A or (resid 133 and name HB) (resid 127 and name HN) ! 0.1573 1395:10 ----- 5.61, 6.15 A assign (resid 136 and name HN) (resid 137 and name HN) 3.15 1.35 1.35 ! 0.0000 1396:10 Seq 4.17, 4.27 A assign (resid 118 and name HB) (resid 138 and name HN) 3.65 1.85 1.85 ! 0.0000 1397:10 Long 4.05, 4.30 A assign (resid 139 and name HB2) (resid 139 and name HD21) 3.65 1.85 1.85 ! 0.9979 1398:10 Intra 2.17, 2.74 A assign (resid 116 and name HG) (resid 140 and name HN) 3.65 1.85 1.85 ! 0.7821 1399:10 Ambig 4.15, 4.60 A or (resid 141 and name HD1) (resid 140 and name HN) ! 0.1734 1399:10 ----- 5.34, 7.46 A assign (resid 13 and name HN) (resid 141 and name HN) 3.15 1.35 1.35 ! 0.6053 1403:10 Ambig 3.59, 3.81 A or (resid 11 and name HN) (resid 141 and name HN) ! 0.3947 1403:10 ----- 3.86, 4.52 A assign (resid 141 and name HG1) (resid 142 and name HN) 2.65 0.85 0.85 ! 0.4885 1404:10 Ambig 2.50, 2.99 A or (resid 142 and name HB) (resid 142 and name HN) ! 0.4830 1404:10 ----- 2.50, 2.59 A assign (resid 142 and name HG12) (resid 142 and name HN) 3.15 1.35 1.35 ! 0.5602 1405:10 Ambig 3.77, 3.85 A or (resid 122 and name HG2*) (resid 121 and name HN) ! 0.2447 1405:10 ----- 4.33, 6.31 A or (resid 13 and name HG2*) (resid 142 and name HN) ! 0.1332 1405:10 ----- 4.79, 5.59 A assign (resid 141 and name HB1) (resid 142 and name HN) 3.15 1.35 1.35 ! 0.4015 1406:10 Ambig 3.95, 4.05 A or (resid 123 and name HB2) (resid 121 and name HN) ! 0.3017 1406:10 ----- 4.14, 4.47 A or (resid 141 and name HD2) (resid 142 and name HN) ! 0.1366 1406:10 ----- 4.73, 5.19 A or (resid 116 and name HB2) (resid 142 and name HN) ! 0.0451 1406:10 ----- 5.68, 5.94 A or (resid 59 and name HG) (resid 57 and name HN) ! 0.0378 1406:10 ----- 5.85, 6.16 A assign (resid 13 and name HN) (resid 142 and name HN) 3.65 1.85 1.85 ! 0.0000 1407:10 Long 4.71, 4.79 A assign (resid 23 and name HG2*) (resid 142 and name HN) 3.65 1.85 1.85 ! 0.6262 1408:10 Ambig 5.60, 6.48 A or (resid 23 and name HG1*) (resid 142 and name HN) ! 0.3738 1408:10 ----- 6.11, 7.22 A assign (resid 3 and name HB2) (resid 3 and name HN) 2.65 0.85 0.85 ! 0.0000 1409:10 Intra 2.28, 2.74 A assign (resid 98 and name HB1) (resid 99 and name HN) 2.65 0.85 0.85 ! 0.0000 1410:10 Seq 2.17, 2.33 A assign (resid 13 and name HG1*) (resid 12 and name HN) 3.65 1.85 1.85 ! 0.0000 1411:10 Seq 4.19, 5.29 A assign (resid 123 and name HD1*) (resid 124 and name HN) 3.65 1.85 1.85 ! 0.0000 1412:10 Seq 3.12, 5.74 A assign (resid 123 and name HD2*) (resid 124 and name HN) 2.65 0.85 0.85 ! 0.0000 1413:10 Seq 2.17, 3.72 A assign (resid 53 and name HB) (resid 102 and name HN) 3.15 1.35 1.35 ! 0.0000 1414:10 Long 4.26, 4.43 A assign (resid 78 and name HD1*) (resid 102 and name HN) 3.15 1.35 1.35 ! 0.4430 1415:10 Ambig 5.55, 6.39 A or (resid 101 and name HD1*) (resid 102 and name HN) ! 0.3606 1415:10 ----- 5.75, 6.39 A or (resid 80 and name HD1*) (resid 102 and name HN) ! 0.1964 1415:10 ----- 6.36, 7.29 A assign (resid 60 and name HG1*) (resid 61 and name HN) 3.15 1.35 1.35 ! 0.9382 1417:10 Seq 2.86, 3.90 A assign (resid 52 and name HB2) (resid 51 and name HN) 4.15 2.35 2.35 ! 0.5406 1419:10 Ambig 5.33, 6.25 A or (resid 103 and name HB2) (resid 51 and name HN) ! 0.4594 1419:10 ----- 5.47, 5.82 A assign (resid 33 and name HG2) (resid 34 and name HN) 4.15 2.35 2.35 ! 0.7514 1422:10 Ambig 5.00, 5.44 A or (resid 128 and name HG1) (resid 34 and name HN) ! 0.2486 1422:10 ----- 6.01, 7.20 A assign (resid 102 and name HB2) (resid 52 and name HN) 3.15 1.35 1.35 ! 0.0000 1423:10 Long 4.06, 4.34 A assign (resid 82 and name HN) (resid 81 and name HG2*) 2.65 0.85 0.85 ! 0.0000 3:20 Seq 2.79, 3.53 A assign (resid 104 and name HN) (resid 50 and name HG2*) 3.65 1.85 1.85 ! 0.0000 4:20 Long 5.57, 6.54 A assign (resid 78 and name HN) (resid 78 and name HG2*) 3.15 1.35 1.35 ! 0.0000 7:20 Intra 4.45, 4.72 A assign (resid 26 and name HN) (resid 26 and name HB) 2.65 0.85 0.85 ! 0.9248 9:20 Intra 2.50, 2.57 A assign (resid 42 and name HN) (resid 42 and name HB*) 2.30 0.50 0.50 ! 0.9970 10:20 Intra 2.45, 3.10 A assign (resid 104 and name HN) (resid 50 and name HA) 3.15 1.35 1.35 ! 0.9870 12:20 Long 3.40, 3.62 A assign (resid 98 and name HN) (resid 97 and name HA) 2.30 0.50 0.50 ! 0.8803 13:20 Ambig 2.11, 2.16 A or (resid 27 and name HN) (resid 97 and name HA) ! 0.1112 13:20 ----- 2.98, 3.23 A assign (resid 104 and name HN) (resid 104 and name HB) 2.65 0.85 0.85 ! 0.9948 14:20 Intra 2.47, 2.60 A assign (resid 23 and name HN) (resid 23 and name HB) 2.65 0.85 0.85 ! 0.0000 15:20 Intra 2.62, 2.70 A assign (resid 37 and name HN) (resid 36 and name HD2*) 2.65 0.85 0.85 ! 0.0000 17:20 Seq 2.63, 4.18 A assign (resid 126 and name HN) (resid 126 and name HB*) 2.30 0.50 0.50 ! 0.9958 18:20 Intra 2.54, 3.09 A assign (resid 126 and name HN) (resid 34 and name HG2*) 4.15 2.35 2.35 ! 0.9817 19:20 Long 3.03, 3.95 A assign (resid 72 and name HN) (resid 72 and name HG2*) 3.15 1.35 1.35 ! 0.0000 20:20 Intra 2.63, 3.82 A assign (resid 38 and name HN) (resid 125 and name HG2*) 2.65 0.85 0.85 ! 0.5234 21:20 Ambig 3.07, 4.44 A or (resid 126 and name HN) (resid 125 and name HG1*) ! 0.2353 21:20 ----- 3.50, 4.23 A or (resid 126 and name HN) (resid 125 and name HG2*) ! 0.2133 21:20 ----- 3.56, 5.01 A assign (resid 40 and name HN) (resid 118 and name HG1*) 3.15 1.35 1.35 ! 0.9721 23:20 Long 2.87, 3.74 A assign (resid 27 and name HN) (resid 26 and name HG2*) 2.30 0.50 0.50 ! 0.9696 24:20 Seq 2.46, 3.35 A assign (resid 23 and name HN) (resid 23 and name HG1*) 2.65 0.85 0.85 ! 0.6008 26:20 Ambig 2.14, 4.49 A or (resid 23 and name HN) (resid 23 and name HG2*) ! 0.3951 26:20 ----- 2.30, 3.47 A assign (resid 21 and name HN) (resid 20 and name HG2*) 2.30 0.50 0.50 ! 0.8959 27:20 Ambig 2.53, 3.55 A or (resid 104 and name HN) (resid 20 and name HG2*) ! 0.1041 27:20 ----- 3.63, 5.06 A assign (resid 26 and name HN) (resid 25 and name HG1*) 2.30 0.50 0.50 ! 0.7346 29:20 Ambig 2.94, 3.61 A or (resid 98 and name HN) (resid 25 and name HG1*) ! 0.1702 29:20 ----- 3.75, 4.74 A or (resid 27 and name HN) (resid 25 and name HG1*) ! 0.0467 29:20 ----- 4.65, 5.99 A assign (resid 42 and name HN) (resid 41 and name HG2*) 2.30 0.50 0.50 ! 0.6601 32:20 Ambig 2.52, 3.59 A or (resid 126 and name HN) (resid 124 and name HG2*) ! 0.2245 32:20 ----- 3.02, 4.30 A or (resid 38 and name HN) (resid 124 and name HG2*) ! 0.0305 32:20 ----- 4.22, 5.20 A or (resid 104 and name HN) (resid 104 and name HG2*) ! 0.0267 32:20 ----- 4.31, 4.62 A assign (resid 21 and name HN) (resid 21 and name HG1*) 2.30 0.50 0.50 ! 0.9925 33:20 Intra 2.10, 3.04 A assign (resid 98 and name HN) (resid 97 and name HG2*) 2.65 0.85 0.85 ! 0.9596 34:20 Seq 2.57, 3.30 A assign (resid 41 and name HN) (resid 41 and name HD1*) 2.65 0.85 0.85 ! 0.0000 35:20 Intra 2.15, 3.89 A assign (resid 104 and name HN) (resid 104 and name HD1*) 3.65 1.85 1.85 ! 0.9824 36:20 Intra 3.57, 4.58 A assign (resid 27 and name HN) (resid 27 and name HG2*) 2.30 0.50 0.50 ! 0.9163 37:20 Ambig 2.09, 2.96 A or (resid 98 and name HN) (resid 27 and name HG2*) ! 0.0814 37:20 ----- 3.13, 4.45 A assign (resid 98 and name HN) (resid 97 and name HD1*) 3.15 1.35 1.35 ! 0.4009 38:20 Ambig 4.25, 5.66 A or (resid 27 and name HN) (resid 97 and name HD1*) ! 0.3931 38:20 ----- 4.27, 5.86 A or (resid 26 and name HN) (resid 97 and name HD1*) ! 0.2060 38:20 ----- 4.75, 6.92 A assign (resid 50 and name HN) (resid 49 and name HB) 3.15 1.35 1.35 ! 0.7519 41:20 Ambig 3.93, 4.24 A or (resid 106 and name HN) (resid 49 and name HB) ! 0.1605 41:20 ----- 5.09, 5.81 A or (resid 143 and name HN) (resid 12 and name HB) ! 0.0876 41:20 ----- 5.63, 6.03 A assign (resid 74 and name HN) (resid 74 and name HB) 2.65 0.85 0.85 ! 0.0000 42:20 Intra 2.53, 2.64 A assign (resid 143 and name HN) (resid 143 and name HB) 2.30 0.50 0.50 ! 0.0000 43:20 Intra 2.44, 2.53 A assign (resid 29 and name HN) (resid 28 and name HB2) 3.15 1.35 1.35 ! 0.0000 44:20 Seq 3.44, 3.73 A assign (resid 29 and name HN) (resid 28 and name HB1) 2.30 0.50 0.50 ! 0.9556 45:20 Seq 2.26, 2.65 A assign (resid 93 and name HN) (resid 93 and name HB2) 3.15 1.35 1.35 ! 0.0000 46:20 Intra 2.56, 3.59 A assign (resid 93 and name HN) (resid 93 and name HB1) 2.65 0.85 0.85 ! 0.9453 47:20 Intra 3.10, 3.22 A assign (resid 31 and name HN) (resid 31 and name HB2) 2.65 0.85 0.85 ! 0.0000 48:20 Intra 2.33, 2.78 A assign (resid 30 and name HN) (resid 30 and name HA) 2.65 0.85 0.85 ! 0.9711 49:20 Intra 2.84, 2.88 A assign (resid 31 and name HN) (resid 31 and name HB1) 2.65 0.85 0.85 ! 0.0000 50:20 Intra 2.59, 3.29 A assign (resid 51 and name HN) (resid 50 and name HA) 2.30 0.50 0.50 ! 0.9937 51:20 Seq 2.00, 2.08 A assign (resid 93 and name HN) (resid 92 and name HA) 2.65 0.85 0.85 ! 0.0000 52:20 Seq 2.12, 2.20 A assign (resid 29 and name HN) (resid 29 and name HA) 2.30 0.50 0.50 ! 0.0000 53:20 Intra 2.16, 2.21 A assign (resid 113 and name HN) (resid 113 and name HB2) 2.65 0.85 0.85 ! 0.9859 56:20 Intra 2.27, 2.98 A assign (resid 113 and name HN) (resid 113 and name HB1) 2.65 0.85 0.85 ! 0.0000 57:20 Intra 2.30, 2.78 A assign (resid 80 and name HN) (resid 80 and name HB) 2.65 0.85 0.85 ! 0.9618 58:20 Intra 2.53, 2.60 A assign (resid 71 and name HN) (resid 71 and name HB1) 3.15 1.35 1.35 ! 0.9901 59:20 Intra 2.27, 2.50 A assign (resid 100 and name HN) (resid 100 and name HB*) 3.15 1.35 1.35 ! 0.0000 60:20 Intra 2.44, 3.13 A assign (resid 106 and name HN) (resid 106 and name HB1) 3.15 1.35 1.35 ! 0.0000 61:20 Intra 2.39, 2.77 A assign (resid 106 and name HN) (resid 106 and name HB2) 2.65 0.85 0.85 ! 0.0000 62:20 Intra 2.17, 2.24 A assign (resid 64 and name HN) (resid 64 and name HB2) 2.65 0.85 0.85 ! 0.0000 63:20 Intra 2.50, 2.58 A assign (resid 64 and name HN) (resid 64 and name HB1) 2.65 0.85 0.85 ! 0.0000 65:20 Intra 2.38, 2.49 A assign (resid 105 and name HN) (resid 105 and name HB) 3.15 1.35 1.35 ! 0.0000 66:20 Intra 2.50, 2.56 A assign (resid 29 and name HN) (resid 29 and name HG*) 2.65 0.85 0.85 ! 0.0000 67:20 Intra 2.86, 3.41 A assign (resid 50 and name HN) (resid 50 and name HB) 2.30 0.50 0.50 ! 0.0000 68:20 Intra 2.62, 2.74 A assign (resid 101 and name HN) (resid 101 and name HD1*) 3.15 1.35 1.35 ! 0.0000 69:20 Intra 4.01, 4.55 A assign (resid 124 and name HN) (resid 123 and name HD2*) 3.15 1.35 1.35 ! 0.0000 70:20 Seq 2.17, 3.72 A assign (resid 35 and name HN) (resid 34 and name HG2*) 2.65 0.85 0.85 ! 0.0000 71:20 Seq 2.13, 3.09 A assign (resid 143 and name HN) (resid 143 and name HG2*) 3.15 1.35 1.35 ! 0.0000 73:20 Intra 4.38, 4.52 A assign (resid 143 and name HN) (resid 12 and name HG2*) 3.15 1.35 1.35 ! 0.9537 74:20 Long 3.13, 4.07 A assign (resid 100 and name HN) (resid 99 and name HB*) 2.30 0.50 0.50 ! 0.9514 75:20 Seq 2.51, 3.37 A assign (resid 31 and name HN) (resid 30 and name HG1*) 3.15 1.35 1.35 ! 0.8676 76:20 Ambig 4.16, 5.16 A or (resid 27 and name HN) (resid 30 and name HG1*) ! 0.1324 76:20 ----- 5.69, 6.76 A assign (resid 31 and name HN) (resid 30 and name HG2*) 3.15 1.35 1.35 ! 0.0000 78:20 Seq 2.66, 3.92 A assign (resid 35 and name HN) (resid 34 and name HG1*) 3.15 1.35 1.35 ! 0.6815 80:20 Ambig 3.74, 4.70 A or (resid 28 and name HN) (resid 26 and name HG2*) ! 0.2934 80:20 ----- 4.31, 5.68 A assign (resid 29 and name HN) (resid 30 and name HG1*) 3.15 1.35 1.35 ! 0.6742 81:20 Ambig 3.74, 4.93 A or (resid 28 and name HN) (resid 30 and name HG1*) ! 0.3258 81:20 ----- 4.23, 5.47 A assign (resid 50 and name HN) (resid 50 and name HG1*) 2.30 0.50 0.50 ! 0.0000 82:20 Intra 2.07, 3.08 A assign (resid 71 and name HN) (resid 70 and name HG2*) 3.15 1.35 1.35 ! 0.7483 83:20 Ambig 4.18, 4.92 A or (resid 143 and name HN) (resid 21 and name HG2*) ! 0.2517 83:20 ----- 5.02, 6.10 A assign (resid 71 and name HN) (resid 70 and name HG1*) 3.65 1.85 1.85 ! 0.0000 84:20 Seq 2.91, 3.69 A assign (resid 106 and name HN) (resid 109 and name HB*) 3.15 1.35 1.35 ! 0.0000 85:20 Mid 2.40, 3.50 A assign (resid 50 and name HN) (resid 49 and name HG2*) 2.65 0.85 0.85 ! 0.9941 86:20 Seq 2.92, 4.00 A assign (resid 51 and name HN) (resid 50 and name HG2*) 2.65 0.85 0.85 ! 0.9717 87:20 Seq 2.48, 3.38 A assign (resid 106 and name HN) (resid 105 and name HG2*) 2.65 0.85 0.85 ! 0.0000 88:20 Seq 2.88, 3.62 A assign (resid 103 and name HN) (resid 21 and name HG1*) 2.65 0.85 0.85 ! 0.6415 89:20 Ambig 3.21, 4.03 A or (resid 105 and name HN) (resid 21 and name HG1*) ! 0.3585 89:20 ----- 3.54, 4.86 A assign (resid 105 and name HN) (resid 104 and name HG2*) 2.30 0.50 0.50 ! 0.8744 90:20 Ambig 2.64, 3.57 A or (resid 80 and name HN) (resid 78 and name HG2*) ! 0.0754 90:20 ----- 3.97, 5.25 A assign (resid 143 and name HN) (resid 142 and name HG2*) 2.65 0.85 0.85 ! 0.9358 91:20 Seq 3.18, 3.82 A assign (resid 93 and name HN) (resid 92 and name HG2*) 2.65 0.85 0.85 ! 0.0000 92:20 Seq 3.76, 4.38 A assign (resid 80 and name HN) (resid 80 and name HD1*) 3.15 1.35 1.35 ! 0.0000 93:20 Intra 4.26, 4.87 A assign (resid 105 and name HN) (resid 105 and name HD1*) 3.15 1.35 1.35 ! 0.9580 94:20 Intra 3.96, 4.53 A assign (resid 28 and name HN) (resid 27 and name HD1*) 3.65 1.85 1.85 ! 0.0000 95:20 Seq 4.73, 5.16 A assign (resid 51 and name HN) (resid 104 and name HD1*) 3.65 1.85 1.85 ! 0.5525 96:20 Ambig 5.30, 6.37 A or (resid 105 and name HN) (resid 104 and name HD1*) ! 0.3720 96:20 ----- 5.66, 6.32 A assign (resid 49 and name HN) (resid 49 and name HB) 2.65 0.85 0.85 ! 0.0000 97:20 Intra 2.61, 2.72 A assign (resid 69 and name HN) (resid 81 and name HB) 3.15 1.35 1.35 ! 0.0000 98:20 Long 3.89, 4.14 A assign (resid 83 and name HN) (resid 83 and name HB) 3.15 1.35 1.35 ! 0.0000 99:20 Intra 3.26, 3.56 A assign (resid 81 and name HN) (resid 81 and name HB) 2.65 0.85 0.85 ! 0.9878 100:20 Intra 2.74, 2.80 A assign (resid 9 and name HN) (resid 9 and name HB1) 2.65 0.85 0.85 ! 0.0000 101:20 Intra 2.55, 2.76 A assign (resid 145 and name HN) (resid 14 and name HB*) 3.15 1.35 1.35 ! 0.6454 102:20 Ambig 3.91, 5.11 A or (resid 30 and name HN) (resid 28 and name HB1) ! 0.2806 102:20 ----- 4.49, 4.91 A assign (resid 9 and name HN) (resid 9 and name HB2) 2.65 0.85 0.85 ! 0.9941 103:20 Intra 2.32, 3.00 A assign (resid 138 and name HN) (resid 138 and name HB2) 2.65 0.85 0.85 ! 0.8666 104:20 Ambig 2.60, 2.90 A or (resid 139 and name HN) (resid 138 and name HB2) ! 0.1032 104:20 ----- 3.71, 4.28 A assign (resid 34 and name HN) (resid 33 and name HA) 2.30 0.50 0.50 ! 0.7448 106:20 Ambig 2.05, 2.08 A or (resid 114 and name HN) (resid 114 and name HB2) ! 0.2417 106:20 ----- 2.48, 2.61 A assign (resid 107 and name HN) (resid 107 and name HA) 2.65 0.85 0.85 ! 0.9834 107:20 Intra 2.76, 2.86 A assign (resid 46 and name HN) (resid 46 and name HB2) 2.65 0.85 0.85 ! 0.9756 108:20 Intra 2.45, 2.63 A assign (resid 46 and name HN) (resid 46 and name HB1) 2.30 0.50 0.50 ! 0.6851 109:20 Ambig 2.44, 3.37 A or (resid 34 and name HN) (resid 34 and name HA) ! 0.2825 109:20 ----- 2.83, 2.87 A assign (resid 145 and name HN) (resid 145 and name HA) 3.15 1.35 1.35 ! 0.5002 110:20 Ambig 2.79, 2.84 A or (resid 49 and name HN) (resid 49 and name HA) ! 0.3836 110:20 ----- 2.91, 2.94 A or (resid 112 and name HN) (resid 145 and name HA) ! 0.1001 110:20 ----- 3.64, 4.30 A assign (resid 61 and name HN) (resid 60 and name HA) 2.65 0.85 0.85 ! 0.9993 111:20 Seq 2.09, 2.16 A assign (resid 70 and name HN) (resid 69 and name HA) 2.30 0.50 0.50 ! 0.9922 112:20 Seq 2.12, 2.15 A assign (resid 30 and name HN) (resid 29 and name HA) 2.65 0.85 0.85 ! 0.0000 113:20 Seq 2.85, 2.98 A assign (resid 107 and name HN) (resid 106 and name HA) 2.65 0.85 0.85 ! 0.0000 114:20 Seq 2.22, 2.27 A assign (resid 131 and name HN) (resid 130 and name HA) 2.65 0.85 0.85 ! 0.0000 115:20 Seq 2.80, 2.95 A assign (resid 62 and name HN) (resid 62 and name HA) 2.65 0.85 0.85 ! 0.0000 116:20 Intra 2.15, 2.26 A assign (resid 112 and name HN) (resid 111 and name HA) 2.30 0.50 0.50 ! 0.9900 117:20 Seq 2.11, 2.28 A assign (resid 137 and name HN) (resid 136 and name HA) 2.65 0.85 0.85 ! 0.0000 118:20 Seq 2.02, 2.07 A assign (resid 16 and name HN) (resid 15 and name HA2) 2.65 0.85 0.85 ! 0.9747 119:20 Seq 2.38, 2.56 A assign (resid 97 and name HN) (resid 96 and name HA2) 3.15 1.35 1.35 ! 0.0000 120:20 Seq 2.84, 3.01 A assign (resid 16 and name HN) (resid 15 and name HA1) 2.65 0.85 0.85 ! 0.9739 121:20 Seq 2.46, 2.62 A assign (resid 97 and name HN) (resid 96 and name HA1) 2.30 0.50 0.50 ! 0.0000 122:20 Seq 2.14, 2.20 A assign (resid 113 and name HN) (resid 112 and name HA1) 2.30 0.50 0.50 ! 0.9990 123:20 Seq 2.36, 2.67 A assign (resid 139 and name HN) (resid 139 and name HB2) 3.15 1.35 1.35 ! 0.9989 124:20 Intra 2.41, 3.11 A assign (resid 69 and name HN) (resid 69 and name HB) 2.65 0.85 0.85 ! 0.6292 125:20 Ambig 2.61, 2.70 A or (resid 49 and name HN) (resid 104 and name HB) ! 0.3708 125:20 ----- 2.85, 3.16 A assign (resid 107 and name HN) (resid 106 and name HB1) 3.15 1.35 1.35 ! 0.9923 126:20 Seq 2.45, 3.41 A assign (resid 16 and name HN) (resid 16 and name HB2) 2.65 0.85 0.85 ! 0.9224 127:20 Intra 2.52, 3.27 A assign (resid 16 and name HN) (resid 16 and name HB1) 3.15 1.35 1.35 ! 0.6312 128:20 Ambig 3.06, 3.51 A or (resid 145 and name HN) (resid 16 and name HB1) ! 0.3688 128:20 ----- 3.34, 4.46 A assign (resid 92 and name HN) (resid 92 and name HB) 2.65 0.85 0.85 ! 0.9513 129:20 Intra 2.50, 2.62 A assign (resid 97 and name HN) (resid 97 and name HB) 2.65 0.85 0.85 ! 0.9879 130:20 Intra 2.38, 2.47 A assign (resid 34 and name HN) (resid 34 and name HB) 2.65 0.85 0.85 ! 0.9845 131:20 Intra 2.67, 2.75 A assign (resid 70 and name HN) (resid 70 and name HB) 2.30 0.50 0.50 ! 0.9868 132:20 Intra 2.68, 2.74 A assign (resid 112 and name HN) (resid 144 and name HB) 2.65 0.85 0.85 ! 0.9933 133:20 Long 1.78, 2.11 A assign (resid 131 and name HN) (resid 131 and name HB1) 3.15 1.35 1.35 ! 0.0000 134:20 Intra 3.59, 3.66 A assign (resid 30 and name HN) (resid 30 and name HB) 2.65 0.85 0.85 ! 0.0000 135:20 Intra 2.70, 2.80 A assign (resid 80 and name HN) (resid 39 and name HG*) 3.65 1.85 1.85 ! 0.9785 136:20 Long 3.01, 3.74 A assign (resid 97 and name HN) (resid 97 and name HG11) 3.15 1.35 1.35 ! 0.6552 137:20 Ambig 3.75, 3.94 A or (resid 25 and name HN) (resid 97 and name HG11) ! 0.3448 137:20 ----- 4.18, 4.49 A assign (resid 54 and name HN) (resid 54 and name HD1*) 3.15 1.35 1.35 ! 0.0000 138:20 Intra 4.01, 4.77 A assign (resid 8 and name HN) (resid 134 and name HG*) 4.15 2.35 2.35 ! 0.9471 139:20 Long 3.29, 6.08 A assign (resid 131 and name HN) (resid 131 and name HG2) 2.65 0.85 0.85 ! 0.5940 140:20 Ambig 2.47, 2.67 A or (resid 61 and name HN) (resid 61 and name HG2) ! 0.3785 140:20 ----- 2.66, 4.10 A assign (resid 61 and name HN) (resid 61 and name HG1) 3.15 1.35 1.35 ! 0.9745 141:20 Intra 2.08, 3.76 A assign (resid 56 and name HD22) (resid 59 and name HD2*) 3.15 1.35 1.35 ! 0.9929 142:20 Mid 2.40, 4.44 A assign (resid 8 and name HN) (resid 8 and name HD2*) 3.15 1.35 1.35 ! 0.9779 143:20 Intra 2.59, 4.15 A assign (resid 97 and name HN) (resid 59 and name HD2*) 3.65 1.85 1.85 ! 0.0000 144:20 Long 4.42, 5.98 A assign (resid 112 and name HN) (resid 144 and name HG2*) 2.65 0.85 0.85 ! 0.6663 145:20 Ambig 3.77, 4.53 A or (resid 145 and name HN) (resid 144 and name HG2*) ! 0.2268 145:20 ----- 4.51, 5.15 A or (resid 16 and name HN) (resid 144 and name HG2*) ! 0.1069 145:20 ----- 5.11, 6.67 A assign (resid 145 and name HN) (resid 145 and name HG2*) 2.30 0.50 0.50 ! 0.9863 146:20 Intra 2.23, 3.33 A assign (resid 112 and name HN) (resid 143 and name HG2*) 3.15 1.35 1.35 ! 0.5185 147:20 Ambig 3.94, 5.34 A or (resid 145 and name HN) (resid 143 and name HG2*) ! 0.4815 147:20 ----- 3.99, 5.37 A assign (resid 137 and name HN) (resid 137 and name HB*) 2.30 0.50 0.50 ! 0.0000 149:20 Intra 2.52, 3.21 A assign (resid 145 and name HN) (resid 144 and name HG1*) 2.30 0.50 0.50 ! 0.4970 150:20 Ambig 3.08, 3.86 A or (resid 112 and name HN) (resid 144 and name HG1*) ! 0.4065 150:20 ----- 3.18, 4.15 A or (resid 16 and name HN) (resid 144 and name HG1*) ! 0.0904 150:20 ----- 4.09, 5.69 A assign (resid 30 and name HN) (resid 30 and name HG1*) 2.30 0.50 0.50 ! 0.0000 151:20 Intra 1.92, 2.85 A assign (resid 16 and name HN) (resid 21 and name HG2*) 3.65 1.85 1.85 ! 0.6926 152:20 Ambig 5.47, 6.31 A or (resid 54 and name HN) (resid 70 and name HG2*) ! 0.3074 152:20 ----- 6.27, 7.47 A assign (resid 30 and name HN) (resid 6 and name HG2*) 3.15 1.35 1.35 ! 0.9586 153:20 Long 2.89, 5.05 A assign (resid 62 and name HN) (resid 60 and name HG1*) 3.65 1.85 1.85 ! 0.4620 154:20 Ambig 4.52, 6.14 A or (resid 83 and name HN) (resid 60 and name HG1*) ! 0.2324 154:20 ----- 5.06, 6.20 A or (resid 56 and name HD22) (resid 60 and name HG2*) ! 0.2140 154:20 ----- 5.13, 7.71 A or (resid 83 and name HN) (resid 60 and name HG2*) ! 0.0916 154:20 ----- 5.91, 7.35 A assign (resid 30 and name HN) (resid 30 and name HG2*) 3.15 1.35 1.35 ! 0.8768 155:20 Ambig 4.39, 4.58 A or (resid 92 and name HN) (resid 30 and name HG2*) ! 0.1232 155:20 ----- 6.09, 6.90 A assign (resid 54 and name HN) (resid 54 and name HD2*) 3.15 1.35 1.35 ! 0.0000 156:20 Intra 3.61, 4.54 A assign (resid 34 and name HN) (resid 34 and name HG1*) 2.30 0.50 0.50 ! 0.9996 157:20 Intra 1.98, 2.93 A assign (resid 70 and name HN) (resid 70 and name HG2*) 2.65 0.85 0.85 ! 0.0000 158:20 Intra 2.88, 3.82 A assign (resid 70 and name HN) (resid 70 and name HG1*) 3.15 1.35 1.35 ! 0.6321 159:20 Ambig 4.36, 4.70 A or (resid 81 and name HN) (resid 70 and name HG1*) ! 0.3679 159:20 ----- 4.77, 5.91 A assign (resid 49 and name HN) (resid 49 and name HG2*) 3.15 1.35 1.35 ! 0.0000 160:20 Intra 4.43, 4.64 A assign (resid 112 and name HN) (resid 111 and name HB*) 2.30 0.50 0.50 ! 0.9455 162:20 Seq 2.50, 3.42 A assign (resid 115 and name HN) (resid 115 and name HB*) 2.30 0.50 0.50 ! 0.0000 164:20 Intra 2.41, 2.96 A assign (resid 81 and name HN) (resid 81 and name HG2*) 3.15 1.35 1.35 ! 0.0000 165:20 Intra 4.37, 4.72 A assign (resid 54 and name HN) (resid 53 and name HG2*) 2.65 0.85 0.85 ! 0.6886 166:20 Ambig 3.67, 4.59 A or (resid 54 and name HN) (resid 53 and name HG1*) ! 0.3114 166:20 ----- 4.19, 4.80 A assign (resid 83 and name HN) (resid 83 and name HG2*) 2.65 0.85 0.85 ! 0.0000 167:20 Intra 2.36, 3.41 A assign (resid 25 and name HN) (resid 25 and name HG2*) 2.65 0.85 0.85 ! 0.9580 168:20 Intra 2.32, 3.23 A assign (resid 133 and name HN) (resid 133 and name HG2*) 2.65 0.85 0.85 ! 0.8005 169:20 Ambig 3.00, 3.95 A or (resid 16 and name HN) (resid 105 and name HG2*) ! 0.1642 169:20 ----- 3.90, 5.45 A assign (resid 45 and name HN) (resid 45 and name HB*) 2.30 0.50 0.50 ! 0.7084 170:20 Ambig 2.46, 2.90 A or (resid 46 and name HN) (resid 45 and name HB*) ! 0.2916 170:20 ----- 2.85, 3.90 A assign (resid 69 and name HN) (resid 69 and name HG2*) 3.15 1.35 1.35 ! 0.0000 171:20 Intra 4.35, 4.69 A assign (resid 92 and name HN) (resid 92 and name HG2*) 3.15 1.35 1.35 ! 0.8064 172:20 Ambig 4.40, 4.59 A or (resid 56 and name HD22) (resid 92 and name HG2*) ! 0.1936 172:20 ----- 5.58, 7.73 A assign (resid 70 and name HN) (resid 69 and name HG2*) 2.65 0.85 0.85 ! 0.6480 173:20 Ambig 3.28, 3.96 A or (resid 81 and name HN) (resid 69 and name HG2*) ! 0.3520 173:20 ----- 3.63, 4.72 A assign (resid 56 and name HD22) (resid 97 and name HG2*) 3.65 1.85 1.85 ! 0.8644 174:20 Ambig 5.22, 6.23 A or (resid 54 and name HN) (resid 97 and name HG2*) ! 0.1356 174:20 ----- 7.11, 7.62 A assign (resid 25 and name HN) (resid 97 and name HG2*) 3.15 1.35 1.35 ! 0.9605 175:20 Long 2.43, 3.49 A assign (resid 15 and name HN) (resid 142 and name HG2*) 2.65 0.85 0.85 ! 0.8155 176:20 Ambig 3.34, 4.19 A or (resid 142 and name HN) (resid 142 and name HG2*) ! 0.1733 176:20 ----- 4.32, 4.62 A assign (resid 16 and name HN) (resid 105 and name HD1*) 3.15 1.35 1.35 ! 0.9860 177:20 Long 2.15, 3.40 A assign (resid 97 and name HN) (resid 97 and name HD1*) 2.65 0.85 0.85 ! 0.9767 179:20 Intra 2.22, 3.30 A assign (resid 92 and name HN) (resid 92 and name HD1*) 3.15 1.35 1.35 ! 0.9363 180:20 Intra 3.97, 4.53 A assign (resid 69 and name HN) (resid 69 and name HD1*) 2.65 0.85 0.85 ! 0.0000 181:20 Intra 2.28, 3.28 A assign (resid 146 and name HN) (resid 145 and name HB) 2.65 0.85 0.85 ! 0.0000 182:20 Seq 2.15, 3.03 A assign (resid 15 and name HN) (resid 143 and name HB) 3.15 1.35 1.35 ! 0.7443 183:20 Ambig 3.51, 3.93 A or (resid 144 and name HN) (resid 143 and name HB) ! 0.2341 183:20 ----- 4.25, 4.35 A assign (resid 20 and name HN) (resid 20 and name HB) 2.30 0.50 0.50 ! 0.0000 184:20 Intra 2.49, 2.58 A assign (resid 6 and name HN) (resid 5 and name HB) 3.15 1.35 1.35 ! 0.9136 185:20 Ambig 4.09, 4.28 A or (resid 4 and name HN) (resid 5 and name HB) ! 0.0864 185:20 ----- 6.06, 6.67 A assign (resid 118 and name HN) (resid 117 and name HB) 3.15 1.35 1.35 ! 0.9520 186:20 Seq 4.02, 4.30 A assign (resid 5 and name HN) (resid 5 and name HB) 2.65 0.85 0.85 ! 0.9746 187:20 Intra 2.48, 2.63 A assign (resid 15 and name HN) (resid 14 and name HB*) 2.30 0.50 0.50 ! 0.9729 188:20 Seq 2.60, 3.28 A assign (resid 79 and name HN) (resid 79 and name HB2) 3.15 1.35 1.35 ! 0.0000 189:20 Intra 2.45, 2.50 A assign (resid 14 and name HN) (resid 14 and name HB*) 2.30 0.50 0.50 ! 0.9561 190:20 Intra 2.59, 3.24 A assign (resid 43 and name HN) (resid 42 and name HB*) 2.65 0.85 0.85 ! 0.0000 191:20 Seq 3.09, 3.74 A assign (resid 73 and name HN) (resid 73 and name HB*) 2.30 0.50 0.50 ! 0.0000 192:20 Intra 2.24, 2.60 A assign (resid -1 and name HN) (resid -2 and name HB*) 3.15 1.35 1.35 ! 0.0000 193:20 Seq 2.13, 3.58 A assign (resid 32 and name HN) (resid 31 and name HB1) 3.15 1.35 1.35 ! 0.0000 194:20 Seq 2.43, 3.64 A assign (resid 32 and name HN) (resid 31 and name HB2) 3.15 1.35 1.35 ! 0.0000 195:20 Seq 2.23, 3.27 A assign (resid 108 and name HN) (resid 107 and name HA) 2.65 0.85 0.85 ! 0.9156 196:20 Ambig 3.25, 3.41 A or (resid 19 and name HN) (resid 107 and name HA) ! 0.0678 196:20 ----- 5.01, 5.71 A assign (resid 0 and name HN) (resid 0 and name HB*) 2.65 0.85 0.85 ! 0.0000 197:20 Intra 2.36, 3.17 A assign (resid 6 and name HN) (resid 6 and name HA) 2.65 0.85 0.85 ! 0.9909 198:20 Intra 2.85, 2.90 A assign (resid 118 and name HN) (resid 117 and name HA) 2.65 0.85 0.85 ! 0.9690 199:20 Seq 2.07, 2.19 A assign (resid 2 and name HN) (resid 1 and name HA) 2.65 0.85 0.85 ! 0.9839 200:20 Seq 2.07, 2.26 A assign (resid 146 and name HN) (resid 145 and name HA) 2.30 0.50 0.50 ! 0.6406 201:20 Ambig 2.09, 2.68 A or (resid 11 and name HN) (resid 10 and name HA) ! 0.2621 201:20 ----- 2.42, 2.45 A or (resid 86 and name HN) (resid 86 and name HA) ! 0.0973 201:20 ----- 2.86, 2.91 A assign (resid 6 and name HN) (resid 133 and name HA) 3.65 1.85 1.85 ! 0.0000 202:20 Long 4.37, 4.63 A assign (resid 6 and name HN) (resid 7 and name HA) 3.65 1.85 1.85 ! 0.0000 203:20 Seq 4.72, 4.99 A assign (resid 7 and name HN) (resid 7 and name HA) 2.65 0.85 0.85 ! 0.9958 204:20 Intra 2.86, 2.89 A assign (resid 3 and name HN) (resid 2 and name HA) 2.30 0.50 0.50 ! 0.0000 205:20 Seq 2.03, 2.32 A assign (resid 148 and name HN) (resid 147 and name HA) 3.15 1.35 1.35 ! 0.0000 206:20 Seq 2.08, 2.98 A assign (resid 4 and name HN) (resid 4 and name HA) 2.65 0.85 0.85 ! 0.9762 207:20 Intra 2.78, 2.88 A assign (resid 5 and name HN) (resid 4 and name HA) 2.65 0.85 0.85 ! 0.0000 208:20 Seq 2.10, 2.51 A assign (resid 132 and name HN) (resid 131 and name HA) 2.65 0.85 0.85 ! 0.9986 209:20 Seq 2.04, 2.11 A assign (resid 130 and name HN) (resid 130 and name HA) 2.30 0.50 0.50 ! 0.9954 210:20 Intra 2.16, 2.21 A assign (resid 121 and name HN) (resid 121 and name HA) 2.65 0.85 0.85 ! 0.0000 211:20 Intra 2.85, 2.88 A assign (resid 96 and name HN) (resid 95 and name HA) 2.65 0.85 0.85 ! 0.0000 212:20 Seq 2.29, 2.52 A assign (resid 0 and name HN) (resid -1 and name HA) 3.15 1.35 1.35 ! 0.0000 213:20 Seq 2.08, 2.62 A assign (resid 121 and name HN) (resid 120 and name HD2) 2.65 0.85 0.85 ! 0.9957 214:20 Seq 2.39, 2.57 A assign (resid 147 and name HN) (resid 146 and name HA2) 2.30 0.50 0.50 ! 0.5971 215:20 Ambig 2.21, 2.70 A or (resid 146 and name HN) (resid 146 and name HA2) ! 0.4029 215:20 ----- 2.36, 2.71 A assign (resid 11 and name HN) (resid 11 and name HA2) 2.65 0.85 0.85 ! 0.9316 216:20 Intra 2.91, 2.92 A assign (resid 15 and name HN) (resid 15 and name HA1) 2.65 0.85 0.85 ! 0.9945 217:20 Intra 2.61, 2.68 A assign (resid 140 and name HN) (resid 140 and name HA1) 2.30 0.50 0.50 ! 0.6822 219:20 Ambig 2.31, 2.39 A or (resid 141 and name HN) (resid 140 and name HA1) ! 0.3154 219:20 ----- 2.63, 2.99 A assign (resid 147 and name HN) (resid 146 and name HA1) 2.30 0.50 0.50 ! 0.5523 220:20 Ambig 2.09, 2.94 A or (resid 146 and name HN) (resid 146 and name HA1) ! 0.3441 220:20 ----- 2.26, 2.60 A or (resid 43 and name HN) (resid 76 and name HA2) ! 0.1036 220:20 ----- 2.76, 3.11 A assign (resid 11 and name HN) (resid 11 and name HA1) 2.65 0.85 0.85 ! 0.9751 221:20 Intra 2.52, 2.54 A assign (resid 7 and name HN) (resid 7 and name HE*) 3.65 1.85 1.85 ! 0.0000 222:20 Intra 4.15, 5.33 A assign (resid 128 and name HN) (resid 127 and name HB2) 3.15 1.35 1.35 ! 0.9936 223:20 Seq 1.98, 2.25 A assign (resid 132 and name HN) (resid 132 and name HB1) 2.30 0.50 0.50 ! 0.8816 224:20 Ambig 2.46, 2.57 A or (resid 96 and name HN) (resid 95 and name HB1) ! 0.1184 224:20 ----- 3.44, 3.61 A assign (resid 96 and name HN) (resid 95 and name HB2) 2.30 0.50 0.50 ! 0.8681 225:20 Ambig 1.88, 2.21 A or (resid 132 and name HN) (resid 132 and name HB2) ! 0.1319 225:20 ----- 2.57, 2.67 A assign (resid 20 and name HN) (resid 19 and name HB1) 3.15 1.35 1.35 ! 0.0000 226:20 Seq 3.52, 3.90 A assign (resid 136 and name HN) (resid 135 and name HB*) 3.15 1.35 1.35 ! 0.8315 227:20 Ambig 3.33, 4.34 A or (resid 6 and name HN) (resid 135 and name HB*) ! 0.1685 227:20 ----- 4.35, 5.21 A assign (resid 140 and name HN) (resid 139 and name HB2) 3.65 1.85 1.85 ! 0.8551 228:20 Ambig 2.21, 4.29 A or (resid 118 and name HN) (resid 139 and name HB2) ! 0.1382 228:20 ----- 2.99, 4.51 A assign (resid 19 and name HN) (resid 19 and name HB2) 2.65 0.85 0.85 ! 0.9935 229:20 Intra 2.61, 2.75 A assign (resid 139 and name HN) (resid 139 and name HB1) 3.15 1.35 1.35 ! 0.0000 230:20 Intra 2.69, 3.09 A assign (resid 129 and name HN) (resid 129 and name HB2) 2.65 0.85 0.85 ! 0.9722 231:20 Intra 2.53, 2.68 A assign (resid 129 and name HN) (resid 129 and name HB1) 2.30 0.50 0.50 ! 0.9984 232:20 Intra 2.37, 2.47 A assign (resid 4 and name HN) (resid 3 and name HB2) 2.65 0.85 0.85 ! 0.7496 233:20 Ambig 1.90, 3.37 A or (resid 3 and name HN) (resid 3 and name HB2) ! 0.2497 233:20 ----- 2.28, 2.74 A assign (resid 4 and name HN) (resid 3 and name HB1) 2.65 0.85 0.85 ! 0.9173 234:20 Ambig 1.79, 2.67 A or (resid 3 and name HN) (resid 3 and name HB1) ! 0.0820 234:20 ----- 2.68, 3.64 A assign (resid 108 and name HN) (resid 108 and name HB2) 2.65 0.85 0.85 ! 0.0000 235:20 Intra 2.54, 2.69 A assign (resid 108 and name HN) (resid 108 and name HB1) 2.65 0.85 0.85 ! 0.0000 236:20 Intra 2.38, 2.53 A assign (resid 4 and name HN) (resid 4 and name HG2) 2.65 0.85 0.85 ! 0.9648 237:20 Intra 1.89, 2.71 A assign (resid 22 and name HN) (resid 21 and name HB) 3.15 1.35 1.35 ! 0.0000 238:20 Seq 4.01, 4.08 A assign (resid 142 and name HN) (resid 141 and name HB1) 3.15 1.35 1.35 ! 0.6734 239:20 Ambig 3.95, 4.05 A or (resid 136 and name HN) (resid 134 and name HB1) ! 0.2956 239:20 ----- 4.53, 6.11 A assign (resid 22 and name HN) (resid 22 and name HB*) 2.30 0.50 0.50 ! 0.0000 240:20 Intra 2.42, 2.76 A assign (resid 25 and name HN) (resid 24 and name HB2) 3.15 1.35 1.35 ! 0.7420 241:20 Ambig 3.48, 3.60 A or (resid 121 and name HN) (resid 120 and name HB1) ! 0.2580 241:20 ----- 4.15, 4.33 A assign (resid 144 and name HN) (resid 144 and name HB) 2.65 0.85 0.85 ! 0.9788 242:20 Intra 2.49, 2.55 A assign (resid 6 and name HN) (resid 6 and name HB) 2.30 0.50 0.50 ! 0.5526 243:20 Ambig 2.43, 2.59 A or (resid 118 and name HN) (resid 118 and name HB) ! 0.4474 243:20 ----- 2.52, 2.57 A assign (resid 2 and name HN) (resid 1 and name HB) 3.65 1.85 1.85 ! 0.0000 244:20 Seq 4.00, 4.26 A assign (resid 2 and name HN) (resid 2 and name HB2) 2.65 0.85 0.85 ! 0.0000 245:20 Intra 2.36, 2.74 A assign (resid 4 and name HN) (resid 4 and name HB2) 3.15 1.35 1.35 ! 0.0000 246:20 Intra 2.29, 3.40 A assign (resid 4 and name HN) (resid 4 and name HB1) 2.65 0.85 0.85 ! 0.9340 247:20 Intra 2.71, 3.18 A assign (resid 60 and name HN) (resid 60 and name HB) 2.65 0.85 0.85 ! 0.0000 248:20 Intra 2.46, 2.59 A assign (resid 131 and name HN) (resid 131 and name HD*) 3.15 1.35 1.35 ! 0.9919 249:20 Intra 3.24, 4.51 A assign (resid 121 and name HN) (resid 120 and name HG*) 3.15 1.35 1.35 ! 0.8483 250:20 Ambig 4.11, 4.43 A or (resid 25 and name HN) (resid 24 and name HG1) ! 0.1517 250:20 ----- 5.48, 5.66 A assign (resid 6 and name HN) (resid 6 and name HG1*) 2.65 0.85 0.85 ! 0.9011 251:20 Ambig 1.94, 4.29 A or (resid 140 and name HN) (resid 10 and name HG1*) ! 0.0927 251:20 ----- 2.83, 4.79 A assign (resid 7 and name HN) (resid 6 and name HG1*) 2.65 0.85 0.85 ! 0.8246 252:20 Ambig 2.96, 3.99 A or (resid 11 and name HN) (resid 10 and name HG1*) ! 0.1596 252:20 ----- 3.90, 4.55 A assign (resid 96 and name HN) (resid 59 and name HD1*) 3.65 1.85 1.85 ! 0.4764 253:20 Ambig 3.18, 4.90 A or (resid 97 and name HN) (resid 59 and name HD1*) ! 0.4391 253:20 ----- 3.22, 4.96 A or (resid 142 and name HN) (resid 116 and name HD2*) ! 0.0844 253:20 ----- 4.24, 5.28 A assign (resid 129 and name HN) (resid 32 and name HG2*) 3.15 1.35 1.35 ! 0.6285 254:20 Ambig 3.94, 5.03 A or (resid 32 and name HN) (resid 32 and name HG2*) ! 0.3715 254:20 ----- 4.30, 4.51 A assign (resid 57 and name HN) (resid 57 and name HG2*) 2.30 0.50 0.50 ! 0.9978 255:20 Intra 2.00, 3.30 A assign (resid 136 and name HN) (resid 136 and name HB*) 2.65 0.85 0.85 ! 0.0000 256:20 Intra 2.59, 3.18 A assign (resid 144 and name HN) (resid 143 and name HG2*) 2.65 0.85 0.85 ! 0.0000 257:20 Seq 3.46, 4.11 A assign (resid 130 and name HN) (resid 126 and name HB*) 3.15 1.35 1.35 ! 0.9549 259:20 Mid 3.71, 4.85 A assign (resid 86 and name HN) (resid 86 and name HG2*) 3.15 1.35 1.35 ! 0.0000 260:20 Intra 2.25, 4.29 A assign (resid 121 and name HN) (resid 122 and name HG2*) 3.15 1.35 1.35 ! 0.4811 261:20 Ambig 4.33, 6.31 A or (resid 142 and name HN) (resid 13 and name HG2*) ! 0.2619 261:20 ----- 4.79, 5.59 A or (resid 15 and name HN) (resid 13 and name HG2*) ! 0.2249 261:20 ----- 4.91, 6.31 A assign (resid 96 and name HN) (resid 30 and name HG1*) 3.65 1.85 1.85 ! 0.0000 262:20 Long 4.21, 5.23 A assign (resid 140 and name HN) (resid 10 and name HG2*) 2.65 0.85 0.85 ! 0.9843 263:20 Long 2.02, 4.19 A assign (resid 6 and name HN) (resid 6 and name HG2*) 2.30 0.50 0.50 ! 0.9222 264:20 Intra 2.14, 3.46 A assign (resid 5 and name HN) (resid 5 and name HG2*) 2.65 0.85 0.85 ! 0.7356 265:20 Ambig 2.09, 4.32 A or (resid 13 and name HN) (resid 13 and name HG1*) ! 0.1096 265:20 ----- 2.88, 3.82 A or (resid 7 and name HN) (resid 6 and name HG2*) ! 0.0989 265:20 ----- 2.92, 4.82 A assign (resid 14 and name HN) (resid 13 and name HG2*) 2.65 0.85 0.85 ! 0.9527 267:20 Seq 3.51, 4.33 A assign (resid 121 and name HN) (resid 121 and name HB*) 2.30 0.50 0.50 ! 0.0000 268:20 Intra 2.46, 2.94 A assign (resid 25 and name HN) (resid 25 and name HG1*) 3.15 1.35 1.35 ! 0.9362 271:20 Intra 4.37, 4.57 A assign (resid 60 and name HN) (resid 60 and name HG2*) 2.30 0.50 0.50 ! 0.9905 272:20 Intra 2.03, 3.06 A assign (resid 148 and name HN) (resid 148 and name HB*) 2.65 0.85 0.85 ! 0.0000 273:20 Intra 2.41, 3.26 A assign (resid 4 and name HN) (resid 133 and name HG2*) 2.65 0.85 0.85 ! 0.9439 274:20 Long 2.96, 4.68 A assign (resid 79 and name HN) (resid 78 and name HG2*) 2.65 0.85 0.85 ! 0.0000 275:20 Seq 2.79, 3.86 A assign (resid 22 and name HN) (resid 21 and name HG1*) 3.15 1.35 1.35 ! 0.0000 276:20 Seq 3.84, 4.66 A assign (resid 96 and name HN) (resid 27 and name HG2*) 2.65 0.85 0.85 ! 0.0000 277:20 Long 2.15, 3.30 A assign (resid 15 and name HN) (resid 105 and name HD1*) 3.15 1.35 1.35 ! 0.7446 278:20 Ambig 3.89, 4.30 A or (resid 144 and name HN) (resid 105 and name HD1*) ! 0.1553 278:20 ----- 5.05, 6.12 A or (resid 20 and name HN) (resid 105 and name HD1*) ! 0.0788 278:20 ----- 5.66, 6.80 A assign (resid 128 and name HN) (resid 133 and name HD1*) 4.15 2.35 2.35 ! 0.0000 280:20 Long 5.09, 6.11 A assign (resid 19 and name HN) (resid 105 and name HD1*) 3.15 1.35 1.35 ! 0.9298 281:20 Long 3.86, 5.10 A assign (resid 13 and name HN) (resid 12 and name HB) 3.15 1.35 1.35 ! 0.9419 282:20 Seq 4.03, 4.12 A assign (resid 12 and name HN) (resid 12 and name HB) 2.65 0.85 0.85 ! 0.0000 283:20 Intra 2.48, 2.54 A assign (resid 111 and name HN) (resid 110 and name HB) 2.65 0.85 0.85 ! 0.0000 284:20 Seq 2.77, 3.36 A assign (resid 117 and name HN) (resid 117 and name HB) 2.65 0.85 0.85 ! 0.9958 285:20 Intra 2.47, 2.57 A assign (resid 18 and name HN) (resid 17 and name HA) 2.65 0.85 0.85 ! 0.9918 286:20 Seq 2.12, 2.17 A assign (resid 151 and name HN) (resid 151 and name HB*) 2.65 0.85 0.85 ! 0.8216 287:20 Ambig 2.47, 3.38 A or (resid 117 and name HN) (resid 42 and name HB*) ! 0.1784 287:20 ----- 3.19, 4.24 A assign (resid 10 and name HN) (resid 9 and name HB2) 3.15 1.35 1.35 ! 0.8358 288:20 Ambig 3.73, 3.93 A or (resid 10 and name HN) (resid 138 and name HB1) ! 0.1642 288:20 ----- 4.90, 5.95 A assign (resid 10 and name HN) (resid 9 and name HB1) 3.15 1.35 1.35 ! 0.0000 289:20 Seq 2.79, 3.66 A assign (resid 1 and name HN) (resid 1 and name HA) 3.15 1.35 1.35 ! 0.5196 291:20 Ambig 2.76, 2.88 A or (resid 5 and name HN) (resid 5 and name HA) ! 0.4804 291:20 ----- 2.79, 2.89 A assign (resid 111 and name HN) (resid 110 and name HA) 2.30 0.50 0.50 ! 0.0000 292:20 Seq 2.09, 2.22 A assign (resid 125 and name HN) (resid 124 and name HA) 2.65 0.85 0.85 ! 0.0000 293:20 Seq 2.14, 2.19 A assign (resid 1 and name HN) (resid 0 and name HA) 2.65 0.85 0.85 ! 0.0000 294:20 Seq 2.10, 2.57 A assign (resid 53 and name HN) (resid 52 and name HA) 2.65 0.85 0.85 ! 0.0000 295:20 Seq 2.51, 2.58 A assign (resid 116 and name HN) (resid 115 and name HA) 2.30 0.50 0.50 ! 0.9974 296:20 Seq 2.09, 2.14 A assign (resid 111 and name HN) (resid 111 and name HA) 2.65 0.85 0.85 ! 0.0000 297:20 Intra 2.83, 2.85 A assign (resid 12 and name HN) (resid 11 and name HA2) 2.65 0.85 0.85 ! 0.8801 298:20 Ambig 2.32, 2.60 A or (resid 16 and name HD21) (resid 15 and name HA2) ! 0.1199 298:20 ----- 3.24, 3.54 A assign (resid 18 and name HN) (resid 18 and name HA1) 2.65 0.85 0.85 ! 0.9394 299:20 Intra 2.91, 2.93 A assign (resid 12 and name HN) (resid 11 and name HA1) 2.65 0.85 0.85 ! 0.9809 300:20 Seq 2.29, 2.46 A assign (resid 53 and name HN) (resid 52 and name HB1) 3.15 1.35 1.35 ! 0.9965 301:20 Seq 2.04, 3.57 A assign (resid 53 and name HN) (resid 52 and name HB2) 2.65 0.85 0.85 ! 0.9991 302:20 Seq 2.07, 2.25 A assign (resid 110 and name HN) (resid 47 and name HE*) 2.65 0.85 0.85 ! 0.9969 303:20 Long 2.09, 3.47 A assign (resid 119 and name HN) (resid 119 and name HB1) 2.65 0.85 0.85 ! 0.0000 304:20 Intra 2.34, 2.51 A assign (resid 16 and name HD21) (resid 16 and name HB1) 2.65 0.85 0.85 ! 0.9971 305:20 Intra 2.14, 2.93 A assign (resid 77 and name HN) (resid 77 and name HB2) 3.15 1.35 1.35 ! 0.0000 306:20 Intra 2.52, 2.64 A assign (resid 77 and name HN) (resid 77 and name HB1) 3.15 1.35 1.35 ! 0.0000 307:20 Intra 3.61, 3.73 A assign (resid 125 and name HN) (resid 125 and name HB) 2.65 0.85 0.85 ! 0.8742 308:20 Ambig 2.74, 2.91 A or (resid 53 and name HN) (resid 53 and name HB) ! 0.1258 308:20 ----- 3.78, 3.83 A assign (resid 29 and name HE21) (resid 29 and name HG*) 2.65 0.85 0.85 ! 0.0000 309:20 Intra 2.20, 3.03 A assign (resid 1 and name HN) (resid 1 and name HB) 2.65 0.85 0.85 ! 0.0000 310:20 Intra 2.51, 2.68 A assign (resid 10 and name HN) (resid 10 and name HB) 3.15 1.35 1.35 ! 0.0000 311:20 Intra 3.74, 3.83 A assign (resid 116 and name HN) (resid 116 and name HD2*) 2.65 0.85 0.85 ! 0.8690 312:20 Ambig 3.21, 4.22 A or (resid 117 and name HN) (resid 116 and name HD2*) ! 0.1310 312:20 ----- 4.40, 5.12 A assign (resid 111 and name HN) (resid 110 and name HG2*) 2.65 0.85 0.85 ! 0.0000 313:20 Seq 2.02, 3.71 A assign (resid 146 and name HN) (resid 145 and name HG2*) 3.15 1.35 1.35 ! 0.9252 314:20 Seq 3.87, 4.67 A assign (resid 117 and name HN) (resid 117 and name HG2*) 3.15 1.35 1.35 ! 0.8342 315:20 Ambig 4.40, 4.56 A or (resid 116 and name HN) (resid 117 and name HG2*) ! 0.0968 315:20 ----- 6.30, 7.38 A assign (resid 68 and name HN) (resid 60 and name HG1*) 3.15 1.35 1.35 ! 0.9123 317:20 Ambig 4.58, 5.25 A or (resid 68 and name HN) (resid 60 and name HG2*) ! 0.0877 317:20 ----- 6.77, 7.82 A assign (resid 63 and name HN) (resid 63 and name HG2*) 2.30 0.50 0.50 ! 0.9004 318:20 Ambig 2.09, 3.25 A or (resid 10 and name HN) (resid 10 and name HG1*) ! 0.0996 318:20 ----- 3.02, 4.00 A assign (resid 10 and name HN) (resid 10 and name HG2*) 2.30 0.50 0.50 ! 0.9976 319:20 Intra 2.19, 3.08 A assign (resid 144 and name HN) (resid 111 and name HB*) 3.65 1.85 1.85 ! 0.0000 320:20 Long 5.14, 6.23 A assign (resid 116 and name HN) (resid 115 and name HB*) 2.30 0.50 0.50 ! 0.9753 321:20 Seq 2.67, 3.60 A assign (resid 18 and name HN) (resid 105 and name HG2*) 2.65 0.85 0.85 ! 0.9706 323:20 Long 3.02, 4.15 A assign (resid 125 and name HN) (resid 124 and name HG2*) 2.30 0.50 0.50 ! 0.9761 325:20 Seq 2.79, 3.51 A assign (resid 18 and name HN) (resid 104 and name HG2*) 3.15 1.35 1.35 ! 0.5793 326:20 Ambig 3.69, 4.82 A or (resid 117 and name HN) (resid 41 and name HG2*) ! 0.3764 326:20 ----- 3.97, 4.75 A assign (resid 110 and name HN) (resid 110 and name HB) 2.65 0.85 0.85 ! 0.0000 327:20 Intra 2.52, 3.02 A assign (resid 52 and name HN) (resid 50 and name HA) 3.15 1.35 1.35 ! 0.0000 329:20 Mid 4.01, 4.17 A assign (resid 110 and name HN) (resid 110 and name HA) 2.65 0.85 0.85 ! 0.0000 330:20 Intra 2.78, 2.86 A assign (resid 56 and name HN) (resid 55 and name HA) 2.65 0.85 0.85 ! 0.9991 331:20 Seq 2.17, 2.22 A assign (resid 87 and name HN) (resid 87 and name HA) 2.65 0.85 0.85 ! 0.0000 332:20 Intra 2.70, 2.76 A assign (resid 58 and name HN) (resid 58 and name HA) 3.15 1.35 1.35 ! 0.9975 333:20 Intra 2.80, 2.85 A assign (resid 88 and name HN) (resid 88 and name HA) 2.65 0.85 0.85 ! 0.0000 334:20 Intra 2.84, 2.88 A assign (resid 110 and name HN) (resid 109 and name HA) 2.30 0.50 0.50 ! 0.9980 335:20 Seq 2.12, 2.19 A assign (resid 109 and name HN) (resid 109 and name HA) 2.65 0.85 0.85 ! 0.8943 336:20 Ambig 2.82, 2.87 A or (resid 108 and name HD21) (resid 109 and name HA) ! 0.1057 336:20 ----- 4.03, 5.55 A assign (resid 71 and name HD21) (resid 71 and name HB1) 2.65 0.85 0.85 ! 0.9187 338:20 Ambig 2.18, 2.37 A or (resid 87 and name HN) (resid 84 and name HB1) ! 0.0783 338:20 ----- 3.28, 3.85 A assign (resid 139 and name HD21) (resid 139 and name HB1) 2.65 0.85 0.85 ! 0.9801 339:20 Intra 2.12, 3.20 A assign (resid 56 and name HD21) (resid 58 and name HB2) 3.65 1.85 1.85 ! 0.0000 340:20 Mid 2.16, 4.06 A assign (resid 129 and name HD21) (resid 129 and name HB2) 2.65 0.85 0.85 ! 0.0000 341:20 Intra 2.82, 2.97 A assign (resid 129 and name HD21) (resid 129 and name HB1) 2.65 0.85 0.85 ! 0.0000 342:20 Intra 2.15, 2.21 A assign (resid 108 and name HD21) (resid 108 and name HB1) 2.65 0.85 0.85 ! 0.9359 343:20 Intra 2.19, 2.60 A assign (resid 65 and name HN) (resid 65 and name HB2) 2.65 0.85 0.85 ! 0.5178 344:20 Ambig 2.11, 2.39 A or (resid 65 and name HD21) (resid 65 and name HB2) ! 0.4822 344:20 ----- 2.13, 2.33 A assign (resid 65 and name HD21) (resid 65 and name HB1) 2.65 0.85 0.85 ! 0.8746 345:20 Ambig 2.25, 3.20 A or (resid 65 and name HN) (resid 65 and name HB1) ! 0.1254 345:20 ----- 3.11, 3.57 A assign (resid 52 and name HN) (resid 51 and name HB*) 2.65 0.85 0.85 ! 0.0000 346:20 Seq 1.98, 2.66 A assign (resid 36 and name HN) (resid 34 and name HG2*) 3.15 1.35 1.35 ! 0.0000 347:20 Mid 1.99, 3.23 A assign (resid 110 and name HN) (resid 110 and name HG2*) 3.15 1.35 1.35 ! 0.0000 348:20 Intra 2.68, 4.05 A assign (resid 58 and name HN) (resid 57 and name HG2*) 3.65 1.85 1.85 ! 0.9751 349:20 Seq 2.81, 5.04 A assign (resid 56 and name HN) (resid 99 and name HB*) 2.65 0.85 0.85 ! 0.9505 350:20 Long 3.71, 4.45 A assign (resid 139 and name HD22) (resid 117 and name HG2*) 3.15 1.35 1.35 ! 0.9976 351:20 Long 2.34, 4.59 A assign (resid 87 and name HN) (resid 87 and name HD2*) 2.65 0.85 0.85 ! 0.8610 352:20 Ambig 3.75, 4.34 A or (resid 36 and name HN) (resid 87 and name HD2*) ! 0.1390 352:20 ----- 5.08, 5.75 A assign (resid 36 and name HN) (resid 125 and name HG2*) 4.15 2.35 2.35 ! 0.5507 353:20 Ambig 4.44, 7.02 A or (resid 36 and name HN) (resid 125 and name HG1*) ! 0.4493 353:20 ----- 4.60, 5.81 A assign (resid 110 and name HN) (resid 109 and name HB*) 2.65 0.85 0.85 ! 0.9758 356:20 Seq 2.57, 3.67 A assign (resid 109 and name HN) (resid 109 and name HB*) 2.30 0.50 0.50 ! 0.9922 357:20 Intra 2.35, 2.91 A assign (resid 56 and name HN) (resid 60 and name HG2*) 3.15 1.35 1.35 ! 0.9295 361:20 Mid 3.20, 4.39 A assign (resid 94 and name HN) (resid 93 and name HB2) 3.15 1.35 1.35 ! 0.0000 365:20 Seq 3.84, 4.31 A assign (resid 76 and name HN) (resid 75 and name HA) 2.65 0.85 0.85 ! 0.0000 366:20 Seq 2.05, 2.07 A assign (resid 67 and name HN) (resid 63 and name HA) 2.65 0.85 0.85 ! 0.0000 367:20 Mid 2.66, 3.13 A assign (resid 95 and name HN) (resid 94 and name HA) 2.65 0.85 0.85 ! 0.0000 369:20 Seq 2.13, 2.30 A assign (resid 84 and name HN) (resid 83 and name HA) 2.65 0.85 0.85 ! 0.0000 370:20 Seq 2.07, 2.15 A assign (resid 66 and name HN) (resid 66 and name HA) 2.65 0.85 0.85 ! 0.9949 371:20 Intra 2.14, 2.21 A assign (resid 76 and name HN) (resid 76 and name HA2) 2.65 0.85 0.85 ! 0.0000 372:20 Intra 2.38, 2.40 A assign (resid 76 and name HN) (resid 76 and name HA1) 2.65 0.85 0.85 ! 0.0000 373:20 Intra 2.92, 2.93 A assign (resid 68 and name HD*) (resid 68 and name HB2) 2.65 0.85 0.85 ! 0.9095 374:20 Ambig 2.36, 3.03 A or (resid 82 and name HD*) (resid 68 and name HB2) ! 0.0859 374:20 ----- 3.49, 5.87 A assign (resid 95 and name HN) (resid 95 and name HB1) 2.65 0.85 0.85 ! 0.0000 375:20 Intra 2.33, 2.83 A assign (resid 95 and name HN) (resid 95 and name HB2) 3.15 1.35 1.35 ! 0.0000 376:20 Intra 2.54, 3.65 A assign (resid 84 and name HN) (resid 84 and name HB1) 2.65 0.85 0.85 ! 0.6498 377:20 Ambig 2.56, 2.69 A or (resid 56 and name HD21) (resid 58 and name HB1) ! 0.3502 377:20 ----- 2.84, 3.65 A assign (resid 47 and name HN) (resid 44 and name HB1) 3.15 1.35 1.35 ! 0.4818 378:20 Ambig 2.59, 3.20 A or (resid 59 and name HN) (resid 58 and name HB1) ! 0.4577 378:20 ----- 2.61, 3.15 A assign (resid 90 and name HD*) (resid 90 and name HB1) 2.65 0.85 0.85 ! 0.0000 379:20 Intra 2.37, 3.07 A assign (resid 95 and name HN) (resid 94 and name HB) 2.30 0.50 0.50 ! 0.0000 380:20 Seq 2.34, 2.61 A assign (resid 47 and name HN) (resid 47 and name HB*) 2.65 0.85 0.85 ! 0.9658 381:20 Intra 2.33, 2.63 A assign (resid 94 and name HN) (resid 59 and name HD2*) 2.65 0.85 0.85 ! 0.8225 382:20 Ambig 2.71, 3.99 A or (resid 56 and name HD21) (resid 59 and name HD2*) ! 0.1775 382:20 ----- 3.50, 4.33 A assign (resid 99 and name HN) (resid 99 and name HB*) 2.65 0.85 0.85 ! 0.0000 383:20 Intra 2.87, 3.39 A assign (resid 90 and name HD*) (resid 86 and name HG2*) 2.65 0.85 0.85 ! 0.0000 384:20 Mid 1.95, 5.23 A assign (resid 95 and name HN) (resid 94 and name HG2*) 3.15 1.35 1.35 ! 0.9540 386:20 Seq 3.49, 4.56 A assign (resid 68 and name HD*) (resid 70 and name HG2*) 2.65 0.85 0.85 ! 0.7561 388:20 Ambig 3.89, 4.84 A or (resid 82 and name HD*) (resid 70 and name HG2*) ! 0.2439 388:20 ----- 4.70, 6.55 A assign (resid 82 and name HD*) (resid 60 and name HG1*) 2.30 0.50 0.50 ! 0.5435 389:20 Ambig 2.30, 5.21 A or (resid 82 and name HD*) (resid 60 and name HG2*) ! 0.2819 389:20 ----- 2.56, 4.74 A or (resid 68 and name HD*) (resid 60 and name HG1*) ! 0.1519 389:20 ----- 2.84, 5.97 A assign (resid 94 and name HN) (resid 30 and name HG2*) 3.15 1.35 1.35 ! 0.0000 390:20 Long 3.82, 5.01 A assign (resid 68 and name HD*) (resid 63 and name HG2*) 2.65 0.85 0.85 ! 0.8212 391:20 Ambig 2.98, 4.98 A or (resid 82 and name HD*) (resid 63 and name HG2*) ! 0.1064 391:20 ----- 4.19, 7.49 A assign (resid 67 and name HN) (resid 63 and name HG2*) 3.15 1.35 1.35 ! 0.6990 392:20 Ambig 4.41, 5.71 A or (resid 68 and name HZ) (resid 63 and name HG2*) ! 0.1704 392:20 ----- 5.59, 7.21 A or (resid 68 and name HZ) (resid 99 and name HB*) ! 0.1306 392:20 ----- 5.84, 7.31 A assign (resid 99 and name HN) (resid 25 and name HG1*) 3.15 1.35 1.35 ! 0.0000 394:20 Long 4.11, 4.65 A assign (resid 94 and name HN) (resid 94 and name HG1*) 2.65 0.85 0.85 ! 0.0000 400:20 Intra 2.95, 3.96 A assign (resid 94 and name HN) (resid 92 and name HG2*) 2.65 0.85 0.85 ! 0.0000 401:20 Mid 3.08, 3.96 A assign (resid 82 and name HD*) (resid 80 and name HG2*) 2.65 0.85 0.85 ! 0.0000 402:20 Mid 3.08, 4.85 A assign (resid 99 and name HN) (resid 97 and name HG2*) 2.65 0.85 0.85 ! 0.0000 403:20 Mid 2.50, 3.30 A assign (resid 82 and name HD*) (resid 92 and name HD1*) 3.65 1.85 1.85 ! 0.7768 406:20 Ambig 5.11, 6.91 A or (resid 94 and name HN) (resid 92 and name HD1*) ! 0.2232 406:20 ----- 6.29, 7.09 A assign (resid 100 and name HD*) (resid 100 and name HB*) 2.30 0.50 0.50 ! 0.9829 409:20 Intra 2.35, 3.04 A assign (resid 106 and name HD21) (resid 106 and name HB2) 2.65 0.85 0.85 ! 0.9525 410:20 Intra 2.13, 2.28 A assign (resid 3 and name HD22) (resid 129 and name HB1) 3.15 1.35 1.35 ! 0.9558 411:20 Long 2.07, 3.04 A assign (resid 89 and name HD21) (resid 89 and name HB2) 2.65 0.85 0.85 ! 0.8910 412:20 Ambig 2.17, 2.28 A or (resid 89 and name HD22) (resid 89 and name HB2) ! 0.0554 412:20 ----- 3.44, 3.49 A assign (resid 66 and name HD*) (resid 66 and name HB*) 2.65 0.85 0.85 ! 0.0000 413:20 Intra 2.29, 3.05 A assign (resid 29 and name HE22) (resid 29 and name HG*) 3.15 1.35 1.35 ! 0.0000 414:20 Intra 3.45, 3.83 A assign (resid 100 and name HD*) (resid 22 and name HG2) 3.65 1.85 1.85 ! 0.0000 415:20 Long 2.46, 4.39 A assign (resid 82 and name HE*) (resid 99 and name HB*) 2.65 0.85 0.85 ! 0.9104 418:20 Ambig 2.34, 4.29 A or (resid 82 and name HE*) (resid 63 and name HG2*) ! 0.0410 418:20 ----- 3.93, 7.39 A assign (resid 90 and name HE*) (resid 86 and name HG2*) 2.30 0.50 0.50 ! 0.0000 421:20 Mid 2.17, 5.17 A assign (resid 68 and name HZ) (resid 70 and name HG2*) 2.65 0.85 0.85 ! 0.0000 423:20 Mid 2.49, 3.63 A assign (resid 59 and name HN) (resid 60 and name HG2*) 3.15 1.35 1.35 ! 0.9493 424:20 Seq 3.94, 5.23 A assign (resid 68 and name HE*) (resid 70 and name HG2*) 3.15 1.35 1.35 ! 0.7791 425:20 Ambig 2.92, 4.08 A or (resid 82 and name HE*) (resid 70 and name HG2*) ! 0.2209 425:20 ----- 3.60, 5.38 A assign (resid 68 and name HE*) (resid 70 and name HG1*) 3.15 1.35 1.35 ! 0.8664 426:20 Ambig 4.61, 5.81 A or (resid 82 and name HE*) (resid 70 and name HG1*) ! 0.1336 426:20 ----- 6.30, 7.87 A assign (resid 122 and name HN) (resid 121 and name HB*) 2.65 0.85 0.85 ! 0.0000 430:20 Seq 2.60, 3.45 A assign (resid 68 and name HE*) (resid 53 and name HG2*) 2.65 0.85 0.85 ! 0.9713 432:20 Long 2.06, 4.41 A assign (resid 37 and name HN) (resid 37 and name HD1*) 3.65 1.85 1.85 ! 0.0000 434:20 Intra 2.21, 4.05 A assign (resid 82 and name HE*) (resid 80 and name HG2*) 2.65 0.85 0.85 ! 0.9731 435:20 Mid 2.42, 4.01 A assign (resid 66 and name HD*) (resid 69 and name HD1*) 3.15 1.35 1.35 ! 0.9426 437:20 Mid 2.76, 5.32 A assign (resid 103 and name HD*) (resid 50 and name HA) 3.15 1.35 1.35 ! 0.9976 439:20 Long 2.36, 4.01 A assign (resid 103 and name HZ) (resid 101 and name HD2*) 3.15 1.35 1.35 ! 0.0000 440:20 Mid 3.86, 5.27 A assign (resid 103 and name HZ) (resid 116 and name HD2*) 2.65 0.85 0.85 ! 0.6108 441:20 Ambig 3.46, 4.99 A or (resid 48 and name HZ) (resid 116 and name HD2*) ! 0.3892 441:20 ----- 3.73, 5.14 A assign (resid 82 and name HZ) (resid 99 and name HB*) 2.65 0.85 0.85 ! 0.9974 442:20 Long 2.09, 2.91 A assign (resid 82 and name HZ) (resid 70 and name HG1*) 4.15 2.35 2.35 ! 0.0000 444:20 Long 6.13, 7.12 A assign (resid 103 and name HD*) (resid 50 and name HG1*) 3.15 1.35 1.35 ! 0.0000 446:20 Long 4.29, 6.75 A assign (resid 82 and name HZ) (resid 53 and name HG2*) 2.65 0.85 0.85 ! 0.9291 449:20 Long 3.06, 4.17 A assign (resid 103 and name HD*) (resid 23 and name HG2*) 2.65 0.85 0.85 ! 0.5503 450:20 Ambig 2.42, 5.67 A or (resid 103 and name HD*) (resid 23 and name HG1*) ! 0.4497 450:20 ----- 2.51, 7.61 A assign (resid 103 and name HD*) (resid 21 and name HG1*) 2.65 0.85 0.85 ! 0.7757 453:20 Ambig 2.81, 5.12 A or (resid 48 and name HD*) (resid 21 and name HG1*) ! 0.2243 453:20 ----- 3.46, 5.87 A assign (resid 100 and name HE*) (resid 97 and name HG2*) 2.65 0.85 0.85 ! 0.5886 454:20 Ambig 2.54, 4.29 A or (resid 100 and name HD*) (resid 97 and name HG2*) ! 0.4114 454:20 ----- 2.69, 4.54 A assign (resid 82 and name HZ) (resid 80 and name HG2*) 3.15 1.35 1.35 ! 0.0000 455:20 Mid 2.64, 3.60 A assign (resid 78 and name HN) (resid 78 and name HD1*) 3.15 1.35 1.35 ! 0.0000 456:20 Intra 4.15, 4.86 A assign (resid 100 and name HE*) (resid 97 and name HD1*) 3.15 1.35 1.35 ! 0.0000 457:20 Mid 3.74, 6.05 A assign (resid 103 and name HE*) (resid 101 and name HD2*) 3.15 1.35 1.35 ! 0.0000 463:20 Mid 3.92, 6.06 A assign (resid 48 and name HE*) (resid 116 and name HD2*) 3.15 1.35 1.35 ! 0.9658 464:20 Long 2.27, 5.02 A assign (resid 103 and name HE*) (resid 50 and name HG1*) 3.15 1.35 1.35 ! 0.0000 465:20 Long 3.90, 6.28 A assign (resid 103 and name HE*) (resid 23 and name HG1*) 2.65 0.85 0.85 ! 0.4971 467:20 Ambig 2.71, 6.99 A or (resid 103 and name HE*) (resid 23 and name HG2*) ! 0.4823 467:20 ----- 2.72, 5.88 A assign (resid 103 and name HE*) (resid 78 and name HD1*) 2.65 0.85 0.85 ! 0.0000 468:20 Long 2.06, 4.05 A assign (resid 12 and name HA) (resid 12 and name HB) 2.65 0.85 0.85 ! 0.9279 470:20 Intra 3.01, 3.03 A assign (resid 14 and name HA) (resid 143 and name HB) 2.65 0.85 0.85 ! 0.0000 471:20 Long 2.34, 2.53 A assign (resid 14 and name HA) (resid 14 and name HB*) 2.30 0.50 0.50 ! 0.0000 472:20 Intra 2.28, 2.63 A assign (resid 79 and name HA) (resid 79 and name HB2) 2.65 0.85 0.85 ! 0.0000 473:20 Intra 3.02, 3.02 A assign (resid 79 and name HA) (resid 79 and name HB1) 2.30 0.50 0.50 ! 0.9754 474:20 Intra 2.41, 2.44 A assign (resid 42 and name HA) (resid 42 and name HB*) 2.30 0.50 0.50 ! 0.0000 475:20 Intra 2.40, 2.73 A assign (resid 114 and name HA) (resid 114 and name HB1) 2.65 0.85 0.85 ! 0.0000 476:20 Intra 2.38, 2.45 A assign (resid 102 and name HA) (resid 102 and name HB1) 2.65 0.85 0.85 ! 0.0000 479:20 Intra 2.95, 3.00 A assign (resid 14 and name HA) (resid 145 and name HG2*) 3.65 1.85 1.85 ! 0.7256 480:20 Ambig 3.92, 5.23 A or (resid 14 and name HA) (resid 12 and name HG2*) ! 0.2744 480:20 ----- 4.61, 5.61 A assign (resid 14 and name HA) (resid 143 and name HG2*) 3.65 1.85 1.85 ! 0.0000 481:20 Long 4.16, 4.91 A assign (resid 137 and name HA) (resid 137 and name HB*) 2.30 0.50 0.50 ! 0.9581 482:20 Intra 2.45, 2.67 A assign (resid 12 and name HA) (resid 13 and name HG2*) 3.15 1.35 1.35 ! 0.8491 483:20 Ambig 3.61, 4.74 A or (resid 79 and name HA) (resid 122 and name HG2*) ! 0.1509 483:20 ----- 4.81, 6.98 A assign (resid 14 and name HA) (resid 13 and name HG2*) 3.15 1.35 1.35 ! 0.7379 485:20 Ambig 3.78, 4.97 A or (resid 40 and name HA) (resid 122 and name HG2*) ! 0.2621 485:20 ----- 4.49, 6.22 A assign (resid 66 and name HB*) (resid 66 and name HA) 2.65 0.85 0.85 ! 0.0000 487:20 Intra 2.45, 2.78 A assign (resid 130 and name HB1) (resid 130 and name HA) 2.65 0.85 0.85 ! 0.0000 488:20 Intra 2.40, 2.62 A assign (resid 52 and name HB1) (resid 52 and name HA) 2.65 0.85 0.85 ! 0.9963 489:20 Intra 2.38, 2.48 A assign (resid 71 and name HB2) (resid 79 and name HB2) 3.15 1.35 1.35 ! 0.0000 491:20 Long 3.39, 3.70 A assign (resid 44 and name HB2) (resid 114 and name HB1) 3.15 1.35 1.35 ! 0.9254 492:20 Long 3.04, 4.74 A assign (resid 58 and name HB1) (resid 58 and name HA) 2.65 0.85 0.85 ! 0.5226 494:20 Ambig 2.43, 2.85 A or (resid 58 and name HB2) (resid 58 and name HA) ! 0.4774 494:20 ----- 2.47, 2.69 A assign (resid 130 and name HB2) (resid 130 and name HA) 2.65 0.85 0.85 ! 0.9898 495:20 Intra 2.38, 2.45 A assign (resid 64 and name HB1) (resid 64 and name HA) 2.65 0.85 0.85 ! 0.0000 496:20 Intra 3.00, 3.02 A assign (resid 106 and name HB1) (resid 106 and name HA) 3.15 1.35 1.35 ! 0.0000 497:20 Intra 2.51, 2.91 A assign (resid 95 and name HB2) (resid 95 and name HA) 2.65 0.85 0.85 ! 0.5356 498:20 Ambig 2.37, 2.42 A or (resid 52 and name HB2) (resid 52 and name HA) ! 0.4644 498:20 ----- 2.42, 2.51 A assign (resid 16 and name HB2) (resid 17 and name HD1) 3.65 1.85 1.85 ! 0.9799 499:20 Seq 2.79, 3.67 A assign (resid 71 and name HB1) (resid 79 and name HB1) 3.15 1.35 1.35 ! 0.6819 501:20 Ambig 3.20, 3.57 A or (resid 44 and name HB1) (resid 114 and name HB1) ! 0.3117 501:20 ----- 3.64, 4.87 A assign (resid 17 and name HB2) (resid 17 and name HA) 2.65 0.85 0.85 ! 0.0000 502:20 Intra 2.78, 2.94 A assign (resid 29 and name HB1) (resid 29 and name HA) 2.65 0.85 0.85 ! 0.0000 507:20 Intra 2.43, 2.51 A assign (resid 16 and name HB2) (resid 17 and name HD2) 3.15 1.35 1.35 ! 0.9950 508:20 Seq 2.11, 2.91 A assign (resid 127 and name HA) (resid 127 and name HB1) 3.15 1.35 1.35 ! 0.0000 509:20 Intra 2.51, 2.59 A assign (resid 85 and name HB2) (resid 85 and name HA) 2.65 0.85 0.85 ! 0.0000 510:20 Intra 2.65, 2.67 A assign (resid 75 and name HB2) (resid 75 and name HA) 2.30 0.50 0.50 ! 0.5203 511:20 Ambig 2.84, 2.90 A or (resid 120 and name HB2) (resid 120 and name HA) ! 0.4797 511:20 ----- 2.88, 2.92 A assign (resid 4 and name HG2) (resid 4 and name HA) 3.15 1.35 1.35 ! 0.8650 512:20 Ambig 2.68, 3.50 A or (resid 4 and name HG1) (resid 4 and name HA) ! 0.1350 512:20 ----- 3.65, 4.07 A assign (resid 29 and name HG*) (resid 28 and name HB1) 3.15 1.35 1.35 ! 0.9775 513:20 Seq 2.64, 3.79 A assign (resid 105 and name HB) (resid 17 and name HA) 2.65 0.85 0.85 ! 0.9588 514:20 Long 2.27, 2.78 A assign (resid 29 and name HG*) (resid 29 and name HA) 2.30 0.50 0.50 ! 0.7944 520:20 Ambig 2.36, 2.85 A or (resid 29 and name HB2) (resid 29 and name HA) ! 0.1923 520:20 ----- 2.98, 3.01 A assign (resid 144 and name HB) (resid 111 and name HA) 2.30 0.50 0.50 ! 0.0000 521:20 Long 1.89, 2.11 A assign (resid 120 and name HB2) (resid 120 and name HD2) 2.65 0.85 0.85 ! 0.9446 522:20 Intra 2.89, 3.00 A assign (resid 17 and name HG2) (resid 17 and name HD2) 2.65 0.85 0.85 ! 0.9954 523:20 Intra 2.26, 2.33 A assign (resid 120 and name HB1) (resid 120 and name HA) 2.30 0.50 0.50 ! 0.7832 527:20 Ambig 2.25, 2.27 A or (resid 120 and name HG*) (resid 120 and name HA) ! 0.1510 527:20 ----- 2.96, 3.60 A assign (resid 33 and name HB2) (resid 33 and name HA) 2.65 0.85 0.85 ! 0.5888 528:20 Ambig 2.74, 2.89 A or (resid 33 and name HG1) (resid 33 and name HA) ! 0.4112 528:20 ----- 2.91, 3.38 A assign (resid 85 and name HB1) (resid 85 and name HA) 3.15 1.35 1.35 ! 0.0000 529:20 Intra 2.30, 2.32 A assign (resid 75 and name HB1) (resid 75 and name HA) 3.15 1.35 1.35 ! 0.9971 530:20 Intra 2.23, 2.25 A assign (resid 1 and name HB) (resid 1 and name HA) 2.65 0.85 0.85 ! 0.9517 531:20 Intra 2.43, 2.73 A assign (resid 4 and name HB1) (resid 5 and name HA) 3.15 1.35 1.35 ! 0.5169 532:20 Ambig 4.15, 5.44 A or (resid 6 and name HB) (resid 5 and name HA) ! 0.3513 532:20 ----- 4.43, 4.62 A or (resid 91 and name HG1) (resid 92 and name HA) ! 0.0461 532:20 ----- 6.21, 6.57 A or (resid 87 and name HB2) (resid 92 and name HA) ! 0.0449 532:20 ----- 6.24, 7.18 A assign (resid 94 and name HB) (resid 94 and name HA) 3.15 1.35 1.35 ! 0.0000 533:20 Intra 2.41, 2.53 A assign (resid 7 and name HB*) (resid 7 and name HA) 2.30 0.50 0.50 ! 0.9853 534:20 Intra 2.40, 2.75 A assign (resid 4 and name HB2) (resid 4 and name HA) 2.65 0.85 0.85 ! 0.9930 535:20 Intra 2.40, 2.59 A assign (resid 87 and name HB2) (resid 87 and name HA) 2.65 0.85 0.85 ! 0.9834 536:20 Intra 2.48, 2.51 A assign (resid 33 and name HG1) (resid 33 and name HD1) 2.30 0.50 0.50 ! 0.7431 537:20 Ambig 2.30, 2.31 A or (resid 24 and name HG1) (resid 24 and name HD2) ! 0.2360 537:20 ----- 2.78, 2.84 A assign (resid 120 and name HG*) (resid 120 and name HD1) 3.15 1.35 1.35 ! 0.9663 538:20 Intra 2.26, 2.47 A assign (resid 75 and name HG1) (resid 75 and name HD2) 3.15 1.35 1.35 ! 0.0000 539:20 Intra 2.64, 2.70 A assign (resid 120 and name HG*) (resid 120 and name HD2) 2.30 0.50 0.50 ! 0.9896 540:20 Intra 2.30, 2.65 A assign (resid 33 and name HG2) (resid 33 and name HD1) 2.65 0.85 0.85 ! 0.9443 541:20 Intra 2.67, 2.81 A assign (resid 33 and name HG1) (resid 93 and name HB1) 3.15 1.35 1.35 ! 0.9581 542:20 Long 2.13, 3.18 A assign (resid 33 and name HG2) (resid 93 and name HB1) 3.65 1.85 1.85 ! 0.7235 543:20 Ambig 3.87, 4.54 A or (resid 91 and name HG1) (resid 93 and name HB1) ! 0.1800 543:20 ----- 4.88, 5.70 A or (resid 85 and name HB1) (resid 67 and name HB*) ! 0.0684 543:20 ----- 5.73, 7.77 A assign (resid 109 and name HB*) (resid 17 and name HA) 3.65 1.85 1.85 ! 0.0000 544:20 Long 2.81, 4.26 A assign (resid 51 and name HG*) (resid 50 and name HA) 3.15 1.35 1.35 ! 0.8241 548:20 Ambig 3.30, 4.60 A or (resid 49 and name HG2*) (resid 50 and name HA) ! 0.1759 548:20 ----- 4.27, 5.42 A assign (resid 24 and name HG1) (resid 24 and name HD1) 2.30 0.50 0.50 ! 0.8124 550:20 Ambig 2.24, 2.27 A or (resid 75 and name HG2) (resid 75 and name HD1) ! 0.1695 550:20 ----- 2.91, 2.97 A assign (resid 33 and name HG1) (resid 33 and name HD2) 2.65 0.85 0.85 ! 0.6152 551:20 Ambig 2.67, 2.87 A or (resid 33 and name HB2) (resid 33 and name HD2) ! 0.3730 551:20 ----- 2.90, 3.37 A assign (resid 149 and name HG*) (resid 149 and name HD2) 2.30 0.50 0.50 ! 0.9606 552:20 Intra 2.26, 2.50 A assign (resid 149 and name HG*) (resid 149 and name HD1) 2.65 0.85 0.85 ! 0.8319 553:20 Ambig 2.25, 2.64 A or (resid 149 and name HB1) (resid 149 and name HD1) ! 0.1681 553:20 ----- 2.94, 3.06 A assign (resid 85 and name HG2) (resid 85 and name HD*) 2.65 0.85 0.85 ! 0.0000 554:20 Intra 2.25, 2.61 A assign (resid 33 and name HG2) (resid 33 and name HD2) 2.65 0.85 0.85 ! 0.8610 555:20 Ambig 2.29, 2.31 A or (resid 128 and name HG1) (resid 33 and name HD2) ! 0.1353 555:20 ----- 3.12, 4.42 A assign (resid 75 and name HB1) (resid 75 and name HD1) 2.65 0.85 0.85 ! 0.9890 556:20 Intra 2.99, 3.24 A assign (resid 17 and name HG1) (resid 17 and name HD2) 2.65 0.85 0.85 ! 0.9012 557:20 Ambig 2.65, 2.96 A or (resid 17 and name HB1) (resid 17 and name HD2) ! 0.0988 557:20 ----- 3.83, 3.91 A assign (resid 55 and name HG2) (resid 55 and name HD2) 2.65 0.85 0.85 ! 0.0000 558:20 Intra 2.26, 2.27 A assign (resid 55 and name HG2) (resid 55 and name HD1) 2.65 0.85 0.85 ! 0.0000 559:20 Intra 2.92, 2.95 A assign (resid 10 and name HB) (resid 140 and name HA1) 4.15 2.35 2.35 ! 0.9634 560:20 Long 2.81, 3.36 A assign (resid 86 and name HG2*) (resid 86 and name HB) 2.65 0.85 0.85 ! 0.9543 561:20 Intra 2.40, 2.65 A assign (resid 77 and name HB2) (resid 74 and name HB) 3.15 1.35 1.35 ! 0.9088 562:20 Ambig 3.30, 3.78 A or (resid 77 and name HB1) (resid 74 and name HB) ! 0.0912 562:20 ----- 4.84, 5.35 A assign (resid 86 and name HG2*) (resid 86 and name HA) 2.65 0.85 0.85 ! 0.0000 563:20 Intra 2.33, 2.99 A assign (resid 92 and name HB) (resid 92 and name HA) 2.65 0.85 0.85 ! 0.0000 564:20 Intra 3.02, 3.04 A assign (resid 7 and name HG2) (resid 7 and name HA) 2.65 0.85 0.85 ! 0.7229 565:20 Ambig 2.38, 2.50 A or (resid 7 and name HG1) (resid 7 and name HA) ! 0.2750 565:20 ----- 2.80, 3.08 A assign (resid 2 and name HB1) (resid 2 and name HA) 2.65 0.85 0.85 ! 0.7880 566:20 Ambig 2.39, 2.49 A or (resid 2 and name HB2) (resid 2 and name HA) ! 0.2120 566:20 ----- 2.98, 3.02 A assign (resid 51 and name HB*) (resid 51 and name HA) 2.30 0.50 0.50 ! 0.7931 567:20 Ambig 2.44, 2.76 A or (resid 51 and name HD1) (resid 51 and name HA) ! 0.2012 567:20 ----- 3.07, 4.10 A assign (resid 87 and name HB1) (resid 87 and name HA) 2.65 0.85 0.85 ! 0.9918 568:20 Intra 2.31, 2.33 A assign (resid 98 and name HG) (resid 98 and name HA) 2.65 0.85 0.85 ! 0.4521 569:20 Ambig 3.10, 3.15 A or (resid 59 and name HG) (resid 98 and name HA) ! 0.3770 569:20 ----- 3.20, 3.91 A or (resid 86 and name HG2*) (resid 87 and name HA) ! 0.0715 569:20 ----- 4.22, 6.09 A or (resid 27 and name HB) (resid 98 and name HA) ! 0.0517 569:20 ----- 4.46, 4.84 A assign (resid 121 and name HB*) (resid 121 and name HA) 2.30 0.50 0.50 ! 0.9730 570:20 Intra 2.42, 2.64 A assign (resid 24 and name HB1) (resid 24 and name HD2) 3.15 1.35 1.35 ! 0.0000 571:20 Intra 3.90, 3.93 A assign (resid 104 and name HB) (resid 49 and name HB) 2.30 0.50 0.50 ! 0.0000 572:20 Long 1.92, 2.08 A assign (resid 69 and name HB) (resid 81 and name HB) 2.30 0.50 0.50 ! 0.0000 573:20 Long 1.89, 2.00 A assign (resid 91 and name HG2) (resid 93 and name HB1) 3.15 1.35 1.35 ! 0.4532 574:20 Ambig 3.99, 4.78 A or (resid 85 and name HG1) (resid 67 and name HB*) ! 0.4054 574:20 ----- 4.07, 6.38 A or (resid 61 and name HB1) (resid 67 and name HB*) ! 0.1103 574:20 ----- 5.05, 6.96 A assign (resid 77 and name HB1) (resid 42 and name HB*) 3.65 1.85 1.85 ! 0.5002 575:20 Ambig 5.28, 6.30 A or (resid 77 and name HB2) (resid 42 and name HB*) ! 0.3081 575:20 ----- 5.72, 6.70 A or (resid 41 and name HB) (resid 42 and name HB*) ! 0.1916 575:20 ----- 6.20, 6.66 A assign (resid 47 and name HD2) (resid 114 and name HB1) 3.15 1.35 1.35 ! 0.9607 577:20 Long 2.70, 3.30 A assign (resid 17 and name HB1) (resid 107 and name HA) 3.65 1.85 1.85 ! 0.9761 578:20 Long 2.19, 2.93 A assign (resid 51 and name HD1) (resid 50 and name HA) 3.15 1.35 1.35 ! 0.8679 581:20 Ambig 2.97, 5.26 A or (resid 51 and name HB*) (resid 50 and name HA) ! 0.1205 581:20 ----- 4.13, 4.95 A assign (resid 60 and name HB) (resid 60 and name HA) 2.65 0.85 0.85 ! 0.5604 582:20 Ambig 2.99, 3.03 A or (resid 61 and name HD2) (resid 60 and name HA) ! 0.3665 582:20 ----- 3.21, 5.91 A assign (resid 17 and name HG1) (resid 17 and name HD1) 2.65 0.85 0.85 ! 0.8370 583:20 Ambig 2.29, 2.31 A or (resid 17 and name HB1) (resid 17 and name HD1) ! 0.1591 583:20 ----- 3.02, 3.91 A assign (resid 85 and name HG1) (resid 85 and name HD*) 3.15 1.35 1.35 ! 0.9969 584:20 Intra 2.24, 2.51 A assign (resid 54 and name HB2) (resid 55 and name HD2) 3.15 1.35 1.35 ! 0.6707 586:20 Ambig 4.35, 4.47 A or (resid 54 and name HG) (resid 55 and name HD2) ! 0.3293 586:20 ----- 4.89, 5.12 A assign (resid 55 and name HG1) (resid 55 and name HD1) 2.65 0.85 0.85 ! 0.9820 587:20 Intra 2.28, 2.29 A assign (resid 110 and name HG2*) (resid 110 and name HB) 2.30 0.50 0.50 ! 0.9455 588:20 Intra 2.41, 2.65 A assign (resid 145 and name HG2*) (resid 145 and name HB) 2.30 0.50 0.50 ! 0.0000 589:20 Intra 2.43, 2.65 A assign (resid 74 and name HG2*) (resid 74 and name HB) 2.30 0.50 0.50 ! 0.9543 590:20 Intra 2.44, 2.66 A assign (resid 32 and name HG2*) (resid 32 and name HA) 2.65 0.85 0.85 ! 0.9125 591:20 Ambig 2.43, 3.06 A or (resid 115 and name HB*) (resid 117 and name HA) ! 0.0275 591:20 ----- 4.35, 5.59 A assign (resid 110 and name HG2*) (resid 110 and name HA) 2.65 0.85 0.85 ! 0.9570 592:20 Intra 2.30, 2.93 A assign (resid 145 and name HG2*) (resid 145 and name HA) 2.30 0.50 0.50 ! 0.8564 593:20 Ambig 2.35, 3.00 A or (resid 143 and name HG2*) (resid 145 and name HA) ! 0.1416 593:20 ----- 3.17, 4.64 A assign (resid 117 and name HG2*) (resid 117 and name HA) 2.65 0.85 0.85 ! 0.5686 594:20 Ambig 2.38, 3.04 A or (resid 124 and name HG11) (resid 124 and name HA) ! 0.3918 594:20 ----- 2.53, 3.07 A assign (resid 92 and name HG12) (resid 92 and name HA) 2.65 0.85 0.85 ! 0.0000 595:20 Intra 2.59, 2.65 A assign (resid 59 and name HB2) (resid 59 and name HA) 2.65 0.85 0.85 ! 0.0000 596:20 Intra 3.00, 3.02 A assign (resid 126 and name HB*) (resid 130 and name HA) 2.30 0.50 0.50 ! 0.0000 597:20 Mid 1.95, 3.04 A assign (resid 98 and name HB1) (resid 98 and name HA) 2.65 0.85 0.85 ! 0.9520 598:20 Intra 3.01, 3.02 A assign (resid 115 and name HB*) (resid 115 and name HA) 2.30 0.50 0.50 ! 0.8794 599:20 Ambig 2.36, 2.62 A or (resid 116 and name HG) (resid 115 and name HA) ! 0.1038 599:20 ----- 3.37, 3.61 A assign (resid 109 and name HB*) (resid 109 and name HA) 2.30 0.50 0.50 ! 0.9443 600:20 Intra 2.36, 2.63 A assign (resid 136 and name HB*) (resid 136 and name HA) 2.65 0.85 0.85 ! 0.0000 601:20 Intra 2.31, 2.61 A assign (resid 111 and name HB*) (resid 146 and name HA2) 3.15 1.35 1.35 ! 0.0000 602:20 Long 1.93, 3.46 A assign (resid 49 and name HG2*) (resid 49 and name HB) 2.30 0.50 0.50 ! 0.8622 603:20 Ambig 2.43, 2.65 A or (resid 51 and name HG*) (resid 49 and name HB) ! 0.1065 603:20 ----- 3.44, 4.65 A assign (resid 12 and name HG2*) (resid 12 and name HB) 2.30 0.50 0.50 ! 0.6517 604:20 Ambig 2.43, 2.65 A or (resid 104 and name HG11) (resid 49 and name HB) ! 0.3453 604:20 ----- 2.71, 3.24 A assign (resid 32 and name HG2*) (resid 32 and name HB) 2.30 0.50 0.50 ! 0.9933 605:20 Intra 2.42, 2.65 A assign (resid 117 and name HG2*) (resid 117 and name HB) 2.30 0.50 0.50 ! 0.0000 606:20 Intra 2.45, 2.66 A assign (resid 143 and name HG2*) (resid 143 and name HB) 2.30 0.50 0.50 ! 0.9130 607:20 Ambig 2.45, 2.65 A or (resid 12 and name HG2*) (resid 143 and name HB) ! 0.0773 607:20 ----- 3.69, 4.70 A assign (resid 27 and name HG2*) (resid 28 and name HB1) 3.65 1.85 1.85 ! 0.3768 608:20 Ambig 6.23, 7.31 A or (resid 13 and name HG1*) (resid 14 and name HB*) ! 0.3394 608:20 ----- 6.34, 7.63 A or (resid 27 and name HG11) (resid 28 and name HB1) ! 0.2838 608:20 ----- 6.53, 6.64 A assign (resid 117 and name HG2*) (resid 42 and name HB*) 3.15 1.35 1.35 ! 0.0000 609:20 Long 3.76, 5.38 A assign (resid 10 and name HG1*) (resid 138 and name HB2) 3.15 1.35 1.35 ! 0.9876 610:20 Long 2.97, 4.91 A assign (resid 109 and name HB*) (resid 47 and name HA) 2.65 0.85 0.85 ! 0.9915 611:20 Long 1.99, 3.36 A assign (resid 47 and name HG2) (resid 47 and name HA) 2.65 0.85 0.85 ! 0.9519 612:20 Intra 2.58, 3.00 A assign (resid 88 and name HB*) (resid 88 and name HA) 2.30 0.50 0.50 ! 0.0000 613:20 Intra 2.42, 2.64 A assign (resid 111 and name HB*) (resid 111 and name HA) 2.30 0.50 0.50 ! 0.9387 614:20 Intra 2.38, 2.63 A assign (resid 144 and name HG2*) (resid 111 and name HA) 3.15 1.35 1.35 ! 0.8913 615:20 Ambig 3.48, 4.32 A or (resid 47 and name HG2) (resid 111 and name HA) ! 0.0409 615:20 ----- 5.82, 6.51 A assign (resid 32 and name HG2*) (resid 33 and name HD2) 2.65 0.85 0.85 ! 0.0000 616:20 Seq 2.22, 3.08 A assign (resid 148 and name HB*) (resid 149 and name HD1) 3.15 1.35 1.35 ! 0.0000 617:20 Seq 3.06, 4.63 A assign (resid 74 and name HG2*) (resid 75 and name HD1) 2.65 0.85 0.85 ! 0.5991 618:20 Ambig 3.76, 4.50 A or (resid 22 and name HG1) (resid 24 and name HD1) ! 0.4009 618:20 ----- 4.02, 5.45 A assign (resid 111 and name HB*) (resid 146 and name HA1) 2.65 0.85 0.85 ! 0.9947 619:20 Long 2.22, 3.79 A assign (resid 122 and name HG2*) (resid 122 and name HB) 3.15 1.35 1.35 ! 0.0000 620:20 Intra 2.41, 2.63 A assign (resid 63 and name HG2*) (resid 63 and name HB) 2.65 0.85 0.85 ! 0.9988 621:20 Intra 2.43, 2.65 A assign (resid 63 and name HG2*) (resid 63 and name HA) 2.65 0.85 0.85 ! 0.9988 622:20 Intra 2.33, 2.95 A assign (resid 6 and name HG1*) (resid 6 and name HA) 2.65 0.85 0.85 ! 0.9908 623:20 Intra 2.47, 3.25 A assign (resid 5 and name HG2*) (resid 5 and name HA) 2.30 0.50 0.50 ! 0.2562 624:20 Ambig 2.39, 3.16 A or (resid 92 and name HG2*) (resid 92 and name HA) ! 0.2350 624:20 ----- 2.43, 3.07 A or (resid 1 and name HG2*) (resid 1 and name HA) ! 0.2099 624:20 ----- 2.47, 3.14 A or (resid 1 and name HG1*) (resid 1 and name HA) ! 0.2070 624:20 ----- 2.48, 3.58 A or (resid 94 and name HG2*) (resid 92 and name HA) ! 0.0732 624:20 ----- 2.95, 4.41 A assign (resid 10 and name HG2*) (resid 10 and name HA) 2.65 0.85 0.85 ! 0.3898 625:20 Ambig 3.64, 3.90 A or (resid 25 and name HG1*) (resid 10 and name HA) ! 0.2989 625:20 ----- 3.80, 5.35 A or (resid 25 and name HG2*) (resid 10 and name HA) ! 0.1300 625:20 ----- 4.37, 5.82 A or (resid 23 and name HG1*) (resid 10 and name HA) ! 0.1059 625:20 ----- 4.52, 5.68 A assign (resid 124 and name HG2*) (resid 124 and name HA) 2.30 0.50 0.50 ! 0.6629 626:20 Ambig 2.47, 3.11 A or (resid 124 and name HD1*) (resid 122 and name HA) ! 0.2647 626:20 ----- 2.88, 4.76 A assign (resid 69 and name HG11) (resid 69 and name HA) 2.65 0.85 0.85 ! 0.9956 627:20 Intra 2.51, 2.58 A assign (resid 133 and name HG2*) (resid 133 and name HA) 2.65 0.85 0.85 ! 0.9820 628:20 Intra 2.26, 2.98 A assign (resid 122 and name HG2*) (resid 122 and name HA) 2.30 0.50 0.50 ! 0.0000 629:20 Intra 2.34, 2.97 A assign (resid 94 and name HG2*) (resid 94 and name HA) 2.65 0.85 0.85 ! 0.9181 630:20 Ambig 3.64, 3.92 A or (resid 92 and name HG2*) (resid 94 and name HA) ! 0.0819 630:20 ----- 5.44, 6.54 A assign (resid 69 and name HG2*) (resid 69 and name HA) 2.30 0.50 0.50 ! 0.8010 631:20 Ambig 2.48, 3.15 A or (resid 69 and name HD1*) (resid 69 and name HA) ! 0.1514 631:20 ----- 3.27, 4.16 A assign (resid 27 and name HG2*) (resid 98 and name HA) 2.65 0.85 0.85 ! 0.6140 632:20 Ambig 3.32, 4.19 A or (resid 87 and name HD1*) (resid 87 and name HA) ! 0.2100 632:20 ----- 3.97, 4.57 A or (resid 87 and name HD2*) (resid 87 and name HA) ! 0.0838 632:20 ----- 4.62, 5.02 A or (resid 92 and name HG2*) (resid 98 and name HA) ! 0.0424 632:20 ----- 5.18, 6.23 A assign (resid 27 and name HG2*) (resid 95 and name HA) 2.65 0.85 0.85 ! 0.9859 633:20 Long 2.10, 3.47 A assign (resid 23 and name HG2*) (resid 24 and name HD2) 2.65 0.85 0.85 ! 0.6624 634:20 Ambig 2.42, 5.05 A or (resid 23 and name HG1*) (resid 24 and name HD2) ! 0.3214 634:20 ----- 2.73, 3.79 A assign (resid 144 and name HG1*) (resid 17 and name HD1) 2.65 0.85 0.85 ! 0.9977 635:20 Long 2.15, 2.90 A assign (resid 21 and name HG2*) (resid 15 and name HA2) 3.15 1.35 1.35 ! 0.0000 636:20 Long 3.74, 4.88 A assign (resid 81 and name HG2*) (resid 81 and name HB) 2.30 0.50 0.50 ! 0.9757 637:20 Intra 2.44, 2.65 A assign (resid 26 and name HG2*) (resid 26 and name HB) 2.30 0.50 0.50 ! 0.9876 638:20 Intra 2.46, 2.66 A assign (resid 83 and name HG2*) (resid 83 and name HB) 2.30 0.50 0.50 ! 0.0000 639:20 Intra 2.37, 2.64 A assign (resid 69 and name HG2*) (resid 81 and name HB) 2.30 0.50 0.50 ! 0.5492 640:20 Ambig 2.71, 3.59 A or (resid 69 and name HD1*) (resid 81 and name HB) ! 0.4451 640:20 ----- 2.81, 4.22 A assign (resid 104 and name HD1*) (resid 49 and name HB) 2.65 0.85 0.85 ! 0.9699 641:20 Long 2.15, 3.78 A assign (resid 20 and name HG2*) (resid 20 and name HB) 2.30 0.50 0.50 ! 0.0000 642:20 Intra 2.44, 2.66 A assign (resid 5 and name HG2*) (resid 5 and name HB) 2.30 0.50 0.50 ! 0.9941 643:20 Intra 2.42, 2.65 A assign (resid 41 and name HG2*) (resid 117 and name HB) 3.65 1.85 1.85 ! 0.5939 644:20 Ambig 5.04, 6.32 A or (resid 118 and name HG2*) (resid 117 and name HB) ! 0.2521 644:20 ----- 5.81, 6.64 A or (resid 41 and name HG11) (resid 117 and name HB) ! 0.0842 644:20 ----- 6.98, 7.99 A assign (resid 104 and name HG2*) (resid 20 and name HB) 3.65 1.85 1.85 ! 0.5981 645:20 Ambig 5.17, 6.53 A or (resid 104 and name HD1*) (resid 20 and name HB) ! 0.2987 645:20 ----- 5.80, 7.23 A or (resid 21 and name HG2*) (resid 20 and name HB) ! 0.1033 645:20 ----- 6.93, 7.63 A assign (resid 133 and name HD1*) (resid 32 and name HB) 4.15 2.35 2.35 ! 0.0000 646:20 Long 2.66, 3.62 A assign (resid 105 and name HD1*) (resid 17 and name HA) 3.65 1.85 1.85 ! 0.8668 647:20 Ambig 3.96, 5.01 A or (resid 104 and name HG2*) (resid 17 and name HA) ! 0.1332 647:20 ----- 5.41, 6.66 A assign (resid 118 and name HG2*) (resid 138 and name HB1) 2.30 0.50 0.50 ! 0.6103 649:20 Ambig 2.12, 3.36 A or (resid 118 and name HG1*) (resid 138 and name HB1) ! 0.2339 649:20 ----- 2.49, 4.05 A or (resid 10 and name HG2*) (resid 138 and name HB1) ! 0.1067 649:20 ----- 2.84, 4.61 A assign (resid 34 and name HG1*) (resid 34 and name HA) 2.65 0.85 0.85 ! 0.7738 650:20 Ambig 3.72, 3.93 A or (resid 125 and name HG1*) (resid 34 and name HA) ! 0.1534 650:20 ----- 4.87, 5.89 A assign (resid 99 and name HB*) (resid 55 and name HA) 2.30 0.50 0.50 ! 0.9875 653:20 Long 2.46, 3.41 A assign (resid 97 and name HD1*) (resid 97 and name HA) 2.65 0.85 0.85 ! 0.9175 654:20 Ambig 2.25, 3.69 A or (resid 97 and name HG12) (resid 97 and name HA) ! 0.0778 654:20 ----- 3.40, 3.69 A assign (resid 60 and name HG1*) (resid 60 and name HA) 2.30 0.50 0.50 ! 0.5741 655:20 Ambig 2.45, 3.09 A or (resid 60 and name HG2*) (resid 60 and name HA) ! 0.4169 655:20 ----- 2.58, 3.24 A assign (resid 47 and name HG1) (resid 47 and name HA) 2.65 0.85 0.85 ! 0.9938 656:20 Intra 2.45, 2.57 A assign (resid 144 and name HG1*) (resid 111 and name HA) 2.30 0.50 0.50 ! 0.9964 657:20 Long 2.13, 2.88 A assign (resid 23 and name HG2*) (resid 24 and name HD1) 3.15 1.35 1.35 ! 0.5523 658:20 Ambig 3.49, 5.20 A or (resid 23 and name HG1*) (resid 24 and name HD1) ! 0.3263 658:20 ----- 3.81, 4.71 A or (resid 21 and name HG2*) (resid 24 and name HD1) ! 0.0396 658:20 ----- 5.41, 6.46 A or (resid 97 and name HG12) (resid 24 and name HD1) ! 0.0297 658:20 ----- 5.68, 6.24 A assign (resid 54 and name HD2*) (resid 55 and name HD2) 2.65 0.85 0.85 ! 0.9901 659:20 Seq 3.13, 4.08 A assign (resid 54 and name HD2*) (resid 55 and name HD1) 3.15 1.35 1.35 ! 0.8817 660:20 Ambig 3.56, 4.65 A or (resid 70 and name HG2*) (resid 55 and name HD1) ! 0.1183 660:20 ----- 4.97, 6.00 A assign (resid 10 and name HG1*) (resid 140 and name HA1) 3.15 1.35 1.35 ! 0.9577 661:20 Long 3.77, 4.84 A assign (resid 97 and name HD1*) (resid 96 and name HA1) 3.15 1.35 1.35 ! 0.6869 662:20 Ambig 3.46, 4.63 A or (resid 97 and name HG12) (resid 96 and name HA1) ! 0.1614 662:20 ----- 4.41, 6.00 A or (resid 94 and name HG2*) (resid 96 and name HA1) ! 0.1517 662:20 ----- 4.45, 6.46 A assign (resid 21 and name HG2*) (resid 15 and name HA1) 2.65 0.85 0.85 ! 0.0000 663:20 Long 3.14, 4.08 A assign (resid 92 and name HG11) (resid 92 and name HA) 2.65 0.85 0.85 ! 0.9316 665:20 Intra 3.08, 3.17 A assign (resid 98 and name HD1*) (resid 98 and name HA) 2.30 0.50 0.50 ! 0.9593 666:20 Intra 2.17, 3.01 A assign (resid 53 and name HG1*) (resid 101 and name HA) 2.65 0.85 0.85 ! 0.4862 667:20 Ambig 2.02, 3.19 A or (resid 101 and name HD2*) (resid 101 and name HA) ! 0.2582 667:20 ----- 2.25, 3.09 A or (resid 101 and name HB*) (resid 101 and name HA) ! 0.1974 667:20 ----- 2.35, 2.70 A assign (resid 30 and name HG2*) (resid 30 and name HA) 2.30 0.50 0.50 ! 0.8966 669:20 Ambig 2.55, 3.17 A or (resid 30 and name HG1*) (resid 30 and name HA) ! 0.0974 669:20 ----- 3.70, 3.93 A assign (resid 50 and name HG2*) (resid 50 and name HA) 2.30 0.50 0.50 ! 0.9722 670:20 Intra 2.50, 3.08 A assign (resid 47 and name HB*) (resid 47 and name HA) 2.65 0.85 0.85 ! 0.0000 672:20 Intra 2.45, 2.76 A assign (resid 97 and name HG2*) (resid 97 and name HA) 2.65 0.85 0.85 ! 0.0000 675:20 Intra 2.52, 3.30 A assign (resid 55 and name HB1) (resid 55 and name HA) 2.65 0.85 0.85 ! 0.0000 676:20 Intra 2.29, 2.32 A assign (resid 82 and name HN) (resid 81 and name HA) 2.30 0.50 0.50 ! 0.0000 677:20 Seq 2.11, 2.14 A assign (resid 78 and name HN) (resid 77 and name HA) 2.65 0.85 0.85 ! 0.0000 678:20 Seq 2.03, 2.15 A assign (resid 41 and name HN) (resid 79 and name HA) 3.15 1.35 1.35 ! 0.0000 679:20 Long 3.33, 3.50 A assign (resid 42 and name HN) (resid 42 and name HA) 2.65 0.85 0.85 ! 0.9908 680:20 Intra 2.90, 2.92 A assign (resid 41 and name HN) (resid 40 and name HA) 2.30 0.50 0.50 ! 0.0000 681:20 Seq 2.08, 2.11 A assign (resid 38 and name HN) (resid 37 and name HA) 2.65 0.85 0.85 ! 0.9465 683:20 Seq 2.11, 2.15 A assign (resid 21 and name HN) (resid 20 and name HA) 2.30 0.50 0.50 ! 0.9896 684:20 Seq 2.14, 2.18 A assign (resid 37 and name HN) (resid 36 and name HA) 2.65 0.85 0.85 ! 0.0000 686:20 Seq 2.05, 2.12 A assign (resid 23 and name HN) (resid 22 and name HA) 2.65 0.85 0.85 ! 0.0000 687:20 Seq 2.08, 2.12 A assign (resid 72 and name HN) (resid 71 and name HA) 2.65 0.85 0.85 ! 0.0000 688:20 Seq 2.09, 2.14 A assign (resid 80 and name HN) (resid 79 and name HA) 2.30 0.50 0.50 ! 0.0000 689:20 Seq 2.11, 2.17 A assign (resid 143 and name HN) (resid 14 and name HA) 2.30 0.50 0.50 ! 0.0000 690:20 Long 2.17, 2.40 A assign (resid 103 and name HN) (resid 102 and name HA) 2.30 0.50 0.50 ! 0.9947 691:20 Seq 2.10, 2.14 A assign (resid 20 and name HN) (resid 20 and name HA) 3.15 1.35 1.35 ! 0.0000 693:20 Intra 2.88, 2.91 A assign (resid 28 and name HN) (resid 27 and name HA) 2.65 0.85 0.85 ! 0.0000 694:20 Seq 2.17, 2.25 A assign (resid 49 and name HN) (resid 48 and name HA) 2.65 0.85 0.85 ! 0.0000 695:20 Seq 2.13, 2.20 A assign (resid 83 and name HN) (resid 82 and name HA) 2.30 0.50 0.50 ! 0.9996 696:20 Seq 2.08, 2.13 A assign (resid 138 and name HN) (resid 137 and name HA) 2.30 0.50 0.50 ! 0.8421 697:20 Ambig 2.18, 2.21 A or (resid 137 and name HN) (resid 137 and name HA) ! 0.1523 697:20 ----- 2.89, 2.91 A assign (resid 69 and name HN) (resid 68 and name HA) 2.65 0.85 0.85 ! 0.0000 699:20 Seq 2.21, 2.24 A assign (resid 39 and name HN) (resid 38 and name HA) 2.30 0.50 0.50 ! 0.9992 700:20 Seq 2.18, 2.23 A assign (resid 137 and name HN) (resid 9 and name HA) 3.15 1.35 1.35 ! 0.8303 701:20 Ambig 3.25, 3.96 A or (resid 8 and name HN) (resid 9 and name HA) ! 0.1237 701:20 ----- 4.46, 4.83 A assign (resid 9 and name HN) (resid 8 and name HA) 2.65 0.85 0.85 ! 0.0000 702:20 Seq 2.06, 2.14 A assign (resid 145 and name HN) (resid 16 and name HA) 2.65 0.85 0.85 ! 0.6987 704:20 Ambig 2.48, 3.02 A or (resid 16 and name HN) (resid 16 and name HA) ! 0.2964 704:20 ----- 2.86, 2.91 A assign (resid 127 and name HN) (resid 126 and name HA) 3.15 1.35 1.35 ! 0.0000 705:20 Seq 2.01, 2.16 A assign (resid 141 and name HN) (resid 12 and name HA) 3.15 1.35 1.35 ! 0.9950 706:20 Long 2.43, 2.65 A assign (resid 43 and name HN) (resid 42 and name HA) 2.30 0.50 0.50 ! 0.0000 707:20 Seq 2.10, 2.17 A assign (resid 15 and name HN) (resid 14 and name HA) 2.30 0.50 0.50 ! 0.9979 708:20 Seq 2.21, 2.30 A assign (resid 14 and name HN) (resid 14 and name HA) 2.65 0.85 0.85 ! 0.0000 709:20 Intra 2.89, 2.92 A assign (resid 102 and name HN) (resid 102 and name HA) 2.65 0.85 0.85 ! 0.9457 710:20 Intra 2.92, 2.94 A assign (resid 13 and name HN) (resid 12 and name HA) 2.30 0.50 0.50 ! 0.9922 712:20 Seq 2.09, 2.13 A assign (resid 12 and name HN) (resid 12 and name HA) 3.15 1.35 1.35 ! 0.0000 713:20 Intra 2.90, 2.92 A assign (resid 10 and name HN) (resid 9 and name HA) 2.30 0.50 0.50 ! 0.0000 717:20 Seq 2.15, 2.23 A assign (resid 117 and name HN) (resid 116 and name HA) 3.15 1.35 1.35 ! 0.8594 718:20 Ambig 2.15, 2.22 A or (resid 116 and name HN) (resid 116 and name HA) ! 0.1406 718:20 ----- 2.91, 2.94 A assign (resid 7 and name HB*) (resid 7 and name HE*) 2.65 0.85 0.85 ! 0.9420 719:20 Intra 1.97, 3.54 A assign (resid 6 and name HB) (resid 134 and name HE2) 4.15 2.35 2.35 ! 0.5876 720:20 Ambig 5.68, 7.90 A or (resid 118 and name HB) (resid 119 and name HB1) ! 0.4124 720:20 ----- 6.03, 6.22 A assign (resid 76 and name HN) (resid 75 and name HB1) 3.65 1.85 1.85 ! 0.9341 721:20 Seq 3.46, 3.72 A assign (resid 85 and name HG1) (resid 85 and name HB2) 2.30 0.50 0.50 ! 0.9972 722:20 Intra 2.66, 2.68 A assign (resid 128 and name HB1) (resid 128 and name HG1) 2.65 0.85 0.85 ! 0.9827 724:20 Intra 2.53, 2.82 A assign (resid 131 and name HG2) (resid 131 and name HE*) 2.30 0.50 0.50 ! 0.5914 725:20 Ambig 2.30, 3.13 A or (resid 7 and name HG1) (resid 7 and name HE*) ! 0.4065 725:20 ----- 2.45, 3.28 A assign (resid 133 and name HG12) (resid 127 and name HB1) 3.65 1.85 1.85 ! 0.0000 726:20 Long 2.97, 3.39 A assign (resid 61 and name HD2) (resid 61 and name HE1) 2.30 0.50 0.50 ! 0.9873 727:20 Intra 2.36, 2.46 A assign (resid 22 and name HG1) (resid 22 and name HE2) 3.15 1.35 1.35 ! 0.8149 728:20 Ambig 3.13, 3.53 A or (resid 134 and name HG*) (resid 132 and name HB2) ! 0.0793 728:20 ----- 4.61, 5.91 A or (resid 124 and name HG11) (resid 132 and name HB2) ! 0.0527 728:20 ----- 4.94, 6.41 A assign (resid 134 and name HD*) (resid 134 and name HE2) 2.30 0.50 0.50 ! 0.7253 729:20 Ambig 2.32, 2.52 A or (resid 134 and name HB1) (resid 134 and name HE2) ! 0.2212 729:20 ----- 2.82, 4.67 A assign (resid 51 and name HB*) (resid 102 and name HB2) 3.65 1.85 1.85 ! 0.0000 730:20 Long 3.88, 5.02 A assign (resid 124 and name HB) (resid 38 and name HB2) 2.65 0.85 0.85 ! 0.9931 731:20 Long 1.81, 3.19 A assign (resid 124 and name HB) (resid 38 and name HB1) 2.30 0.50 0.50 ! 0.9840 732:20 Long 2.01, 2.29 A assign (resid 22 and name HB*) (resid 22 and name HE1) 2.65 0.85 0.85 ! 0.9724 733:20 Intra 2.71, 3.56 A assign (resid 7 and name HG2) (resid 29 and name HG*) 4.15 2.35 2.35 ! 0.0000 734:20 Long 4.04, 6.02 A assign (resid 7 and name HG1) (resid 29 and name HG*) 3.65 1.85 1.85 ! 0.0000 735:20 Long 2.57, 4.42 A assign (resid 128 and name HB1) (resid 128 and name HG2) 2.65 0.85 0.85 ! 0.0000 737:20 Intra 2.26, 2.35 A assign (resid 51 and name HD1) (resid 51 and name HE*) 2.30 0.50 0.50 ! 0.0000 738:20 Intra 2.38, 2.67 A assign (resid 141 and name HD1) (resid 141 and name HE*) 2.30 0.50 0.50 ! 0.0000 739:20 Intra 2.32, 2.59 A assign (resid 134 and name HG*) (resid 134 and name HE2) 2.65 0.85 0.85 ! 0.0000 740:20 Intra 2.32, 3.57 A assign (resid 32 and name HG2*) (resid 127 and name HB1) 3.65 1.85 1.85 ! 0.9478 741:20 Long 2.89, 4.29 A assign (resid 22 and name HD1) (resid 22 and name HE2) 2.30 0.50 0.50 ! 0.5307 742:20 Ambig 2.40, 2.68 A or (resid 22 and name HG2) (resid 22 and name HE2) ! 0.3708 742:20 ----- 2.55, 3.31 A or (resid 126 and name HB*) (resid 132 and name HB2) ! 0.0985 742:20 ----- 3.18, 4.50 A assign (resid 109 and name HB*) (resid 106 and name HB1) 3.15 1.35 1.35 ! 0.0000 743:20 Mid 1.93, 3.31 A assign (resid 62 and name HA) (resid 62 and name HB2) 2.65 0.85 0.85 ! 0.9960 744:20 Intra 2.52, 2.69 A assign (resid 45 and name HB*) (resid 76 and name HA1) 2.65 0.85 0.85 ! 0.0000 745:20 Long 2.40, 4.00 A assign (resid 141 and name HG2) (resid 113 and name HB1) 3.65 1.85 1.85 ! 0.7196 746:20 Ambig 2.62, 4.17 A or (resid 141 and name HD1) (resid 113 and name HB1) ! 0.2463 746:20 ----- 3.13, 4.87 A assign (resid 22 and name HD1) (resid 22 and name HE1) 2.30 0.50 0.50 ! 0.5101 747:20 Ambig 2.46, 2.81 A or (resid 22 and name HG2) (resid 22 and name HE1) ! 0.4899 747:20 ----- 2.48, 3.21 A assign (resid 136 and name HB*) (resid 120 and name HB2) 3.15 1.35 1.35 ! 0.4989 748:20 Ambig 3.28, 6.34 A or (resid 111 and name HB*) (resid 144 and name HB) ! 0.4347 748:20 ----- 3.36, 4.34 A assign (resid 144 and name HG2*) (resid 144 and name HB) 2.30 0.50 0.50 ! 0.9355 749:20 Intra 2.40, 2.63 A assign (resid 37 and name HG2*) (resid 82 and name HB2) 3.65 1.85 1.85 ! 0.0000 751:20 Long 3.17, 4.34 A assign (resid 47 and name HG1) (resid 47 and name HE*) 2.30 0.50 0.50 ! 0.9211 752:20 Intra 2.38, 2.82 A assign (resid 104 and name HD1*) (resid 51 and name HE*) 2.65 0.85 0.85 ! 0.9858 753:20 Long 2.76, 4.67 A assign (resid 105 and name HD1*) (resid 19 and name HB1) 2.65 0.85 0.85 ! 0.9818 755:20 Long 2.72, 4.30 A assign (resid 124 and name HD1*) (resid 38 and name HB2) 2.65 0.85 0.85 ! 0.5393 756:20 Ambig 3.09, 4.74 A or (resid 36 and name HD1*) (resid 38 and name HB2) ! 0.2439 756:20 ----- 3.53, 6.19 A or (resid 124 and name HG2*) (resid 38 and name HB2) ! 0.1909 756:20 ----- 3.67, 5.46 A assign (resid 124 and name HD1*) (resid 38 and name HB1) 2.65 0.85 0.85 ! 0.9081 757:20 Ambig 2.40, 3.97 A or (resid 36 and name HD1*) (resid 38 and name HB1) ! 0.0551 757:20 ----- 3.83, 6.88 A assign (resid 54 and name HD1*) (resid 100 and name HB*) 3.15 1.35 1.35 ! 0.8161 758:20 Ambig 2.67, 4.65 A or (resid 54 and name HD1*) (resid 22 and name HE1) ! 0.1342 758:20 ----- 3.60, 5.78 A assign (resid 133 and name HG2*) (resid 4 and name HG2) 3.65 1.85 1.85 ! 0.5562 759:20 Ambig 4.33, 6.51 A or (resid 6 and name HG1*) (resid 4 and name HG2) ! 0.3166 759:20 ----- 4.75, 6.88 A or (resid 6 and name HG1*) (resid 29 and name HG*) ! 0.1271 759:20 ----- 5.53, 7.73 A assign (resid 144 and name HG1*) (resid 144 and name HB) 2.30 0.50 0.50 ! 0.9857 760:20 Intra 2.42, 2.64 A assign (resid 47 and name HB*) (resid 47 and name HE*) 2.65 0.85 0.85 ! 0.0000 761:20 Intra 1.98, 3.61 A assign (resid 116 and name HD2*) (resid 43 and name HB*) 2.65 0.85 0.85 ! 0.9930 762:20 Long 1.97, 3.11 A assign (resid 77 and name HA) (resid 77 and name HB1) 2.65 0.85 0.85 ! 0.0000 763:20 Intra 2.46, 2.56 A assign (resid 134 and name HA) (resid 134 and name HB2) 2.30 0.50 0.50 ! 0.6144 764:20 Ambig 2.20, 2.38 A or (resid 22 and name HA) (resid 22 and name HB*) ! 0.3846 764:20 ----- 2.38, 2.74 A assign (resid 77 and name HA) (resid 77 and name HG2) 3.15 1.35 1.35 ! 0.0000 765:20 Intra 2.27, 2.44 A assign (resid 77 and name HA) (resid 77 and name HG1) 3.15 1.35 1.35 ! 0.0000 766:20 Intra 2.51, 2.97 A assign (resid 126 and name HA) (resid 34 and name HG2*) 3.65 1.85 1.85 ! 0.5527 767:20 Ambig 4.14, 5.19 A or (resid 36 and name HA) (resid 34 and name HG2*) ! 0.4473 767:20 ----- 4.28, 5.45 A assign (resid 126 and name HA) (resid 126 and name HB*) 2.30 0.50 0.50 ! 0.9847 768:20 Intra 2.37, 2.63 A assign (resid 71 and name HA) (resid 72 and name HG2*) 3.65 1.85 1.85 ! 0.9247 769:20 Seq 4.05, 5.63 A assign (resid 81 and name HA) (resid 81 and name HG2*) 2.30 0.50 0.50 ! 0.6198 770:20 Ambig 2.49, 3.11 A or (resid 38 and name HA) (resid 81 and name HG2*) ! 0.3636 770:20 ----- 2.73, 4.01 A assign (resid 8 and name HA) (resid 8 and name HD1*) 2.65 0.85 0.85 ! 0.0000 772:20 Intra 2.11, 3.16 A assign (resid 36 and name HA) (resid 36 and name HD1*) 3.15 1.35 1.35 ! 0.0000 773:20 Intra 3.38, 4.57 A assign (resid 36 and name HA) (resid 36 and name HD2*) 2.30 0.50 0.50 ! 0.6122 774:20 Ambig 1.96, 3.31 A or (resid 8 and name HA) (resid 8 and name HD2*) ! 0.3742 774:20 ----- 2.13, 3.63 A assign (resid 116 and name HA) (resid 116 and name HD2*) 2.65 0.85 0.85 ! 0.0000 775:20 Intra 2.30, 3.12 A assign (resid 9 and name HA) (resid 10 and name HG2*) 2.65 0.85 0.85 ! 0.9265 777:20 Seq 3.50, 4.62 A assign (resid 134 and name HA) (resid 5 and name HG2*) 3.15 1.35 1.35 ! 0.7760 778:20 Ambig 3.03, 4.95 A or (resid 134 and name HA) (resid 6 and name HG2*) ! 0.1994 778:20 ----- 3.80, 4.87 A assign (resid 22 and name HA) (resid 21 and name HG2*) 3.15 1.35 1.35 ! 0.8193 779:20 Ambig 3.92, 5.04 A or (resid 116 and name HA) (resid 118 and name HG2*) ! 0.1351 779:20 ----- 5.29, 6.47 A assign (resid 103 and name HA) (resid 50 and name HG1*) 3.65 1.85 1.85 ! 0.0000 780:20 Long 5.78, 6.27 A assign (resid 103 and name HA) (resid 50 and name HG2*) 3.15 1.35 1.35 ! 0.0000 781:20 Long 3.62, 4.87 A assign (resid 20 and name HA) (resid 21 and name HG1*) 3.65 1.85 1.85 ! 0.0000 782:20 Seq 3.77, 4.88 A assign (resid 38 and name HA) (resid 37 and name HG2*) 2.65 0.85 0.85 ! 0.5527 783:20 Ambig 3.35, 4.64 A or (resid 81 and name HA) (resid 37 and name HG2*) ! 0.2328 783:20 ----- 3.87, 5.23 A or (resid 126 and name HA) (resid 124 and name HG2*) ! 0.1418 783:20 ----- 4.20, 5.24 A assign (resid 81 and name HA) (resid 80 and name HG2*) 3.15 1.35 1.35 ! 0.8592 784:20 Ambig 3.31, 4.47 A or (resid 38 and name HA) (resid 80 and name HG2*) ! 0.1408 784:20 ----- 4.47, 5.67 A assign (resid 126 and name HA) (resid 133 and name HD1*) 3.65 1.85 1.85 ! 0.0000 785:20 Long 3.77, 5.35 A assign (resid 134 and name HA) (resid 134 and name HB1) 2.65 0.85 0.85 ! 0.9982 786:20 Intra 2.33, 2.49 A assign (resid 134 and name HA) (resid 134 and name HG*) 3.15 1.35 1.35 ! 0.9910 788:20 Intra 2.66, 3.78 A assign (resid 56 and name HA) (resid 57 and name HG2*) 3.15 1.35 1.35 ! 0.0000 791:20 Seq 3.55, 4.95 A assign (resid 141 and name HA) (resid 115 and name HB*) 3.15 1.35 1.35 ! 0.9478 793:20 Long 3.41, 4.42 A assign (resid 45 and name HA) (resid 45 and name HB*) 2.30 0.50 0.50 ! 0.9980 797:20 Intra 2.37, 2.62 A assign (resid 54 and name HA) (resid 54 and name HD1*) 3.15 1.35 1.35 ! 0.0000 798:20 Intra 4.34, 4.68 A assign (resid 134 and name HA) (resid 8 and name HD2*) 4.15 2.35 2.35 ! 0.9694 799:20 Long 3.19, 5.51 A assign (resid 43 and name HA) (resid 116 and name HD2*) 2.65 0.85 0.85 ! 0.9742 800:20 Long 2.41, 3.90 A assign (resid 39 and name HA) (resid 123 and name HD2*) 3.15 1.35 1.35 ! 0.9762 801:20 Long 2.70, 4.56 A assign (resid 37 and name HA) (resid 125 and name HG2*) 2.65 0.85 0.85 ! 0.8636 802:20 Ambig 2.34, 3.86 A or (resid 37 and name HA) (resid 125 and name HG1*) ! 0.0815 802:20 ----- 3.47, 4.75 A assign (resid 54 and name HA) (resid 54 and name HD2*) 2.30 0.50 0.50 ! 0.0000 804:20 Intra 2.06, 2.93 A assign (resid 72 and name HA) (resid 50 and name HG1*) 3.65 1.85 1.85 ! 0.9155 805:20 Ambig 3.81, 5.22 A or (resid 45 and name HA) (resid 50 and name HG1*) ! 0.0845 805:20 ----- 5.66, 6.96 A assign (resid 70 and name HA) (resid 70 and name HG1*) 2.30 0.50 0.50 ! 0.9217 807:20 Intra 2.56, 3.18 A assign (resid 144 and name HA) (resid 144 and name HG1*) 2.65 0.85 0.85 ! 0.4493 808:20 Ambig 2.50, 3.10 A or (resid 25 and name HA) (resid 25 and name HG2*) ! 0.3770 808:20 ----- 2.57, 3.18 A or (resid 100 and name HA) (resid 25 and name HG2*) ! 0.0429 808:20 ----- 3.70, 5.04 A or (resid 24 and name HA) (resid 25 and name HG2*) ! 0.0377 808:20 ----- 3.78, 4.83 A or (resid 25 and name HA) (resid 23 and name HG1*) ! 0.0230 808:20 ----- 4.11, 5.42 A assign (resid 25 and name HA) (resid 25 and name HG1*) 2.30 0.50 0.50 ! 0.9196 809:20 Ambig 2.53, 3.14 A or (resid 26 and name HA) (resid 25 and name HG1*) ! 0.0488 809:20 ----- 4.14, 5.18 A assign (resid 41 and name HA) (resid 41 and name HG2*) 2.30 0.50 0.50 ! 0.9577 810:20 Intra 2.47, 3.11 A assign (resid 70 and name HA) (resid 80 and name HG2*) 2.65 0.85 0.85 ! 0.5494 811:20 Ambig 3.29, 4.68 A or (resid 144 and name HA) (resid 142 and name HG2*) ! 0.4506 811:20 ----- 3.40, 4.55 A assign (resid 37 and name HA) (resid 37 and name HG2*) 2.30 0.50 0.50 ! 0.9598 813:20 Intra 2.47, 3.12 A assign (resid 41 and name HA) (resid 41 and name HD1*) 3.15 1.35 1.35 ! 0.8829 814:20 Ambig 3.39, 4.44 A or (resid 39 and name HA) (resid 41 and name HD1*) ! 0.1171 814:20 ----- 4.75, 6.67 A assign (resid 127 and name HA) (resid 133 and name HD1*) 3.15 1.35 1.35 ! 0.0000 816:20 Long 3.09, 4.82 A assign (resid 144 and name HA) (resid 105 and name HD1*) 3.15 1.35 1.35 ! 0.0000 817:20 Long 3.07, 4.12 A assign (resid 26 and name HA) (resid 97 and name HD1*) 3.65 1.85 1.85 ! 0.8545 819:20 Ambig 2.89, 4.74 A or (resid 24 and name HA) (resid 97 and name HD1*) ! 0.1105 819:20 ----- 4.06, 6.38 A assign (resid 24 and name HA) (resid 97 and name HG2*) 3.15 1.35 1.35 ! 0.6262 820:20 Ambig 2.94, 3.64 A or (resid 26 and name HA) (resid 97 and name HG2*) ! 0.1644 820:20 ----- 3.68, 4.92 A or (resid 100 and name HA) (resid 97 and name HG2*) ! 0.1549 820:20 ----- 3.71, 4.32 A assign (resid 61 and name HA) (resid 61 and name HD1) 2.30 0.50 0.50 ! 0.4955 821:20 Ambig 1.93, 3.79 A or (resid 131 and name HA) (resid 131 and name HD*) ! 0.4912 821:20 ----- 1.93, 2.83 A assign (resid 61 and name HA) (resid 61 and name HD2) 3.65 1.85 1.85 ! 0.9755 822:20 Intra 2.03, 3.74 A assign (resid 61 and name HA) (resid 61 and name HG2) 2.65 0.85 0.85 ! 0.7571 823:20 Ambig 2.41, 3.07 A or (resid 131 and name HA) (resid 131 and name HG2) ! 0.1800 823:20 ----- 3.06, 3.15 A assign (resid 61 and name HA) (resid 61 and name HG1) 3.15 1.35 1.35 ! 0.9342 824:20 Intra 2.39, 2.85 A assign (resid 99 and name HA) (resid 99 and name HB*) 2.65 0.85 0.85 ! 0.0000 829:20 Intra 2.42, 2.64 A assign (resid 132 and name HA) (resid 126 and name HB*) 2.65 0.85 0.85 ! 0.7766 830:20 Ambig 2.89, 4.02 A or (resid 143 and name HA) (resid 141 and name HG2) ! 0.1947 830:20 ----- 3.64, 4.22 A assign (resid 57 and name HA) (resid 57 and name HG2*) 2.30 0.50 0.50 ! 0.5313 831:20 Ambig 2.31, 3.01 A or (resid 57 and name HB) (resid 57 and name HG2*) ! 0.3984 831:20 ----- 2.43, 2.65 A assign (resid 136 and name HA) (resid 136 and name HB*) 2.30 0.50 0.50 ! 0.0000 832:20 Intra 2.31, 2.61 A assign (resid 114 and name HA) (resid 115 and name HB*) 3.15 1.35 1.35 ! 0.0000 833:20 Seq 4.31, 4.93 A assign (resid 112 and name HA2) (resid 111 and name HB*) 3.15 1.35 1.35 ! 0.9540 834:20 Seq 4.09, 4.88 A assign (resid 74 and name HA) (resid 74 and name HG2*) 2.30 0.50 0.50 ! 0.9831 835:20 Intra 2.40, 3.04 A assign (resid 148 and name HA) (resid 148 and name HB*) 2.30 0.50 0.50 ! 0.9713 836:20 Intra 2.42, 2.65 A assign (resid 105 and name HA) (resid 105 and name HG2*) 2.65 0.85 0.85 ! 0.0000 837:20 Intra 2.49, 3.09 A assign (resid 53 and name HA) (resid 101 and name HD1*) 4.15 2.35 2.35 ! 0.5132 840:20 Ambig 6.82, 7.38 A or (resid 118 and name HA) (resid 101 and name HD1*) ! 0.4868 840:20 ----- 6.88, 7.70 A assign (resid 67 and name HA) (resid 60 and name HG1*) 3.15 1.35 1.35 ! 0.6270 843:20 Ambig 4.37, 5.50 A or (resid 99 and name HA) (resid 60 and name HG2*) ! 0.2908 843:20 ----- 4.96, 6.11 A or (resid 67 and name HA) (resid 60 and name HG2*) ! 0.0822 843:20 ----- 6.13, 7.67 A assign (resid 58 and name HB1) (resid 94 and name HG2*) 3.65 1.85 1.85 ! 0.7971 845:20 Ambig 3.54, 5.18 A or (resid 16 and name HB2) (resid 144 and name HG1*) ! 0.2029 845:20 ----- 4.44, 5.92 A assign (resid 23 and name HA) (resid 13 and name HG1*) 2.30 0.50 0.50 ! 0.9902 846:20 Long 2.10, 3.45 A assign (resid 23 and name HA) (resid 23 and name HG1*) 2.30 0.50 0.50 ! 0.4395 848:20 Ambig 2.50, 3.18 A or (resid 23 and name HA) (resid 23 and name HG2*) ! 0.3603 848:20 ----- 2.59, 3.23 A or (resid 140 and name HA2) (resid 23 and name HG1*) ! 0.0732 848:20 ----- 3.37, 4.75 A or (resid 140 and name HA2) (resid 23 and name HG2*) ! 0.0558 848:20 ----- 3.53, 6.40 A assign (resid 61 and name HA) (resid 60 and name HG1*) 3.15 1.35 1.35 ! 0.9583 849:20 Seq 3.78, 5.13 A assign (resid 67 and name HA) (resid 83 and name HG2*) 3.65 1.85 1.85 ! 0.0000 850:20 Long 3.73, 5.15 A assign (resid 52 and name HA) (resid 50 and name HG2*) 2.65 0.85 0.85 ! 0.8944 852:20 Ambig 2.85, 4.00 A or (resid 101 and name HA) (resid 50 and name HG2*) ! 0.1056 852:20 ----- 4.07, 5.22 A assign (resid 93 and name HA) (resid 92 and name HG2*) 3.65 1.85 1.85 ! 0.0000 853:20 Seq 3.90, 5.08 A assign (resid 142 and name HA) (resid 142 and name HG2*) 2.65 0.85 0.85 ! 0.9972 854:20 Intra 2.48, 3.11 A assign (resid 94 and name HA) (resid 94 and name HG1*) 2.30 0.50 0.50 ! 0.4985 855:20 Ambig 2.41, 3.05 A or (resid 78 and name HA) (resid 78 and name HG2*) ! 0.4981 855:20 ----- 2.41, 3.01 A assign (resid 78 and name HA) (resid 78 and name HD1*) 3.15 1.35 1.35 ! 0.0000 856:20 Intra 4.48, 4.77 A assign (resid 105 and name HA) (resid 105 and name HD1*) 3.15 1.35 1.35 ! 0.9345 857:20 Intra 4.34, 4.65 A assign (resid 59 and name HA) (resid 59 and name HB1) 2.65 0.85 0.85 ! 0.0000 858:20 Intra 2.38, 2.44 A assign (resid 59 and name HA) (resid 59 and name HB2) 2.65 0.85 0.85 ! 0.0000 859:20 Intra 3.00, 3.02 A assign (resid 73 and name HB*) (resid 77 and name HB1) 3.65 1.85 1.85 ! 0.9927 860:20 Mid 2.13, 3.24 A assign (resid 51 and name HA) (resid 51 and name HB*) 2.65 0.85 0.85 ! 0.0000 861:20 Intra 2.44, 2.76 A assign (resid 59 and name HA) (resid 59 and name HG) 2.65 0.85 0.85 ! 0.9031 862:20 Ambig 3.23, 3.35 A or (resid 120 and name HA) (resid 134 and name HD*) ! 0.0969 862:20 ----- 4.68, 6.15 A assign (resid 7 and name HA) (resid 7 and name HD*) 3.15 1.35 1.35 ! 0.0000 863:20 Intra 3.88, 4.55 A assign (resid 124 and name HA) (resid 124 and name HG12) 2.65 0.85 0.85 ! 0.7919 864:20 Ambig 2.58, 2.72 A or (resid 85 and name HA) (resid 87 and name HG) ! 0.1546 864:20 ----- 3.38, 3.78 A assign (resid 69 and name HA) (resid 69 and name HG11) 2.65 0.85 0.85 ! 0.7210 865:20 Ambig 2.51, 2.58 A or (resid 122 and name HA) (resid 124 and name HG11) ! 0.1648 865:20 ----- 3.21, 3.67 A or (resid 66 and name HA) (resid 69 and name HG11) ! 0.1120 865:20 ----- 3.42, 4.25 A assign (resid 120 and name HA) (resid 123 and name HG) 3.15 1.35 1.35 ! 0.7442 866:20 Ambig 2.99, 4.24 A or (resid 69 and name HA) (resid 69 and name HG12) ! 0.2015 866:20 ----- 3.72, 3.75 A assign (resid 2 and name HA) (resid 2 and name HG2) 2.65 0.85 0.85 ! 0.0000 867:20 Intra 2.48, 2.72 A assign (resid 51 and name HA) (resid 51 and name HG*) 3.15 1.35 1.35 ! 0.9988 868:20 Intra 2.40, 2.93 A assign (resid 86 and name HB) (resid 86 and name HG2*) 2.30 0.50 0.50 ! 0.9733 869:20 Intra 2.40, 2.65 A assign (resid 32 and name HA) (resid 32 and name HG2*) 2.30 0.50 0.50 ! 0.9978 870:20 Intra 2.43, 3.06 A assign (resid 117 and name HA) (resid 117 and name HG2*) 2.30 0.50 0.50 ! 0.7877 871:20 Ambig 2.38, 3.04 A or (resid 145 and name HA) (resid 143 and name HG2*) ! 0.1397 871:20 ----- 3.17, 4.64 A assign (resid 150 and name HA) (resid 150 and name HG2*) 2.30 0.50 0.50 ! 0.5488 872:20 Ambig 2.34, 3.08 A or (resid 150 and name HB) (resid 150 and name HG2*) ! 0.4199 872:20 ----- 2.45, 2.65 A assign (resid 145 and name HA) (resid 145 and name HG2*) 2.30 0.50 0.50 ! 0.5494 873:20 Ambig 2.35, 3.00 A or (resid 145 and name HB) (resid 145 and name HG2*) ! 0.4481 873:20 ----- 2.43, 2.65 A assign (resid 110 and name HA) (resid 110 and name HG2*) 2.30 0.50 0.50 ! 0.5594 874:20 Ambig 2.30, 2.93 A or (resid 110 and name HB) (resid 110 and name HG2*) ! 0.4208 874:20 ----- 2.41, 2.65 A assign (resid 33 and name HD1) (resid 32 and name HG2*) 3.15 1.35 1.35 ! 0.0000 875:20 Seq 3.39, 4.28 A assign (resid 115 and name HA) (resid 115 and name HB*) 2.30 0.50 0.50 ! 0.9749 876:20 Intra 2.36, 2.62 A assign (resid 145 and name HA) (resid 111 and name HB*) 2.65 0.85 0.85 ! 0.9208 877:20 Long 2.52, 4.90 A assign (resid 121 and name HA) (resid 121 and name HB*) 2.30 0.50 0.50 ! 0.9942 878:20 Intra 2.42, 2.64 A assign (resid 109 and name HA) (resid 109 and name HB*) 2.30 0.50 0.50 ! 0.0000 880:20 Intra 2.36, 2.63 A assign (resid 74 and name HB) (resid 74 and name HG2*) 2.30 0.50 0.50 ! 0.0000 881:20 Intra 2.44, 2.66 A assign (resid 75 and name HA) (resid 45 and name HB*) 2.65 0.85 0.85 ! 0.4859 882:20 Ambig 3.22, 4.14 A or (resid 150 and name HB) (resid 148 and name HB*) ! 0.2779 882:20 ----- 3.54, 6.21 A or (resid 150 and name HA) (resid 148 and name HB*) ! 0.0935 882:20 ----- 4.24, 5.87 A or (resid 46 and name HA) (resid 45 and name HB*) ! 0.0873 882:20 ----- 4.29, 4.91 A assign (resid 133 and name HA) (resid 133 and name HG2*) 2.30 0.50 0.50 ! 0.9917 883:20 Intra 2.26, 2.98 A assign (resid 88 and name HA) (resid 87 and name HD1*) 3.15 1.35 1.35 ! 0.8041 884:20 Ambig 3.04, 4.01 A or (resid 87 and name HA) (resid 87 and name HD1*) ! 0.1622 884:20 ----- 3.97, 4.57 A assign (resid 83 and name HA) (resid 36 and name HD2*) 3.65 1.85 1.85 ! 0.9119 885:20 Ambig 2.24, 4.92 A or (resid 124 and name HA) (resid 123 and name HD2*) ! 0.0656 885:20 ----- 3.47, 4.80 A assign (resid 59 and name HA) (resid 59 and name HD2*) 2.65 0.85 0.85 ! 0.0000 886:20 Intra 2.10, 2.89 A assign (resid 115 and name HA) (resid 116 and name HD2*) 3.15 1.35 1.35 ! 0.5691 887:20 Ambig 3.93, 5.15 A or (resid 59 and name HA) (resid 59 and name HD1*) ! 0.4309 887:20 ----- 4.12, 4.62 A assign (resid 92 and name HA) (resid 59 and name HD2*) 2.65 0.85 0.85 ! 0.9467 888:20 Long 2.67, 4.54 A assign (resid 98 and name HA) (resid 98 and name HD1*) 2.65 0.85 0.85 ! 0.9986 889:20 Intra 2.17, 3.01 A assign (resid 98 and name HA) (resid 59 and name HD1*) 2.65 0.85 0.85 ! 0.9675 890:20 Long 1.87, 2.95 A assign (resid 95 and name HA) (resid 30 and name HG1*) 2.65 0.85 0.85 ! 0.9526 892:20 Long 2.40, 3.12 A assign (resid 52 and name HA) (resid 50 and name HG1*) 3.65 1.85 1.85 ! 0.0000 893:20 Mid 4.36, 5.56 A assign (resid 80 and name HA) (resid 70 and name HG2*) 2.30 0.50 0.50 ! 0.8582 894:20 Ambig 2.49, 3.94 A or (resid 10 and name HA) (resid 10 and name HG2*) ! 0.0889 894:20 ----- 3.64, 3.90 A assign (resid 80 and name HA) (resid 70 and name HG1*) 2.65 0.85 0.85 ! 0.9880 895:20 Long 3.08, 4.40 A assign (resid 33 and name HA) (resid 30 and name HG2*) 3.65 1.85 1.85 ! 0.9101 897:20 Ambig 3.66, 4.45 A or (resid 92 and name HA) (resid 30 and name HG2*) ! 0.0899 897:20 ----- 5.38, 6.39 A assign (resid 87 and name HA) (resid 87 and name HD2*) 3.15 1.35 1.35 ! 0.0000 898:20 Intra 4.62, 5.02 A assign (resid 5 and name HA) (resid 5 and name HG2*) 2.30 0.50 0.50 ! 0.3908 899:20 Ambig 2.39, 3.16 A or (resid 1 and name HA) (resid 1 and name HG1*) ! 0.3158 899:20 ----- 2.48, 3.58 A or (resid 24 and name HD2) (resid 13 and name HG1*) ! 0.2249 899:20 ----- 2.62, 3.38 A assign (resid 83 and name HA) (resid 83 and name HG2*) 2.65 0.85 0.85 ! 0.9944 901:20 Intra 2.40, 3.61 A assign (resid 51 and name HA) (resid 50 and name HG2*) 3.15 1.35 1.35 ! 0.0000 902:20 Seq 4.10, 5.21 A assign (resid 98 and name HA) (resid 60 and name HG2*) 3.15 1.35 1.35 ! 0.9395 903:20 Long 3.67, 4.98 A assign (resid 69 and name HA) (resid 69 and name HG2*) 2.30 0.50 0.50 ! 0.9612 904:20 Intra 2.48, 3.15 A assign (resid 92 and name HA) (resid 92 and name HG2*) 2.65 0.85 0.85 ! 0.9895 905:20 Intra 2.43, 3.07 A assign (resid 92 and name HA) (resid 94 and name HG1*) 4.15 2.35 2.35 ! 0.0000 906:20 Mid 4.77, 6.09 A assign (resid 80 and name HA) (resid 80 and name HG2*) 2.65 0.85 0.85 ! 0.9912 907:20 Intra 2.50, 3.13 A assign (resid 95 and name HA) (resid 27 and name HG2*) 3.15 1.35 1.35 ! 0.0000 908:20 Long 2.10, 3.47 A assign (resid 80 and name HA) (resid 80 and name HD1*) 3.15 1.35 1.35 ! 0.0000 909:20 Intra 4.38, 4.66 A assign (resid 51 and name HA) (resid 104 and name HD1*) 3.65 1.85 1.85 ! 0.0000 910:20 Long 4.18, 5.64 A assign (resid 15 and name HA2) (resid 105 and name HD1*) 2.65 0.85 0.85 ! 0.0000 911:20 Long 3.38, 4.15 A assign (resid 133 and name HA) (resid 133 and name HD1*) 3.15 1.35 1.35 ! 0.7544 912:20 Ambig 3.97, 5.09 A or (resid 6 and name HA) (resid 133 and name HD1*) ! 0.1606 912:20 ----- 5.13, 6.46 A or (resid 33 and name HA) (resid 133 and name HD1*) ! 0.0586 912:20 ----- 6.07, 7.64 A assign (resid 98 and name HA) (resid 27 and name HG2*) 3.15 1.35 1.35 ! 0.8780 913:20 Ambig 3.32, 4.19 A or (resid 96 and name HA2) (resid 27 and name HG2*) ! 0.1220 913:20 ----- 4.61, 5.32 A assign (resid 69 and name HA) (resid 69 and name HD1*) 2.65 0.85 0.85 ! 0.6154 914:20 Ambig 3.27, 4.16 A or (resid 66 and name HA) (resid 69 and name HD1*) ! 0.3683 914:20 ----- 3.56, 4.83 A assign (resid 98 and name HA) (resid 97 and name HG2*) 3.15 1.35 1.35 ! 0.8823 915:20 Ambig 3.97, 4.93 A or (resid 24 and name HD2) (resid 97 and name HG2*) ! 0.0744 915:20 ----- 6.00, 7.07 A assign (resid 81 and name HB) (resid 69 and name HB) 2.65 0.85 0.85 ! 0.0000 916:20 Long 1.89, 2.00 A assign (resid 138 and name HB1) (resid 10 and name HG1*) 2.65 0.85 0.85 ! 0.7363 917:20 Ambig 2.38, 3.62 A or (resid 30 and name HA) (resid 6 and name HG1*) ! 0.2534 917:20 ----- 2.85, 4.35 A assign (resid 88 and name HA) (resid 88 and name HB*) 2.30 0.50 0.50 ! 0.0000 918:20 Intra 2.42, 2.64 A assign (resid 55 and name HA) (resid 99 and name HB*) 2.30 0.50 0.50 ! 0.9875 919:20 Long 2.46, 3.41 A assign (resid 9 and name HB2) (resid 26 and name HG2*) 3.15 1.35 1.35 ! 0.5023 920:20 Ambig 3.49, 5.31 A or (resid 24 and name HD1) (resid 13 and name HG2*) ! 0.2429 920:20 ----- 3.94, 5.30 A or (resid 79 and name HB1) (resid 122 and name HG2*) ! 0.0967 920:20 ----- 4.59, 6.65 A or (resid 28 and name HB1) (resid 26 and name HG2*) ! 0.0880 920:20 ----- 4.66, 5.79 A assign (resid 32 and name HB) (resid 32 and name HG2*) 2.30 0.50 0.50 ! 0.9966 921:20 Intra 2.42, 2.65 A assign (resid 143 and name HB) (resid 143 and name HG2*) 2.30 0.50 0.50 ! 0.9850 922:20 Intra 2.45, 2.65 A assign (resid 34 and name HA) (resid 34 and name HG2*) 2.65 0.85 0.85 ! 0.0000 923:20 Intra 2.51, 3.12 A assign (resid 138 and name HB2) (resid 136 and name HB*) 3.15 1.35 1.35 ! 0.7894 924:20 Ambig 3.76, 5.41 A or (resid 112 and name HA1) (resid 110 and name HG2*) ! 0.1667 924:20 ----- 4.88, 6.98 A assign (resid 14 and name HB*) (resid 145 and name HG2*) 2.65 0.85 0.85 ! 0.9861 925:20 Long 2.21, 4.07 A assign (resid 120 and name HD2) (resid 121 and name HB*) 3.15 1.35 1.35 ! 0.0000 927:20 Seq 3.82, 4.79 A assign (resid 49 and name HB) (resid 49 and name HG2*) 2.30 0.50 0.50 ! 0.0000 929:20 Intra 2.43, 2.65 A assign (resid 146 and name HA1) (resid 111 and name HB*) 2.30 0.50 0.50 ! 0.5237 931:20 Ambig 2.22, 3.79 A or (resid 111 and name HA) (resid 111 and name HB*) ! 0.3443 931:20 ----- 2.38, 2.63 A or (resid 17 and name HA) (resid 109 and name HB*) ! 0.1271 931:20 ----- 2.81, 4.26 A assign (resid 76 and name HA2) (resid 45 and name HB*) 2.65 0.85 0.85 ! 0.9893 932:20 Long 1.99, 3.57 A assign (resid 17 and name HA) (resid 105 and name HG2*) 2.30 0.50 0.50 ! 0.9709 933:20 Long 2.09, 2.96 A assign (resid 149 and name HD1) (resid 148 and name HB*) 3.15 1.35 1.35 ! 0.9730 934:20 Seq 3.06, 4.63 A assign (resid 96 and name HA1) (resid 59 and name HD2*) 4.15 2.35 2.35 ! 0.9832 936:20 Long 3.11, 5.13 A assign (resid 96 and name HA1) (resid 59 and name HD1*) 3.15 1.35 1.35 ! 0.9352 937:20 Long 2.71, 4.90 A assign (resid 83 and name HB) (resid 36 and name HD2*) 2.65 0.85 0.85 ! 0.0000 938:20 Long 2.38, 3.93 A assign (resid 26 and name HB) (resid 26 and name HG2*) 2.30 0.50 0.50 ! 0.9649 939:20 Intra 2.46, 2.66 A assign (resid 111 and name HA) (resid 144 and name HG1*) 2.30 0.50 0.50 ! 0.9467 940:20 Long 2.13, 2.88 A assign (resid 5 and name HB) (resid 5 and name HG2*) 2.30 0.50 0.50 ! 0.0000 941:20 Intra 2.42, 2.65 A assign (resid 55 and name HD2) (resid 54 and name HD2*) 2.65 0.85 0.85 ! 0.0000 942:20 Seq 3.13, 4.08 A assign (resid 30 and name HA) (resid 30 and name HG1*) 2.65 0.85 0.85 ! 0.8825 943:20 Ambig 3.70, 3.93 A or (resid 28 and name HB1) (resid 30 and name HG1*) ! 0.1175 943:20 ----- 5.17, 6.78 A assign (resid 83 and name HB) (resid 83 and name HG2*) 2.30 0.50 0.50 ! 0.0000 944:20 Intra 2.37, 2.64 A assign (resid 49 and name HB) (resid 104 and name HG2*) 3.15 1.35 1.35 ! 0.5721 945:20 Ambig 3.84, 4.49 A or (resid 79 and name HB2) (resid 78 and name HG2*) ! 0.1248 945:20 ----- 4.95, 6.03 A or (resid 117 and name HB) (resid 41 and name HG2*) ! 0.1117 945:20 ----- 5.04, 6.32 A or (resid 20 and name HB) (resid 104 and name HG2*) ! 0.0958 945:20 ----- 5.17, 6.53 A or (resid 17 and name HA) (resid 104 and name HG2*) ! 0.0729 945:20 ----- 5.41, 6.66 A assign (resid 93 and name HB2) (resid 94 and name HG1*) 3.15 1.35 1.35 ! 0.0000 946:20 Seq 3.77, 5.16 A assign (resid 81 and name HB) (resid 69 and name HG2*) 2.65 0.85 0.85 ! 0.9468 947:20 Long 2.71, 3.59 A assign (resid 15 and name HA1) (resid 21 and name HG1*) 3.65 1.85 1.85 ! 0.8356 948:20 Ambig 3.58, 4.82 A or (resid 93 and name HB1) (resid 94 and name HG1*) ! 0.1453 948:20 ----- 4.79, 6.15 A assign (resid 49 and name HB) (resid 104 and name HD1*) 3.15 1.35 1.35 ! 0.9974 949:20 Long 2.15, 3.78 A assign (resid 17 and name HA) (resid 105 and name HD1*) 3.15 1.35 1.35 ! 0.9082 950:20 Ambig 3.96, 5.01 A or (resid 111 and name HA) (resid 105 and name HD1*) ! 0.0918 950:20 ----- 5.80, 7.39 A assign (resid 97 and name HA) (resid 27 and name HG2*) 3.65 1.85 1.85 ! 0.8370 951:20 Ambig 3.34, 4.66 A or (resid 96 and name HA1) (resid 27 and name HG2*) ! 0.1630 951:20 ----- 4.38, 4.98 A assign (resid 97 and name HA) (resid 97 and name HD1*) 2.65 0.85 0.85 ! 0.9298 952:20 Intra 2.25, 3.69 A assign (resid 97 and name HA) (resid 97 and name HG2*) 2.65 0.85 0.85 ! 0.9957 954:20 Intra 2.52, 3.30 A assign (resid 55 and name HD1) (resid 57 and name HG2*) 4.15 2.35 2.35 ! 0.5301 956:20 Ambig 5.46, 6.98 A or (resid 60 and name HA) (resid 57 and name HG2*) ! 0.4699 956:20 ----- 5.57, 7.54 A assign (resid 127 and name HB2) (resid 32 and name HG2*) 2.65 0.85 0.85 ! 0.5466 957:20 Ambig 2.15, 3.37 A or (resid 33 and name HD2) (resid 32 and name HG2*) ! 0.4510 957:20 ----- 2.22, 3.08 A assign (resid 30 and name HA) (resid 30 and name HG2*) 2.30 0.50 0.50 ! 0.0000 964:20 Intra 2.55, 3.17 A assign (resid 55 and name HD1) (resid 54 and name HD2*) 3.15 1.35 1.35 ! 0.0000 965:20 Seq 3.56, 4.65 A assign (resid 15 and name HA1) (resid 21 and name HG2*) 2.65 0.85 0.85 ! 0.8812 966:20 Ambig 3.14, 4.08 A or (resid 11 and name HA1) (resid 10 and name HG2*) ! 0.0632 966:20 ----- 4.87, 5.90 A assign (resid 50 and name HA) (resid 50 and name HG1*) 2.65 0.85 0.85 ! 0.0000 967:20 Intra 3.74, 3.95 A assign (resid 35 and name HA1) (resid 34 and name HG1*) 4.15 2.35 2.35 ! 0.5939 968:20 Ambig 5.04, 6.19 A or (resid 84 and name HB2) (resid 34 and name HG1*) ! 0.4061 968:20 ----- 5.37, 7.67 A assign (resid 60 and name HA) (resid 60 and name HG1*) 2.30 0.50 0.50 ! 0.3760 969:20 Ambig 2.45, 3.09 A or (resid 67 and name HB*) (resid 60 and name HG1*) ! 0.3340 969:20 ----- 2.50, 3.84 A or (resid 60 and name HA) (resid 60 and name HG2*) ! 0.2731 969:20 ----- 2.58, 3.24 A assign (resid 50 and name HA) (resid 50 and name HG2*) 2.30 0.50 0.50 ! 0.0000 970:20 Intra 2.50, 3.08 A assign (resid 15 and name HA1) (resid 105 and name HD1*) 2.65 0.85 0.85 ! 0.0000 972:20 Long 2.12, 2.62 A assign (resid 127 and name HB2) (resid 133 and name HD1*) 2.65 0.85 0.85 ! 0.9992 973:20 Long 1.94, 4.00 A assign (resid 71 and name HA) (resid 71 and name HB2) 3.15 1.35 1.35 ! 0.0000 974:20 Intra 2.36, 2.45 A assign (resid 71 and name HA) (resid 71 and name HB1) 2.65 0.85 0.85 ! 0.0000 975:20 Intra 3.00, 3.03 A assign (resid 90 and name HA) (resid 91 and name HD*) 2.65 0.85 0.85 ! 0.0000 976:20 Seq 1.95, 2.33 A assign (resid 113 and name HA) (resid 113 and name HB2) 3.15 1.35 1.35 ! 0.9927 977:20 Intra 2.27, 2.55 A assign (resid 43 and name HA) (resid 43 and name HB*) 2.65 0.85 0.85 ! 0.9845 978:20 Intra 2.38, 2.47 A assign (resid 129 and name HA) (resid 131 and name HE*) 4.15 2.35 2.35 ! 0.0000 979:20 Mid 4.49, 6.54 A assign (resid 139 and name HA) (resid 139 and name HB2) 2.65 0.85 0.85 ! 0.0000 980:20 Intra 2.48, 2.65 A assign (resid 129 and name HA) (resid 129 and name HB2) 2.30 0.50 0.50 ! 0.9875 981:20 Intra 2.47, 2.51 A assign (resid 129 and name HA) (resid 129 and name HB1) 2.65 0.85 0.85 ! 0.9529 982:20 Intra 3.02, 3.04 A assign (resid 113 and name HA) (resid 113 and name HB1) 2.65 0.85 0.85 ! 0.9877 984:20 Intra 2.43, 2.66 A assign (resid 100 and name HA) (resid 100 and name HB*) 2.65 0.85 0.85 ! 0.0000 985:20 Intra 2.36, 2.73 A assign (resid 141 and name HA) (resid 141 and name HB2) 3.15 1.35 1.35 ! 0.9952 986:20 Intra 2.39, 2.47 A assign (resid 70 and name HA) (resid 70 and name HB) 3.15 1.35 1.35 ! 0.9863 987:20 Intra 3.03, 3.04 A assign (resid 28 and name HA) (resid 7 and name HE*) 4.15 2.35 2.35 ! 0.4358 990:20 Ambig 5.51, 7.67 A or (resid 132 and name HA) (resid 131 and name HE*) ! 0.2865 990:20 ----- 5.91, 7.99 A or (resid 67 and name HA) (resid 82 and name HB2) ! 0.2778 990:20 ----- 5.94, 6.40 A assign (resid 52 and name HA) (resid 52 and name HB1) 2.30 0.50 0.50 ! 0.6920 991:20 Ambig 2.38, 2.48 A or (resid 58 and name HA) (resid 61 and name HE2) ! 0.2885 991:20 ----- 2.75, 4.96 A assign (resid 52 and name HA) (resid 52 and name HB2) 2.30 0.50 0.50 ! 0.9957 992:20 Intra 2.42, 2.51 A assign (resid 19 and name HA) (resid 19 and name HB2) 3.65 1.85 1.85 ! 0.0000 993:20 Intra 2.40, 2.46 A assign (resid 28 and name HA) (resid 95 and name HB2) 2.65 0.85 0.85 ! 0.8289 996:20 Ambig 1.88, 2.21 A or (resid 132 and name HA) (resid 132 and name HB2) ! 0.1711 996:20 ----- 2.45, 2.50 A assign (resid 132 and name HA) (resid 132 and name HB1) 2.65 0.85 0.85 ! 0.0000 997:20 Intra 3.03, 3.04 A assign (resid 19 and name HA) (resid 19 and name HB1) 2.65 0.85 0.85 ! 0.9697 998:20 Intra 3.00, 3.02 A assign (resid 95 and name HA) (resid 95 and name HB2) 2.65 0.85 0.85 ! 0.9343 999:20 Intra 2.37, 2.42 A assign (resid 3 and name HA) (resid 3 and name HB2) 2.65 0.85 0.85 ! 0.9973 1001:20 Intra 2.59, 2.98 A assign (resid 65 and name HA) (resid 65 and name HB1) 2.65 0.85 0.85 ! 0.9830 1003:20 Intra 2.44, 2.57 A assign (resid 94 and name HA) (resid 94 and name HB) 2.30 0.50 0.50 ! 0.0000 1005:20 Intra 2.41, 2.53 A assign (resid 149 and name HA) (resid 149 and name HB2) 2.65 0.85 0.85 ! 0.0000 1008:20 Intra 2.64, 2.74 A assign (resid 131 and name HA) (resid 131 and name HB2) 2.65 0.85 0.85 ! 0.0000 1009:20 Intra 3.01, 3.02 A assign (resid 131 and name HA) (resid 131 and name HB1) 2.65 0.85 0.85 ! 0.0000 1010:20 Intra 2.41, 2.46 A assign (resid 75 and name HD2) (resid 75 and name HG1) 2.65 0.85 0.85 ! 0.0000 1011:20 Intra 2.64, 2.70 A assign (resid 148 and name HA) (resid 149 and name HG*) 3.65 1.85 1.85 ! 0.0000 1012:20 Seq 3.96, 4.43 A assign (resid 128 and name HA) (resid 128 and name HB2) 3.15 1.35 1.35 ! 0.5077 1013:20 Ambig 2.42, 2.48 A or (resid 148 and name HA) (resid 17 and name HG2) ! 0.4923 1013:20 ----- 2.43, 5.83 A assign (resid 23 and name HA) (resid 24 and name HG1) 3.65 1.85 1.85 ! 0.0000 1015:20 Seq 4.01, 4.31 A assign (resid 110 and name HB) (resid 47 and name HE*) 2.65 0.85 0.85 ! 0.5007 1017:20 Ambig 2.50, 4.06 A or (resid 114 and name HB2) (resid 47 and name HE*) ! 0.4172 1017:20 ----- 2.58, 5.22 A or (resid 109 and name HA) (resid 47 and name HE*) ! 0.0610 1017:20 ----- 3.55, 4.74 A assign (resid 106 and name HA) (resid 106 and name HB1) 2.65 0.85 0.85 ! 0.9709 1018:20 Intra 2.51, 2.91 A assign (resid 106 and name HA) (resid 106 and name HB2) 2.65 0.85 0.85 ! 0.9474 1019:20 Intra 2.50, 2.65 A assign (resid 64 and name HA) (resid 64 and name HB2) 2.30 0.50 0.50 ! 0.9663 1020:20 Intra 2.40, 2.44 A assign (resid 130 and name HA) (resid 130 and name HB1) 2.65 0.85 0.85 ! 0.0000 1021:20 Intra 2.40, 2.62 A assign (resid 130 and name HA) (resid 130 and name HB2) 2.30 0.50 0.50 ! 0.0000 1022:20 Intra 2.38, 2.45 A assign (resid 66 and name HA) (resid 66 and name HB*) 2.65 0.85 0.85 ! 0.9847 1023:20 Intra 2.45, 2.78 A assign (resid 64 and name HA) (resid 64 and name HB1) 2.65 0.85 0.85 ! 0.0000 1024:20 Intra 3.00, 3.02 A assign (resid 89 and name HA) (resid 89 and name HB2) 2.65 0.85 0.85 ! 0.7869 1025:20 Ambig 3.01, 3.03 A or (resid 86 and name HA) (resid 89 and name HB2) ! 0.2131 1025:20 ----- 3.74, 4.16 A assign (resid 89 and name HA) (resid 89 and name HB1) 2.65 0.85 0.85 ! 0.9908 1026:20 Intra 2.46, 2.50 A assign (resid 87 and name HA) (resid 87 and name HB2) 3.65 1.85 1.85 ! 0.9931 1027:20 Intra 2.48, 2.51 A assign (resid 4 and name HA) (resid 4 and name HG1) 3.15 1.35 1.35 ! 0.0000 1028:20 Intra 3.65, 4.07 A assign (resid 4 and name HA) (resid 4 and name HG2) 3.15 1.35 1.35 ! 0.0000 1029:20 Intra 2.68, 3.50 A assign (resid 69 and name HA) (resid 70 and name HB) 3.15 1.35 1.35 ! 0.5551 1030:20 Ambig 4.67, 4.71 A or (resid 80 and name HA) (resid 70 and name HB) ! 0.4449 1030:20 ----- 4.85, 5.09 A assign (resid 85 and name HA) (resid 85 and name HB2) 2.30 0.50 0.50 ! 0.9089 1031:20 Ambig 2.65, 2.67 A or (resid 86 and name HB) (resid 85 and name HB2) ! 0.0911 1031:20 ----- 3.89, 5.81 A assign (resid 85 and name HA) (resid 85 and name HB1) 2.30 0.50 0.50 ! 0.9611 1032:20 Intra 2.30, 2.32 A assign (resid 75 and name HA) (resid 75 and name HB2) 2.30 0.50 0.50 ! 0.4655 1033:20 Ambig 2.84, 2.90 A or (resid 120 and name HA) (resid 120 and name HB2) ! 0.4293 1033:20 ----- 2.88, 2.92 A or (resid 121 and name HA) (resid 120 and name HB2) ! 0.0766 1033:20 ----- 3.84, 3.94 A assign (resid 120 and name HA) (resid 120 and name HB1) 2.30 0.50 0.50 ! 0.9913 1034:20 Intra 2.25, 2.27 A assign (resid 1 and name HA) (resid 1 and name HB) 2.65 0.85 0.85 ! 0.7612 1035:20 Ambig 2.43, 2.73 A or (resid 24 and name HD2) (resid 24 and name HB2) ! 0.1063 1035:20 ----- 3.37, 3.84 A or (resid 33 and name HD1) (resid 33 and name HB2) ! 0.0483 1035:20 ----- 3.85, 3.88 A or (resid 33 and name HD1) (resid 91 and name HB1) ! 0.0289 1035:20 ----- 4.19, 5.19 A assign (resid 7 and name HA) (resid 7 and name HB*) 2.30 0.50 0.50 ! 0.9598 1036:20 Intra 2.40, 2.75 A assign (resid 4 and name HA) (resid 4 and name HB2) 2.65 0.85 0.85 ! 0.0000 1037:20 Intra 2.40, 2.59 A assign (resid 4 and name HA) (resid 4 and name HB1) 2.65 0.85 0.85 ! 0.0000 1038:20 Intra 2.40, 2.45 A assign (resid 85 and name HA) (resid 85 and name HG2) 3.15 1.35 1.35 ! 0.5263 1039:20 Ambig 3.78, 3.85 A or (resid 86 and name HA) (resid 85 and name HG2) ! 0.4737 1039:20 ----- 3.85, 4.34 A assign (resid 75 and name HD2) (resid 75 and name HG2) 2.30 0.50 0.50 ! 0.8391 1040:20 Ambig 2.24, 2.28 A or (resid 120 and name HA) (resid 120 and name HG*) ! 0.1576 1040:20 ----- 2.96, 3.60 A assign (resid 120 and name HD1) (resid 120 and name HG*) 2.30 0.50 0.50 ! 0.9984 1041:20 Intra 2.26, 2.47 A assign (resid 24 and name HD1) (resid 24 and name HG2) 2.65 0.85 0.85 ! 0.0000 1042:20 Intra 2.73, 2.89 A assign (resid 51 and name HA) (resid 51 and name HE*) 4.15 2.35 2.35 ! 0.0000 1043:20 Intra 2.68, 4.72 A assign (resid 79 and name HB2) (resid 71 and name HB2) 3.65 1.85 1.85 ! 0.8646 1044:20 Ambig 3.39, 3.70 A or (resid 73 and name HB*) (resid 71 and name HB2) ! 0.1059 1044:20 ----- 4.81, 6.39 A assign (resid 47 and name HA) (resid 106 and name HB2) 2.65 0.85 0.85 ! 0.4704 1045:20 Ambig 2.78, 3.28 A or (resid 17 and name HD1) (resid 16 and name HB2) ! 0.4610 1045:20 ----- 2.79, 3.67 A assign (resid 17 and name HD1) (resid 17 and name HG2) 2.65 0.85 0.85 ! 0.9007 1046:20 Ambig 2.66, 2.72 A or (resid 17 and name HA) (resid 17 and name HG2) ! 0.0993 1046:20 ----- 3.84, 3.97 A assign (resid 83 and name HA) (resid 83 and name HB) 2.30 0.50 0.50 ! 0.9918 1047:20 Intra 2.39, 2.45 A assign (resid 36 and name HA) (resid 83 and name HB) 3.65 1.85 1.85 ! 0.0000 1049:20 Long 2.07, 3.24 A assign (resid 84 and name HN) (resid 83 and name HB) 3.15 1.35 1.35 ! 0.0000 1050:20 Seq 3.51, 3.95 A assign (resid 80 and name HA) (resid 81 and name HB) 3.15 1.35 1.35 ! 0.6001 1051:20 Ambig 4.50, 4.57 A or (resid 69 and name HA) (resid 81 and name HB) ! 0.3999 1051:20 ----- 4.82, 4.95 A assign (resid 81 and name HA) (resid 81 and name HB) 2.65 0.85 0.85 ! 0.9112 1053:20 Ambig 3.03, 3.04 A or (resid 38 and name HA) (resid 81 and name HB) ! 0.0828 1053:20 ----- 4.52, 4.69 A assign (resid 82 and name HN) (resid 81 and name HB) 3.65 1.85 1.85 ! 0.0000 1054:20 Seq 4.10, 4.17 A assign (resid 90 and name HE*) (resid 90 and name HD*) 2.30 0.50 0.50 ! 0.0000 1056:20 Intra 2.43, 3.68 A assign (resid 90 and name HA) (resid 90 and name HD*) 3.15 1.35 1.35 ! 0.0000 1057:20 Intra 2.29, 3.60 A assign (resid 90 and name HB2) (resid 90 and name HD*) 3.15 1.35 1.35 ! 0.9674 1058:20 Intra 2.25, 3.02 A assign (resid 90 and name HB1) (resid 90 and name HD*) 3.15 1.35 1.35 ! 0.0000 1059:20 Intra 2.37, 3.07 A assign (resid 61 and name HB1) (resid 90 and name HD*) 2.65 0.85 0.85 ! 0.9802 1060:20 Long 2.76, 4.07 A assign (resid 86 and name HG2*) (resid 90 and name HD*) 2.65 0.85 0.85 ! 0.6752 1061:20 Ambig 1.95, 5.23 A or (resid 61 and name HG2) (resid 90 and name HD*) ! 0.3248 1061:20 ----- 2.21, 5.11 A assign (resid 145 and name HN) (resid 145 and name HB) 3.15 1.35 1.35 ! 0.9405 1062:20 Intra 3.44, 3.54 A assign (resid 19 and name HA) (resid 20 and name HB) 3.65 1.85 1.85 ! 0.0000 1063:20 Seq 4.68, 4.78 A assign (resid 20 and name HA) (resid 20 and name HB) 2.65 0.85 0.85 ! 0.0000 1064:20 Intra 3.02, 3.03 A assign (resid 21 and name HN) (resid 20 and name HB) 3.15 1.35 1.35 ! 0.9625 1065:20 Seq 3.83, 4.09 A assign (resid 19 and name HB1) (resid 20 and name HB) 4.15 2.35 2.35 ! 0.0000 1066:20 Seq 5.86, 6.24 A assign (resid 9 and name HB1) (resid 26 and name HB) 3.15 1.35 1.35 ! 0.9868 1067:20 Long 1.97, 2.34 A assign (resid 9 and name HB1) (resid 26 and name HB) 2.65 0.85 0.85 ! 0.9928 1068:20 Long 1.97, 2.34 A assign (resid 141 and name HN) (resid 12 and name HB) 4.15 2.35 2.35 ! 0.0000 1069:20 Long 5.10, 5.42 A assign (resid 69 and name HG12) (resid 81 and name HB) 3.15 1.35 1.35 ! 0.0000 1070:20 Long 3.40, 3.78 A assign (resid 141 and name HB1) (resid 12 and name HB) 3.15 1.35 1.35 ! 0.2940 1071:20 Ambig 3.97, 4.27 A or (resid 51 and name HD1) (resid 49 and name HB) ! 0.2682 1071:20 ----- 4.03, 5.12 A or (resid 104 and name HG12) (resid 49 and name HB) ! 0.2574 1071:20 ----- 4.06, 4.48 A or (resid 141 and name HD2) (resid 12 and name HB) ! 0.1525 1071:20 ----- 4.43, 6.42 A assign (resid 47 and name HE*) (resid 110 and name HB) 3.65 1.85 1.85 ! 0.0000 1072:20 Long 2.50, 4.06 A assign (resid 47 and name HG1) (resid 110 and name HB) 4.15 2.35 2.35 ! 0.8597 1074:20 Ambig 4.05, 5.15 A or (resid 144 and name HG1*) (resid 110 and name HB) ! 0.1403 1074:20 ----- 5.48, 6.82 A assign (resid 139 and name HD22) (resid 117 and name HB) 4.15 2.35 2.35 ! 0.0000 1075:20 Long 4.49, 5.19 A assign (resid 116 and name HA) (resid 117 and name HB) 4.15 2.35 2.35 ! 0.9308 1076:20 Seq 4.63, 4.70 A assign (resid 117 and name HA) (resid 117 and name HB) 2.65 0.85 0.85 ! 0.9837 1078:20 Intra 3.02, 3.02 A assign (resid 57 and name HG2*) (resid 57 and name HB) 3.15 1.35 1.35 ! 0.0000 1080:20 Intra 2.43, 2.65 A assign (resid 145 and name HB) (resid 14 and name HB*) 3.65 1.85 1.85 ! 0.5097 1083:20 Ambig 4.82, 6.15 A or (resid 145 and name HA) (resid 14 and name HB*) ! 0.4903 1083:20 ----- 4.85, 6.18 A assign (resid 26 and name HN) (resid 9 and name HB1) 3.15 1.35 1.35 ! 0.7130 1084:20 Ambig 3.86, 4.13 A or (resid 27 and name HN) (resid 9 and name HB1) ! 0.2718 1084:20 ----- 4.54, 5.39 A assign (resid 9 and name HA) (resid 9 and name HB1) 2.65 0.85 0.85 ! 0.9659 1086:20 Intra 2.46, 2.97 A assign (resid 9 and name HA) (resid 9 and name HB2) 2.30 0.50 0.50 ! 0.0000 1088:20 Intra 2.40, 2.52 A assign (resid 31 and name HN) (resid 30 and name HA) 2.30 0.50 0.50 ! 0.0000 1091:20 Seq 2.08, 2.17 A assign (resid 139 and name HN) (resid 138 and name HB1) 3.15 1.35 1.35 ! 0.0000 1092:20 Seq 3.66, 3.81 A assign (resid 63 and name HN) (resid 63 and name HA) 3.65 1.85 1.85 ! 0.0000 1093:20 Intra 2.69, 2.79 A assign (resid 68 and name HN) (resid 63 and name HA) 3.65 1.85 1.85 ! 0.0000 1094:20 Long 2.72, 3.38 A assign (resid 119 and name HA) (resid 120 and name HA) 3.15 1.35 1.35 ! 0.3312 1095:20 Ambig 4.45, 4.49 A or (resid 67 and name HA) (resid 63 and name HA) ! 0.2805 1095:20 ----- 4.57, 4.98 A or (resid 123 and name HA) (resid 120 and name HA) ! 0.2800 1095:20 ----- 4.57, 4.87 A or (resid 65 and name HA) (resid 63 and name HA) ! 0.0513 1095:20 ----- 6.07, 6.28 A assign (resid 123 and name HB2) (resid 120 and name HA) 3.15 1.35 1.35 ! 0.9889 1096:20 Mid 2.10, 2.40 A assign (resid 123 and name HD1*) (resid 120 and name HA) 3.15 1.35 1.35 ! 0.9864 1097:20 Mid 1.95, 3.57 A assign (resid 87 and name HB1) (resid 33 and name HA) 3.65 1.85 1.85 ! 0.3978 1098:20 Ambig 5.69, 6.79 A or (resid 91 and name HG2) (resid 33 and name HA) ! 0.3970 1098:20 ----- 5.69, 6.29 A or (resid 30 and name HB) (resid 33 and name HA) ! 0.2052 1098:20 ----- 6.36, 6.76 A assign (resid 93 and name HA) (resid 33 and name HA) 3.15 1.35 1.35 ! 0.9983 1100:20 Long 2.39, 2.95 A assign (resid 150 and name HN) (resid 149 and name HA) 3.15 1.35 1.35 ! 0.0000 1102:20 Seq 2.15, 2.91 A assign (resid 57 and name HG2*) (resid 57 and name HA) 3.65 1.85 1.85 ! 0.0000 1103:20 Intra 2.31, 3.01 A assign (resid 149 and name HB2) (resid 149 and name HA) 3.65 1.85 1.85 ! 0.0000 1104:20 Intra 2.64, 2.74 A assign (resid 70 and name HA) (resid 80 and name HA) 3.15 1.35 1.35 ! 0.9985 1105:20 Long 2.34, 2.45 A assign (resid 66 and name HD*) (resid 66 and name HA) 2.65 0.85 0.85 ! 0.5998 1106:20 Ambig 2.23, 3.47 A or (resid 67 and name HN) (resid 66 and name HA) ! 0.4002 1106:20 ----- 2.39, 2.75 A assign (resid 99 and name HA) (resid 55 and name HA) 2.65 0.85 0.85 ! 0.9978 1107:20 Long 2.33, 2.52 A assign (resid 104 and name HA) (resid 20 and name HA) 2.65 0.85 0.85 ! 0.0000 1108:20 Long 1.98, 2.14 A assign (resid 20 and name HG2*) (resid 20 and name HA) 2.30 0.50 0.50 ! 0.5650 1109:20 Ambig 2.39, 3.03 A or (resid 81 and name HG2*) (resid 81 and name HA) ! 0.4331 1109:20 ----- 2.49, 3.11 A assign (resid 104 and name HG2*) (resid 20 and name HA) 2.65 0.85 0.85 ! 0.9235 1110:20 Long 3.35, 4.52 A assign (resid 29 and name HB1) (resid 6 and name HA) 3.15 1.35 1.35 ! 0.0000 1111:20 Long 2.96, 3.70 A assign (resid 29 and name HB2) (resid 6 and name HA) 3.15 1.35 1.35 ! 0.9661 1112:20 Long 2.23, 2.74 A assign (resid 6 and name HB) (resid 6 and name HA) 2.65 0.85 0.85 ! 0.9439 1113:20 Intra 2.38, 2.94 A assign (resid 108 and name HN) (resid 107 and name HB*) 3.15 1.35 1.35 ! 0.6075 1114:20 Ambig 2.63, 3.55 A or (resid 60 and name HN) (resid 60 and name HA) ! 0.3867 1114:20 ----- 2.83, 2.89 A assign (resid 142 and name HA) (resid 12 and name HA) 3.15 1.35 1.35 ! 0.5049 1115:20 Ambig 4.08, 4.32 A or (resid 140 and name HA2) (resid 12 and name HA) ! 0.4500 1115:20 ----- 4.16, 4.47 A assign (resid 12 and name HB) (resid 12 and name HA) 2.65 0.85 0.85 ! 0.0000 1116:20 Intra 3.01, 3.03 A assign (resid 12 and name HG2*) (resid 12 and name HA) 2.30 0.50 0.50 ! 0.9870 1117:20 Intra 2.46, 3.10 A assign (resid 13 and name HG2*) (resid 12 and name HA) 3.15 1.35 1.35 ! 0.8986 1118:20 Ambig 3.61, 4.74 A or (resid 142 and name HG12) (resid 12 and name HA) ! 0.1014 1118:20 ----- 5.19, 5.45 A assign (resid 141 and name HG2) (resid 12 and name HA) 3.65 1.85 1.85 ! 0.6216 1119:20 Ambig 3.99, 4.54 A or (resid 141 and name HD1) (resid 12 and name HA) ! 0.3423 1119:20 ----- 4.41, 5.97 A assign (resid 36 and name HA) (resid 83 and name HA) 3.15 1.35 1.35 ! 0.9957 1120:20 Long 2.44, 2.75 A assign (resid 31 and name HB1) (resid 31 and name HA) 2.30 0.50 0.50 ! 0.4149 1121:20 Ambig 2.28, 2.58 A or (resid 0 and name HB*) (resid 0 and name HA) ! 0.2998 1121:20 ----- 2.41, 2.72 A or (resid 31 and name HB2) (resid 31 and name HA) ! 0.2758 1121:20 ----- 2.44, 2.77 A assign (resid 106 and name HB2) (resid 47 and name HA) 3.65 1.85 1.85 ! 0.9516 1122:20 Long 2.78, 3.28 A assign (resid 106 and name HB1) (resid 47 and name HA) 3.15 1.35 1.35 ! 0.9364 1123:20 Long 2.70, 3.27 A assign (resid 106 and name HD21) (resid 47 and name HA) 3.65 1.85 1.85 ! 0.9890 1124:20 Long 2.88, 3.61 A assign (resid 47 and name HN) (resid 47 and name HA) 3.15 1.35 1.35 ! 0.0000 1125:20 Intra 2.87, 2.90 A assign (resid 48 and name HN) (resid 47 and name HA) 3.15 1.35 1.35 ! 0.5519 1126:20 Ambig 3.45, 3.52 A or (resid 110 and name HN) (resid 47 and name HA) ! 0.4481 1126:20 ----- 3.57, 4.24 A assign (resid 78 and name HN) (resid 42 and name HA) 3.15 1.35 1.35 ! 0.0000 1127:20 Long 3.53, 3.73 A assign (resid 77 and name HA) (resid 42 and name HA) 2.65 0.85 0.85 ! 0.9973 1128:20 Long 2.18, 2.38 A assign (resid 42 and name HB*) (resid 42 and name HA) 2.30 0.50 0.50 ! 0.0000 1129:20 Intra 2.40, 2.73 A assign (resid 77 and name HB1) (resid 42 and name HA) 3.15 1.35 1.35 ! 0.5145 1130:20 Ambig 3.99, 4.48 A or (resid 77 and name HD*) (resid 42 and name HA) ! 0.2914 1130:20 ----- 4.38, 5.50 A or (resid 77 and name HB2) (resid 42 and name HA) ! 0.1941 1130:20 ----- 4.69, 4.94 A assign (resid 41 and name HG2*) (resid 42 and name HA) 3.15 1.35 1.35 ! 0.9754 1131:20 Seq 3.64, 4.89 A assign (resid 79 and name HN) (resid 79 and name HA) 3.15 1.35 1.35 ! 0.0000 1132:20 Intra 2.86, 2.91 A assign (resid 143 and name HB) (resid 14 and name HA) 2.65 0.85 0.85 ! 0.0000 1133:20 Long 2.34, 2.53 A assign (resid 79 and name HB2) (resid 79 and name HA) 2.65 0.85 0.85 ! 0.0000 1134:20 Intra 3.02, 3.02 A assign (resid 79 and name HB1) (resid 79 and name HA) 3.15 1.35 1.35 ! 0.0000 1135:20 Intra 2.41, 2.44 A assign (resid 78 and name HG2*) (resid 79 and name HA) 3.15 1.35 1.35 ! 0.3746 1136:20 Ambig 3.94, 5.17 A or (resid 41 and name HD1*) (resid 79 and name HA) ! 0.3206 1136:20 ----- 4.04, 5.91 A or (resid 41 and name HG11) (resid 79 and name HA) ! 0.2104 1136:20 ----- 4.33, 5.50 A or (resid 70 and name HG1*) (resid 79 and name HA) ! 0.0496 1136:20 ----- 5.51, 6.84 A assign (resid 80 and name HB) (resid 79 and name HA) 3.65 1.85 1.85 ! 0.0000 1137:20 Seq 4.56, 4.64 A assign (resid 145 and name HG2*) (resid 14 and name HA) 3.15 1.35 1.35 ! 0.4217 1138:20 Ambig 3.92, 5.23 A or (resid 143 and name HG2*) (resid 14 and name HA) ! 0.2962 1138:20 ----- 4.16, 4.91 A or (resid 12 and name HG2*) (resid 14 and name HA) ! 0.1595 1138:20 ----- 4.61, 5.61 A or (resid 144 and name HG2*) (resid 14 and name HA) ! 0.0574 1138:20 ----- 5.46, 6.39 A assign (resid 142 and name HG2*) (resid 14 and name HA) 3.15 1.35 1.35 ! 0.0000 1139:20 Long 3.30, 4.19 A assign (resid 14 and name HB*) (resid 14 and name HA) 2.30 0.50 0.50 ! 0.0000 1140:20 Intra 2.28, 2.63 A assign (resid 9 and name HB2) (resid 9 and name HA) 2.65 0.85 0.85 ! 0.9807 1141:20 Intra 2.40, 2.52 A assign (resid 10 and name HB) (resid 9 and name HA) 4.15 2.35 2.35 ! 0.0000 1142:20 Seq 5.58, 5.64 A assign (resid 10 and name HG2*) (resid 9 and name HA) 3.15 1.35 1.35 ! 0.8743 1143:20 Ambig 3.50, 4.62 A or (resid 25 and name HG1*) (resid 9 and name HA) ! 0.0711 1143:20 ----- 5.32, 6.63 A assign (resid 52 and name HN) (resid 51 and name HA) 3.65 1.85 1.85 ! 0.0000 1144:20 Seq 3.50, 3.53 A assign (resid 51 and name HN) (resid 51 and name HA) 3.15 1.35 1.35 ! 0.9955 1145:20 Intra 2.85, 2.88 A assign (resid 104 and name HD1*) (resid 51 and name HA) 3.65 1.85 1.85 ! 0.0000 1146:20 Long 4.18, 5.64 A assign (resid 59 and name HD1*) (resid 59 and name HA) 3.65 1.85 1.85 ! 0.0000 1147:20 Intra 4.12, 4.62 A assign (resid 59 and name HB1) (resid 59 and name HA) 3.15 1.35 1.35 ! 0.9600 1148:20 Intra 2.38, 2.44 A assign (resid 59 and name HN) (resid 59 and name HA) 3.65 1.85 1.85 ! 0.0000 1149:20 Intra 2.90, 2.92 A assign (resid 29 and name HE21) (resid 29 and name HA) 3.65 1.85 1.85 ! 0.0000 1150:20 Intra 3.89, 4.19 A assign (resid 64 and name HN) (resid 64 and name HA) 3.15 1.35 1.35 ! 0.0000 1151:20 Intra 2.76, 2.82 A assign (resid 89 and name HN) (resid 89 and name HA) 3.65 1.85 1.85 ! 0.0000 1152:20 Intra 2.88, 2.93 A assign (resid 65 and name HN) (resid 64 and name HA) 3.65 1.85 1.85 ! 0.8177 1153:20 Ambig 3.33, 3.45 A or (resid 65 and name HD21) (resid 64 and name HA) ! 0.1003 1153:20 ----- 4.72, 6.17 A or (resid 88 and name HN) (resid 89 and name HA) ! 0.0819 1153:20 ----- 4.89, 5.02 A assign (resid 89 and name HD21) (resid 89 and name HA) 3.65 1.85 1.85 ! 0.8495 1154:20 Ambig 2.90, 4.12 A or (resid 89 and name HD22) (resid 89 and name HA) ! 0.1410 1154:20 ----- 3.91, 4.48 A assign (resid 89 and name HB1) (resid 89 and name HA) 2.65 0.85 0.85 ! 0.9908 1155:20 Intra 2.46, 2.50 A assign (resid 47 and name HN) (resid 48 and name HA) 3.15 1.35 1.35 ! 0.5673 1156:20 Ambig 4.66, 4.92 A or (resid 43 and name HD*) (resid 48 and name HA) ! 0.4327 1156:20 ----- 4.87, 6.95 A assign (resid 105 and name HA) (resid 48 and name HA) 2.65 0.85 0.85 ! 0.9832 1157:20 Long 2.42, 2.64 A assign (resid 48 and name HB2) (resid 48 and name HA) 3.15 1.35 1.35 ! 0.9016 1158:20 Ambig 3.01, 3.02 A or (resid 106 and name HB1) (resid 48 and name HA) ! 0.0984 1158:20 ----- 4.36, 5.02 A assign (resid 48 and name HB1) (resid 48 and name HA) 2.65 0.85 0.85 ! 0.0000 1159:20 Intra 2.40, 2.44 A assign (resid 106 and name HN) (resid 48 and name HA) 3.15 1.35 1.35 ! 0.9877 1160:20 Long 2.66, 2.89 A assign (resid 82 and name HD*) (resid 82 and name HA) 3.15 1.35 1.35 ! 0.9826 1161:20 Intra 2.43, 3.53 A assign (resid 68 and name HA) (resid 82 and name HA) 2.65 0.85 0.85 ! 0.9047 1163:20 Ambig 2.94, 3.30 A or (resid 81 and name HA) (resid 82 and name HA) ! 0.0845 1163:20 ----- 4.36, 4.40 A assign (resid 82 and name HB2) (resid 82 and name HA) 3.15 1.35 1.35 ! 0.0000 1164:20 Intra 3.02, 3.03 A assign (resid 82 and name HB1) (resid 82 and name HA) 3.15 1.35 1.35 ! 0.0000 1165:20 Intra 2.41, 2.46 A assign (resid 83 and name HG2*) (resid 82 and name HA) 3.65 1.85 1.85 ! 0.9420 1166:20 Seq 3.80, 4.92 A assign (resid 69 and name HD1*) (resid 82 and name HA) 3.65 1.85 1.85 ! 0.9063 1167:20 Ambig 2.96, 3.75 A or (resid 37 and name HD1*) (resid 82 and name HA) ! 0.0522 1167:20 ----- 4.76, 6.11 A assign (resid 36 and name HB1) (resid 36 and name HA) 2.65 0.85 0.85 ! 0.9955 1168:20 Intra 2.49, 2.83 A assign (resid 69 and name HA) (resid 82 and name HA) 4.15 2.35 2.35 ! 0.7014 1169:20 Ambig 5.74, 5.86 A or (resid 66 and name HA) (resid 82 and name HA) ! 0.2986 1169:20 ----- 6.62, 7.10 A assign (resid 36 and name HD2*) (resid 36 and name HA) 2.65 0.85 0.85 ! 0.9983 1170:20 Intra 1.96, 3.31 A assign (resid 131 and name HB1) (resid 131 and name HA) 3.15 1.35 1.35 ! 0.0000 1171:20 Intra 2.41, 2.46 A assign (resid 131 and name HD*) (resid 131 and name HA) 3.65 1.85 1.85 ! 0.9981 1172:20 Intra 1.93, 2.83 A assign (resid 131 and name HG1) (resid 131 and name HA) 3.65 1.85 1.85 ! 0.0000 1173:20 Intra 3.72, 3.78 A assign (resid 107 and name HA) (resid 106 and name HA) 3.15 1.35 1.35 ! 0.0000 1174:20 Seq 4.21, 4.34 A assign (resid 141 and name HA) (resid 115 and name HA) 3.15 1.35 1.35 ! 0.9986 1175:20 Long 1.85, 2.11 A assign (resid 106 and name HB1) (resid 109 and name HA) 3.65 1.85 1.85 ! 0.8121 1176:20 Ambig 2.78, 3.57 A or (resid 47 and name HE*) (resid 109 and name HA) ! 0.1879 1176:20 ----- 3.55, 4.74 A assign (resid 47 and name HG2) (resid 109 and name HA) 3.65 1.85 1.85 ! 0.9796 1177:20 Long 2.35, 4.06 A assign (resid 47 and name HG1) (resid 109 and name HA) 2.65 0.85 0.85 ! 0.9876 1178:20 Long 2.40, 2.87 A assign (resid 47 and name HB*) (resid 109 and name HA) 3.65 1.85 1.85 ! 0.0000 1179:20 Long 3.74, 4.67 A assign (resid 45 and name HN) (resid 44 and name HA) 3.15 1.35 1.35 ! 0.9633 1180:20 Seq 2.06, 2.12 A assign (resid 52 and name HN) (resid 52 and name HA) 3.65 1.85 1.85 ! 0.0000 1181:20 Intra 2.70, 2.74 A assign (resid 62 and name HB2) (resid 62 and name HA) 3.15 1.35 1.35 ! 0.9907 1182:20 Intra 2.52, 2.69 A assign (resid 22 and name HA) (resid 102 and name HA) 2.30 0.50 0.50 ! 0.9823 1183:20 Long 2.25, 2.43 A assign (resid 102 and name HB2) (resid 102 and name HA) 2.65 0.85 0.85 ! 0.9655 1184:20 Intra 2.48, 2.58 A assign (resid 41 and name HB) (resid 40 and name HA) 3.65 1.85 1.85 ! 0.0000 1185:20 Seq 4.51, 4.61 A assign (resid 102 and name HB1) (resid 102 and name HA) 2.65 0.85 0.85 ! 0.0000 1186:20 Intra 2.95, 3.00 A assign (resid 22 and name HB*) (resid 102 and name HA) 3.15 1.35 1.35 ! 0.0000 1187:20 Long 2.71, 4.31 A assign (resid 20 and name HG2*) (resid 102 and name HA) 3.15 1.35 1.35 ! 0.0000 1188:20 Long 3.87, 4.89 A assign (resid 21 and name HG1*) (resid 102 and name HA) 3.15 1.35 1.35 ! 0.5650 1189:20 Ambig 4.63, 5.73 A or (resid 54 and name HD1*) (resid 102 and name HA) ! 0.2701 1189:20 ----- 5.23, 6.86 A or (resid 53 and name HG1*) (resid 102 and name HA) ! 0.1649 1189:20 ----- 5.68, 6.90 A assign (resid 8 and name HB2) (resid 8 and name HA) 3.15 1.35 1.35 ! 0.8489 1190:20 Ambig 2.42, 2.84 A or (resid 8 and name HG) (resid 8 and name HA) ! 0.1473 1190:20 ----- 3.24, 3.73 A assign (resid 8 and name HD1*) (resid 8 and name HA) 2.65 0.85 0.85 ! 0.5080 1191:20 Ambig 2.11, 3.16 A or (resid 8 and name HD2*) (resid 8 and name HA) ! 0.4835 1191:20 ----- 2.13, 3.63 A assign (resid 8 and name HB1) (resid 8 and name HA) 3.65 1.85 1.85 ! 0.0000 1192:20 Intra 2.54, 2.77 A assign (resid 102 and name HN) (resid 101 and name HA) 3.65 1.85 1.85 ! 0.9933 1193:20 Seq 2.18, 2.22 A assign (resid 32 and name HA) (resid 33 and name HD1) 2.65 0.85 0.85 ! 0.9955 1195:20 Seq 2.00, 2.27 A assign (resid 23 and name HA) (resid 24 and name HD2) 2.30 0.50 0.50 ! 0.0000 1196:20 Seq 2.25, 2.42 A assign (resid 32 and name HA) (resid 33 and name HD2) 2.30 0.50 0.50 ! 0.9988 1197:20 Seq 2.07, 2.47 A assign (resid 16 and name HA) (resid 17 and name HD1) 2.65 0.85 0.85 ! 0.0000 1199:20 Seq 2.02, 2.14 A assign (resid 145 and name HN) (resid 17 and name HD2) 3.65 1.85 1.85 ! 0.6929 1200:20 Ambig 4.01, 5.30 A or (resid 16 and name HN) (resid 17 and name HD2) ! 0.2744 1200:20 ----- 4.68, 5.06 A assign (resid 137 and name HB*) (resid 137 and name HA) 2.30 0.50 0.50 ! 0.9581 1203:20 Intra 2.45, 2.67 A assign (resid 10 and name HG2*) (resid 137 and name HA) 3.65 1.85 1.85 ! 0.0000 1204:20 Long 5.15, 6.45 A assign (resid 10 and name HG1*) (resid 137 and name HA) 4.15 2.35 2.35 ! 0.0000 1205:20 Long 5.89, 7.49 A assign (resid 132 and name HA) (resid 126 and name HA) 3.15 1.35 1.35 ! 0.9996 1206:20 Long 1.98, 2.29 A assign (resid 17 and name HD1) (resid 16 and name HA) 2.65 0.85 0.85 ! 0.0000 1207:20 Seq 2.02, 2.14 A assign (resid 17 and name HD2) (resid 16 and name HA) 2.65 0.85 0.85 ! 0.9824 1208:20 Seq 2.14, 2.89 A assign (resid 126 and name HB*) (resid 126 and name HA) 2.65 0.85 0.85 ! 0.9873 1209:20 Intra 2.37, 2.63 A assign (resid 16 and name HB2) (resid 16 and name HA) 2.65 0.85 0.85 ! 0.9413 1210:20 Intra 2.42, 2.76 A assign (resid 144 and name HG1*) (resid 16 and name HA) 2.65 0.85 0.85 ! 0.9822 1211:20 Long 2.15, 3.57 A assign (resid 148 and name HA) (resid 149 and name HD2) 2.65 0.85 0.85 ! 0.0000 1212:20 Seq 1.91, 2.25 A assign (resid 148 and name HA) (resid 149 and name HD1) 2.65 0.85 0.85 ! 0.0000 1213:20 Seq 2.10, 2.49 A assign (resid 148 and name HB*) (resid 149 and name HD2) 3.65 1.85 1.85 ! 0.0000 1214:20 Seq 2.30, 3.71 A assign (resid 144 and name HG1*) (resid 17 and name HD2) 3.15 1.35 1.35 ! 0.0000 1215:20 Long 3.36, 4.53 A assign (resid 90 and name HN) (resid 91 and name HD*) 3.15 1.35 1.35 ! 0.0000 1216:20 Seq 3.68, 4.44 A assign (resid 91 and name HB1) (resid 91 and name HD*) 2.65 0.85 0.85 ! 0.0000 1217:20 Intra 3.25, 3.74 A assign (resid 91 and name HG1) (resid 91 and name HD*) 2.65 0.85 0.85 ! 0.9959 1218:20 Intra 2.25, 2.58 A assign (resid 91 and name HB2) (resid 91 and name HD*) 3.15 1.35 1.35 ! 0.0000 1219:20 Intra 3.29, 3.89 A assign (resid 91 and name HG2) (resid 91 and name HD*) 2.65 0.85 0.85 ! 0.9948 1220:20 Intra 2.26, 2.56 A assign (resid 145 and name HG2*) (resid 15 and name HA2) 3.65 1.85 1.85 ! 0.5921 1222:20 Ambig 4.40, 5.88 A or (resid 144 and name HG2*) (resid 15 and name HA2) ! 0.1315 1222:20 ----- 5.65, 7.13 A or (resid 105 and name HG2*) (resid 15 and name HA2) ! 0.0996 1222:20 ----- 5.92, 7.11 A or (resid 12 and name HG2*) (resid 11 and name HA2) ! 0.0796 1222:20 ----- 6.14, 6.49 A or (resid 10 and name HG1*) (resid 11 and name HA2) ! 0.0704 1222:20 ----- 6.27, 6.52 A assign (resid 144 and name HG2*) (resid 15 and name HA1) 3.15 1.35 1.35 ! 0.4729 1223:20 Ambig 4.15, 5.79 A or (resid 105 and name HG2*) (resid 15 and name HA1) ! 0.2566 1223:20 ----- 4.60, 5.76 A or (resid 145 and name HG2*) (resid 15 and name HA1) ! 0.1364 1223:20 ----- 5.11, 6.61 A or (resid 142 and name HB) (resid 15 and name HA1) ! 0.0627 1223:20 ----- 5.81, 6.38 A assign (resid 24 and name HG2) (resid 11 and name HA1) 3.15 1.35 1.35 ! 0.6858 1224:20 Ambig 3.67, 5.12 A or (resid 105 and name HB) (resid 15 and name HA1) ! 0.1659 1224:20 ----- 4.64, 4.96 A or (resid 24 and name HG1) (resid 11 and name HA1) ! 0.0871 1224:20 ----- 5.17, 6.55 A assign (resid 36 and name HN) (resid 35 and name HA1) 3.65 1.85 1.85 ! 0.0000 1225:20 Seq 2.88, 3.14 A assign (resid 35 and name HN) (resid 35 and name HA1) 3.15 1.35 1.35 ! 0.0000 1226:20 Intra 2.42, 2.52 A assign (resid 84 and name HN) (resid 35 and name HA1) 3.65 1.85 1.85 ! 0.0000 1227:20 Long 3.64, 4.22 A assign (resid 15 and name HN) (resid 15 and name HA2) 3.15 1.35 1.35 ! 0.0000 1228:20 Intra 2.81, 2.87 A assign (resid 77 and name HN) (resid 76 and name HA1) 3.15 1.35 1.35 ! 0.0000 1229:20 Seq 3.08, 3.21 A assign (resid 43 and name HN) (resid 76 and name HA1) 3.15 1.35 1.35 ! 0.0000 1230:20 Long 3.49, 3.81 A assign (resid 45 and name HN) (resid 76 and name HA1) 3.65 1.85 1.85 ! 0.9666 1231:20 Long 3.35, 3.95 A assign (resid 59 and name HN) (resid 59 and name HB2) 3.15 1.35 1.35 ! 0.0000 1232:20 Intra 2.51, 2.58 A assign (resid 59 and name HN) (resid 59 and name HB1) 3.15 1.35 1.35 ! 0.0000 1233:20 Intra 3.64, 3.70 A assign (resid 56 and name HD21) (resid 59 and name HB2) 3.65 1.85 1.85 ! 0.9950 1234:20 Mid 2.66, 3.61 A assign (resid 36 and name HN) (resid 36 and name HB1) 3.65 1.85 1.85 ! 0.0000 1235:20 Intra 2.56, 3.18 A assign (resid 60 and name HN) (resid 59 and name HB1) 3.65 1.85 1.85 ! 0.0000 1236:20 Seq 3.12, 3.29 A assign (resid 60 and name HN) (resid 59 and name HB2) 3.65 1.85 1.85 ! 0.0000 1237:20 Seq 1.98, 2.13 A assign (resid 98 and name HN) (resid 98 and name HB2) 3.15 1.35 1.35 ! 0.9077 1238:20 Ambig 2.61, 2.70 A or (resid 27 and name HN) (resid 98 and name HB2) ! 0.0828 1238:20 ----- 3.88, 4.22 A assign (resid 98 and name HN) (resid 98 and name HB1) 3.15 1.35 1.35 ! 0.9747 1239:20 Intra 2.39, 2.44 A assign (resid 99 and name HN) (resid 98 and name HB2) 3.65 1.85 1.85 ! 0.0000 1240:20 Seq 3.63, 3.73 A assign (resid 99 and name HN) (resid 98 and name HB1) 3.65 1.85 1.85 ! 0.0000 1241:20 Seq 2.17, 2.33 A assign (resid 98 and name HA) (resid 98 and name HB1) 3.15 1.35 1.35 ! 0.0000 1242:20 Intra 3.01, 3.02 A assign (resid 98 and name HA) (resid 98 and name HB2) 3.65 1.85 1.85 ! 0.9984 1243:20 Intra 2.44, 2.46 A assign (resid 98 and name HD2*) (resid 98 and name HB2) 2.65 0.85 0.85 ! 0.9929 1244:20 Intra 2.48, 3.12 A assign (resid 98 and name HD2*) (resid 98 and name HB1) 2.65 0.85 0.85 ! 0.9321 1245:20 Intra 2.37, 3.02 A assign (resid 40 and name HA) (resid 40 and name HB2) 2.65 0.85 0.85 ! 0.0000 1246:20 Intra 2.43, 2.49 A assign (resid 40 and name HA) (resid 40 and name HB1) 2.65 0.85 0.85 ! 0.0000 1247:20 Intra 3.02, 3.03 A assign (resid 119 and name HB2) (resid 40 and name HB1) 3.15 1.35 1.35 ! 0.0000 1250:20 Long 3.10, 3.52 A assign (resid 119 and name HB2) (resid 40 and name HB2) 3.65 1.85 1.85 ! 0.0000 1251:20 Long 4.77, 5.23 A assign (resid 77 and name HD*) (resid 40 and name HB1) 4.15 2.35 2.35 ! 0.6712 1253:20 Ambig 4.80, 6.23 A or (resid 121 and name HB*) (resid 40 and name HB1) ! 0.1979 1253:20 ----- 5.89, 7.74 A or (resid 41 and name HG12) (resid 40 and name HB1) ! 0.1309 1253:20 ----- 6.31, 6.87 A assign (resid 119 and name HN) (resid 40 and name HB1) 3.65 1.85 1.85 ! 0.0000 1254:20 Long 2.97, 3.51 A assign (resid 40 and name HN) (resid 40 and name HB1) 3.65 1.85 1.85 ! 0.0000 1255:20 Intra 2.50, 2.63 A assign (resid 40 and name HN) (resid 40 and name HB2) 3.65 1.85 1.85 ! 0.0000 1256:20 Intra 2.86, 3.05 A assign (resid 41 and name HN) (resid 40 and name HB2) 3.65 1.85 1.85 ! 0.0000 1257:20 Seq 4.15, 4.29 A assign (resid 41 and name HN) (resid 40 and name HB1) 3.65 1.85 1.85 ! 0.0000 1258:20 Seq 4.09, 4.22 A assign (resid 116 and name HN) (resid 116 and name HB2) 3.65 1.85 1.85 ! 0.8811 1259:20 Ambig 2.54, 2.59 A or (resid 117 and name HN) (resid 116 and name HB2) ! 0.1189 1259:20 ----- 3.55, 4.05 A assign (resid 117 and name HN) (resid 116 and name HB1) 3.65 1.85 1.85 ! 0.8498 1260:20 Ambig 2.70, 3.41 A or (resid 116 and name HN) (resid 116 and name HB1) ! 0.1502 1260:20 ----- 3.61, 3.66 A assign (resid 143 and name HA) (resid 113 and name HB1) 3.65 1.85 1.85 ! 0.9609 1261:20 Long 2.15, 3.90 A assign (resid 41 and name HN) (resid 41 and name HB) 2.65 0.85 0.85 ! 0.0000 1262:20 Intra 2.50, 2.58 A assign (resid 127 and name HA) (resid 127 and name HB2) 2.65 0.85 0.85 ! 0.0000 1263:20 Intra 2.36, 2.39 A assign (resid 32 and name HG2*) (resid 127 and name HB2) 4.15 2.35 2.35 ! 0.9971 1264:20 Long 2.15, 3.37 A assign (resid 133 and name HD1*) (resid 127 and name HB2) 3.65 1.85 1.85 ! 0.0000 1265:20 Long 1.94, 4.00 A assign (resid 133 and name HG11) (resid 127 and name HB2) 4.15 2.35 2.35 ! 0.9797 1266:20 Long 2.76, 5.64 A assign (resid 127 and name HN) (resid 127 and name HB2) 3.65 1.85 1.85 ! 0.9852 1267:20 Intra 2.31, 3.47 A assign (resid 119 and name HN) (resid 119 and name HB2) 3.15 1.35 1.35 ! 0.0000 1268:20 Intra 2.50, 2.63 A assign (resid 69 and name HA) (resid 69 and name HB) 3.15 1.35 1.35 ! 0.9186 1269:20 Ambig 3.02, 3.04 A or (resid 80 and name HA) (resid 69 and name HB) ! 0.0676 1269:20 ----- 4.67, 4.91 A assign (resid 81 and name HN) (resid 69 and name HB) 3.15 1.35 1.35 ! 0.9129 1270:20 Ambig 2.86, 3.12 A or (resid 70 and name HN) (resid 69 and name HB) ! 0.0871 1270:20 ----- 4.23, 4.30 A assign (resid 69 and name HG12) (resid 69 and name HB) 2.30 0.50 0.50 ! 0.9166 1271:20 Ambig 2.56, 2.60 A or (resid 51 and name HD1) (resid 104 and name HB) ! 0.0810 1271:20 ----- 3.83, 4.93 A assign (resid 69 and name HG11) (resid 69 and name HB) 2.30 0.50 0.50 ! 0.6466 1272:20 Ambig 3.00, 3.01 A or (resid 81 and name HG2*) (resid 69 and name HB) ! 0.3534 1272:20 ----- 3.32, 4.09 A assign (resid 69 and name HG2*) (resid 69 and name HB) 2.30 0.50 0.50 ! 0.5111 1273:20 Ambig 2.40, 2.62 A or (resid 104 and name HG2*) (resid 104 and name HB) ! 0.4889 1273:20 ----- 2.42, 2.64 A assign (resid 103 and name HN) (resid 102 and name HB1) 3.15 1.35 1.35 ! 0.0000 1274:20 Seq 3.96, 4.18 A assign (resid 89 and name HN) (resid 89 and name HB2) 3.65 1.85 1.85 ! 0.0000 1275:20 Intra 2.36, 2.51 A assign (resid 89 and name HN) (resid 89 and name HB1) 3.15 1.35 1.35 ! 0.0000 1276:20 Intra 3.60, 3.68 A assign (resid 102 and name HN) (resid 102 and name HB1) 3.15 1.35 1.35 ! 0.9986 1277:20 Intra 2.48, 2.67 A assign (resid 52 and name HN) (resid 102 and name HB1) 3.15 1.35 1.35 ! 0.0000 1278:20 Long 2.47, 2.87 A assign (resid 90 and name HD*) (resid 89 and name HB2) 3.15 1.35 1.35 ! 0.0000 1279:20 Seq 2.56, 4.45 A assign (resid 90 and name HD*) (resid 89 and name HB1) 3.15 1.35 1.35 ! 0.0000 1280:20 Seq 3.29, 4.82 A assign (resid 89 and name HD21) (resid 89 and name HB1) 3.15 1.35 1.35 ! 0.8344 1281:20 Ambig 2.86, 3.22 A or (resid 89 and name HD22) (resid 89 and name HB1) ! 0.1656 1281:20 ----- 3.75, 3.92 A assign (resid 56 and name HD21) (resid 97 and name HB) 3.15 1.35 1.35 ! 0.8530 1282:20 Ambig 3.55, 3.89 A or (resid 94 and name HN) (resid 92 and name HB) ! 0.1470 1282:20 ----- 4.76, 4.97 A assign (resid 92 and name HA) (resid 92 and name HB) 3.15 1.35 1.35 ! 0.8698 1283:20 Ambig 3.02, 3.04 A or (resid 98 and name HA) (resid 97 and name HB) ! 0.0546 1283:20 ----- 4.80, 5.16 A assign (resid 97 and name HA) (resid 97 and name HB) 2.65 0.85 0.85 ! 0.0000 1284:20 Intra 3.04, 3.05 A assign (resid 34 and name HG2*) (resid 92 and name HB) 4.15 2.35 2.35 ! 0.9488 1286:20 Long 4.40, 5.46 A assign (resid 92 and name HG2*) (resid 92 and name HB) 2.30 0.50 0.50 ! 0.3764 1287:20 Ambig 2.39, 2.65 A or (resid 97 and name HG12) (resid 97 and name HB) ! 0.3691 1287:20 ----- 2.40, 2.51 A or (resid 97 and name HD1*) (resid 97 and name HB) ! 0.2522 1287:20 ----- 2.56, 3.23 A assign (resid 92 and name HG11) (resid 92 and name HB) 2.65 0.85 0.85 ! 0.9370 1288:20 Intra 2.43, 2.48 A assign (resid 92 and name HD1*) (resid 92 and name HB) 2.65 0.85 0.85 ! 0.0000 1289:20 Intra 2.58, 3.18 A assign (resid 87 and name HD2*) (resid 87 and name HB1) 2.65 0.85 0.85 ! 0.9334 1290:20 Intra 2.37, 2.98 A assign (resid 87 and name HD1*) (resid 87 and name HB2) 2.30 0.50 0.50 ! 0.5387 1291:20 Ambig 2.48, 3.09 A or (resid 87 and name HD2*) (resid 87 and name HB2) ! 0.4613 1291:20 ----- 2.54, 3.18 A assign (resid 87 and name HG) (resid 87 and name HB2) 2.65 0.85 0.85 ! 0.0000 1292:20 Intra 3.02, 3.02 A assign (resid 87 and name HG) (resid 87 and name HB1) 2.30 0.50 0.50 ! 0.9284 1293:20 Intra 2.51, 2.54 A assign (resid 87 and name HA) (resid 87 and name HB1) 3.65 1.85 1.85 ! 0.9972 1294:20 Intra 2.31, 2.33 A assign (resid 65 and name HA) (resid 65 and name HB2) 2.65 0.85 0.85 ! 0.9410 1295:20 Intra 2.78, 2.99 A assign (resid 90 and name HD*) (resid 90 and name HB2) 3.15 1.35 1.35 ! 0.0000 1296:20 Intra 2.25, 3.02 A assign (resid 90 and name HA) (resid 90 and name HB2) 3.15 1.35 1.35 ! 0.0000 1297:20 Intra 2.55, 3.01 A assign (resid 61 and name HB1) (resid 90 and name HB1) 3.15 1.35 1.35 ! 0.0000 1298:20 Long 2.06, 3.75 A assign (resid 61 and name HB1) (resid 90 and name HB2) 3.15 1.35 1.35 ! 0.5359 1299:20 Ambig 2.57, 4.37 A or (resid 61 and name HB2) (resid 90 and name HB2) ! 0.4519 1299:20 ----- 2.64, 3.88 A assign (resid 61 and name HG2) (resid 90 and name HB2) 3.65 1.85 1.85 ! 0.7108 1300:20 Ambig 2.89, 5.44 A or (resid 86 and name HG2*) (resid 90 and name HB2) ! 0.2797 1300:20 ----- 3.38, 5.36 A assign (resid 90 and name HN) (resid 90 and name HB2) 3.65 1.85 1.85 ! 0.0000 1301:20 Intra 2.50, 2.67 A assign (resid 16 and name HD22) (resid 16 and name HB1) 3.65 1.85 1.85 ! 0.0000 1302:20 Intra 3.44, 3.79 A assign (resid 16 and name HA) (resid 16 and name HB1) 2.65 0.85 0.85 ! 0.0000 1303:20 Intra 2.33, 2.41 A assign (resid 17 and name HD1) (resid 16 and name HB1) 3.15 1.35 1.35 ! 0.6777 1304:20 Ambig 2.75, 3.49 A or (resid 146 and name HA1) (resid 16 and name HB1) ! 0.3223 1304:20 ----- 3.11, 6.32 A assign (resid 17 and name HD2) (resid 16 and name HB1) 3.15 1.35 1.35 ! 0.0000 1305:20 Seq 1.99, 2.93 A assign (resid 17 and name HD2) (resid 16 and name HB2) 3.15 1.35 1.35 ! 0.8627 1306:20 Ambig 2.11, 2.91 A or (resid 127 and name HB2) (resid 3 and name HB1) ! 0.1373 1306:20 ----- 2.86, 5.47 A assign (resid 16 and name HA) (resid 16 and name HB2) 2.65 0.85 0.85 ! 0.0000 1307:20 Intra 2.42, 2.76 A assign (resid 16 and name HD21) (resid 16 and name HB2) 3.15 1.35 1.35 ! 0.9935 1308:20 Intra 2.28, 2.86 A assign (resid 106 and name HD22) (resid 106 and name HB2) 3.15 1.35 1.35 ! 0.0000 1309:20 Intra 3.41, 3.46 A assign (resid 106 and name HD22) (resid 106 and name HB1) 3.65 1.85 1.85 ! 0.0000 1310:20 Intra 3.38, 3.68 A assign (resid 39 and name HA) (resid 39 and name HB*) 2.65 0.85 0.85 ! 0.9882 1311:20 Intra 2.39, 2.46 A assign (resid 39 and name HN) (resid 39 and name HB*) 3.15 1.35 1.35 ! 0.0000 1312:20 Intra 3.36, 3.71 A assign (resid 124 and name HN) (resid 39 and name HB*) 3.65 1.85 1.85 ! 0.7488 1313:20 Ambig 4.15, 5.00 A or (resid 80 and name HN) (resid 39 and name HB*) ! 0.2512 1313:20 ----- 4.97, 5.39 A assign (resid 40 and name HN) (resid 39 and name HB*) 3.15 1.35 1.35 ! 0.0000 1314:20 Seq 2.50, 3.57 A assign (resid 39 and name HG*) (resid 39 and name HB*) 2.30 0.50 0.50 ! 0.0000 1315:20 Intra 2.37, 2.72 A assign (resid 39 and name HE*) (resid 39 and name HB*) 2.30 0.50 0.50 ! 0.0000 1316:20 Intra 2.08, 3.37 A assign (resid 41 and name HG12) (resid 39 and name HB*) 2.65 0.85 0.85 ! 0.4834 1317:20 Ambig 3.68, 5.31 A or (resid 123 and name HB2) (resid 39 and name HB*) ! 0.3610 1317:20 ----- 3.87, 4.43 A or (resid 80 and name HB) (resid 39 and name HB*) ! 0.1555 1317:20 ----- 4.45, 4.67 A assign (resid 130 and name HN) (resid 130 and name HB2) 3.15 1.35 1.35 ! 0.9906 1318:20 Intra 3.07, 3.77 A assign (resid 131 and name HN) (resid 130 and name HB1) 3.65 1.85 1.85 ! 0.0000 1319:20 Seq 3.89, 4.47 A assign (resid 56 and name HD22) (resid 56 and name HB2) 3.15 1.35 1.35 ! 0.9838 1320:20 Intra 3.47, 3.81 A assign (resid 56 and name HN) (resid 56 and name HB2) 2.65 0.85 0.85 ! 0.7157 1321:20 Ambig 2.69, 2.81 A or (resid 58 and name HN) (resid 56 and name HB2) ! 0.2843 1321:20 ----- 3.13, 4.55 A assign (resid 56 and name HD21) (resid 56 and name HB2) 3.65 1.85 1.85 ! 0.0000 1322:20 Intra 2.22, 2.95 A assign (resid 56 and name HA) (resid 56 and name HB2) 3.15 1.35 1.35 ! 0.0000 1323:20 Intra 2.33, 2.43 A assign (resid 109 and name HB*) (resid 106 and name HB2) 3.15 1.35 1.35 ! 0.9972 1326:20 Mid 2.13, 4.14 A assign (resid 56 and name HN) (resid 56 and name HB1) 2.65 0.85 0.85 ! 0.9513 1327:20 Intra 2.36, 2.45 A assign (resid 56 and name HD21) (resid 56 and name HB1) 3.15 1.35 1.35 ! 0.0000 1328:20 Intra 2.13, 2.26 A assign (resid 100 and name HE*) (resid 56 and name HB1) 3.65 1.85 1.85 ! 0.6900 1329:20 Ambig 3.64, 5.85 A or (resid 100 and name HD*) (resid 56 and name HB1) ! 0.2924 1329:20 ----- 4.20, 6.72 A assign (resid 56 and name HA) (resid 56 and name HB1) 3.15 1.35 1.35 ! 0.0000 1330:20 Intra 2.59, 3.01 A assign (resid 55 and name HA) (resid 56 and name HB1) 3.65 1.85 1.85 ! 0.0000 1332:20 Seq 4.29, 4.64 A assign (resid 60 and name HG2*) (resid 56 and name HB1) 3.15 1.35 1.35 ! 0.8507 1333:20 Ambig 3.62, 5.14 A or (resid 59 and name HD2*) (resid 56 and name HB1) ! 0.1176 1333:20 ----- 5.04, 5.78 A assign (resid 56 and name HD22) (resid 56 and name HB1) 3.15 1.35 1.35 ! 0.0000 1334:20 Intra 3.44, 3.50 A assign (resid 18 and name HN) (resid 105 and name HB) 3.15 1.35 1.35 ! 0.9844 1335:20 Long 2.44, 2.70 A assign (resid 94 and name HG2*) (resid 94 and name HB) 2.30 0.50 0.50 ! 0.0000 1336:20 Intra 2.35, 2.63 A assign (resid 72 and name HG2*) (resid 70 and name HB) 4.15 2.35 2.35 ! 0.9409 1337:20 Mid 4.52, 6.54 A assign (resid 141 and name HE*) (resid 141 and name HB2) 3.15 1.35 1.35 ! 0.0000 1338:20 Intra 1.93, 3.28 A assign (resid 116 and name HN) (resid 141 and name HB2) 3.65 1.85 1.85 ! 0.0000 1339:20 Long 3.71, 4.19 A assign (resid 71 and name HN) (resid 70 and name HB) 3.65 1.85 1.85 ! 0.0000 1340:20 Seq 4.18, 4.27 A assign (resid 70 and name HG2*) (resid 70 and name HB) 2.30 0.50 0.50 ! 0.4847 1341:20 Ambig 2.42, 2.63 A or (resid 70 and name HG1*) (resid 70 and name HB) ! 0.4558 1341:20 ----- 2.44, 2.65 A assign (resid 141 and name HG1) (resid 141 and name HB2) 2.30 0.50 0.50 ! 0.9273 1342:20 Intra 2.33, 2.49 A assign (resid 23 and name HG1*) (resid 23 and name HB) 2.30 0.50 0.50 ! 0.5252 1343:20 Ambig 2.39, 2.62 A or (resid 23 and name HG2*) (resid 23 and name HB) ! 0.4748 1343:20 ----- 2.43, 2.64 A assign (resid 8 and name HD2*) (resid 134 and name HB2) 3.15 1.35 1.35 ! 0.9618 1344:20 Long 1.92, 3.91 A assign (resid 8 and name HD2*) (resid 134 and name HB1) 3.15 1.35 1.35 ! 0.8955 1345:20 Ambig 2.29, 4.79 A or (resid 123 and name HD2*) (resid 134 and name HB1) ! 0.0660 1345:20 ----- 3.53, 5.88 A assign (resid 134 and name HG*) (resid 134 and name HB2) 2.30 0.50 0.50 ! 0.5626 1346:20 Ambig 2.29, 2.74 A or (resid 22 and name HG1) (resid 22 and name HB*) ! 0.4339 1346:20 ----- 2.39, 2.73 A assign (resid 136 and name HB*) (resid 134 and name HB2) 2.30 0.50 0.50 ! 0.4025 1347:20 Ambig 2.26, 4.74 A or (resid 22 and name HG2) (resid 22 and name HB*) ! 0.3021 1347:20 ----- 2.37, 2.70 A or (resid 22 and name HD1) (resid 22 and name HB*) ! 0.2954 1347:20 ----- 2.38, 3.15 A assign (resid 22 and name HE2) (resid 22 and name HB*) 2.30 0.50 0.50 ! 0.9852 1349:20 Intra 1.92, 2.45 A assign (resid 51 and name HE*) (resid 51 and name HB*) 2.65 0.85 0.85 ! 0.9814 1350:20 Intra 2.00, 3.63 A assign (resid 69 and name HD1*) (resid 66 and name HB*) 3.15 1.35 1.35 ! 0.0000 1351:20 Mid 2.54, 5.49 A assign (resid 66 and name HN) (resid 66 and name HB*) 3.65 1.85 1.85 ! 0.0000 1352:20 Intra 3.00, 3.55 A assign (resid 100 and name HD*) (resid 22 and name HB*) 3.65 1.85 1.85 ! 0.0000 1353:20 Long 4.30, 6.57 A assign (resid 21 and name HN) (resid 21 and name HB) 3.65 1.85 1.85 ! 0.6488 1354:20 Ambig 2.88, 2.98 A or (resid 38 and name HN) (resid 125 and name HB) ! 0.2896 1354:20 ----- 3.30, 5.58 A assign (resid 54 and name HN) (resid 53 and name HB) 3.65 1.85 1.85 ! 0.7733 1355:20 Ambig 2.72, 2.90 A or (resid 133 and name HN) (resid 125 and name HB) ! 0.2267 1355:20 ----- 3.33, 4.15 A assign (resid 51 and name HN) (resid 51 and name HB*) 2.65 0.85 0.85 ! 0.9895 1356:20 Intra 2.16, 2.94 A assign (resid 104 and name HD1*) (resid 51 and name HB*) 3.15 1.35 1.35 ! 0.8389 1357:20 Ambig 4.76, 6.02 A or (resid 53 and name HG1*) (resid 51 and name HB*) ! 0.1611 1357:20 ----- 6.27, 7.70 A assign (resid 25 and name HG1*) (resid 25 and name HB) 2.30 0.50 0.50 ! 0.4906 1358:20 Ambig 2.42, 2.63 A or (resid 25 and name HG2*) (resid 25 and name HB) ! 0.4739 1358:20 ----- 2.43, 2.64 A assign (resid 99 and name HB*) (resid 25 and name HB) 3.15 1.35 1.35 ! 0.5454 1359:20 Ambig 3.22, 4.37 A or (resid 133 and name HG2*) (resid 2 and name HB2) ! 0.3417 1359:20 ----- 3.48, 7.24 A or (resid 10 and name HG1*) (resid 25 and name HB) ! 0.0888 1359:20 ----- 4.35, 6.01 A assign (resid 109 and name HB*) (resid 17 and name HB2) 3.65 1.85 1.85 ! 0.9000 1361:20 Ambig 4.24, 5.75 A or (resid 111 and name HB*) (resid 17 and name HB2) ! 0.1000 1361:20 ----- 6.12, 7.77 A assign (resid 105 and name HG2*) (resid 17 and name HB2) 3.65 1.85 1.85 ! 0.0000 1362:20 Long 4.31, 5.59 A assign (resid 17 and name HA) (resid 17 and name HB2) 2.65 0.85 0.85 ! 0.8453 1363:20 Ambig 2.78, 2.94 A or (resid 17 and name HD1) (resid 17 and name HB2) ! 0.1337 1363:20 ----- 3.78, 3.89 A assign (resid 17 and name HD2) (resid 17 and name HB2) 3.65 1.85 1.85 ! 0.0000 1364:20 Intra 2.78, 3.12 A assign (resid 2 and name HA) (resid 2 and name HB1) 2.65 0.85 0.85 ! 0.9986 1366:20 Intra 2.39, 2.49 A assign (resid 38 and name HA) (resid 38 and name HB2) 2.65 0.85 0.85 ! 0.9033 1367:20 Ambig 2.44, 2.52 A or (resid 81 and name HA) (resid 38 and name HB2) ! 0.0902 1367:20 ----- 3.58, 3.92 A assign (resid 38 and name HA) (resid 38 and name HB1) 2.65 0.85 0.85 ! 0.9690 1368:20 Intra 2.62, 3.01 A assign (resid 39 and name HN) (resid 38 and name HB2) 3.15 1.35 1.35 ! 0.9709 1369:20 Seq 4.11, 4.20 A assign (resid 39 and name HN) (resid 38 and name HB1) 3.65 1.85 1.85 ! 0.0000 1370:20 Seq 3.55, 4.03 A assign (resid 124 and name HN) (resid 38 and name HB1) 3.15 1.35 1.35 ! 0.9991 1371:20 Long 1.94, 2.61 A assign (resid 38 and name HN) (resid 38 and name HB1) 3.15 1.35 1.35 ! 0.9939 1372:20 Intra 2.57, 2.76 A assign (resid 38 and name HN) (resid 38 and name HB2) 3.15 1.35 1.35 ! 0.9951 1373:20 Intra 2.42, 3.14 A assign (resid 124 and name HN) (resid 38 and name HB2) 3.65 1.85 1.85 ! 0.9985 1374:20 Long 2.25, 4.07 A assign (resid 128 and name HN) (resid 128 and name HG2) 3.15 1.35 1.35 ! 0.9961 1375:20 Intra 1.99, 2.76 A assign (resid 5 and name HN) (resid 4 and name HB2) 3.65 1.85 1.85 ! 0.9993 1376:20 Seq 1.86, 2.50 A assign (resid 5 and name HN) (resid 4 and name HB1) 3.15 1.35 1.35 ! 0.0000 1377:20 Seq 2.08, 3.29 A assign (resid 128 and name HA) (resid 128 and name HG2) 3.15 1.35 1.35 ! 0.0000 1378:20 Intra 3.74, 4.00 A assign (resid 141 and name HE*) (resid 141 and name HD2) 2.30 0.50 0.50 ! 0.3557 1379:20 Ambig 2.28, 2.69 A or (resid 134 and name HE2) (resid 134 and name HD*) ! 0.3256 1379:20 ----- 2.32, 2.52 A or (resid 47 and name HE*) (resid 47 and name HD2) ! 0.3177 1379:20 ----- 2.33, 2.73 A assign (resid 77 and name HE*) (resid 77 and name HD*) 2.30 0.50 0.50 ! 0.9339 1380:20 Intra 2.34, 2.60 A assign (resid 134 and name HA) (resid 134 and name HD*) 3.65 1.85 1.85 ! 0.0000 1383:20 Intra 3.76, 4.44 A assign (resid 74 and name HB) (resid 77 and name HD*) 3.65 1.85 1.85 ! 0.9692 1384:20 Mid 3.04, 4.70 A assign (resid 59 and name HN) (resid 59 and name HG) 3.15 1.35 1.35 ! 0.0000 1385:20 Intra 2.51, 2.74 A assign (resid 7 and name HE*) (resid 7 and name HD*) 2.30 0.50 0.50 ! 0.5147 1386:20 Ambig 2.35, 2.66 A or (resid 131 and name HE*) (resid 131 and name HD*) ! 0.4838 1386:20 ----- 2.37, 2.62 A assign (resid 100 and name HB*) (resid 22 and name HD1) 2.30 0.50 0.50 ! 0.7408 1387:20 Ambig 2.07, 3.45 A or (resid 22 and name HE1) (resid 22 and name HD1) ! 0.2592 1387:20 ----- 2.46, 2.81 A assign (resid 22 and name HE1) (resid 22 and name HD2) 2.30 0.50 0.50 ! 0.0000 1388:20 Intra 2.31, 2.43 A assign (resid 97 and name HA) (resid 97 and name HG12) 3.15 1.35 1.35 ! 0.0000 1389:20 Intra 3.40, 3.69 A assign (resid 39 and name HG*) (resid 41 and name HG11) 3.15 1.35 1.35 ! 0.8805 1390:20 Ambig 2.81, 4.37 A or (resid 24 and name HG1) (resid 97 and name HG12) ! 0.1195 1390:20 ----- 3.91, 4.50 A assign (resid 41 and name HA) (resid 41 and name HG11) 3.65 1.85 1.85 ! 0.9861 1392:20 Intra 2.49, 2.82 A assign (resid 97 and name HN) (resid 97 and name HG12) 3.65 1.85 1.85 ! 0.9721 1394:20 Intra 2.53, 4.06 A assign (resid 98 and name HN) (resid 97 and name HG12) 3.65 1.85 1.85 ! 0.6040 1395:20 Ambig 4.99, 5.11 A or (resid 27 and name HN) (resid 97 and name HG12) ! 0.1831 1395:20 ----- 6.09, 6.63 A or (resid 26 and name HN) (resid 97 and name HG12) ! 0.1514 1395:20 ----- 6.29, 6.71 A assign (resid 41 and name HN) (resid 41 and name HG11) 3.65 1.85 1.85 ! 0.0000 1396:20 Intra 2.26, 2.84 A assign (resid 8 and name HA) (resid 8 and name HG) 3.65 1.85 1.85 ! 0.8095 1397:20 Ambig 3.24, 3.73 A or (resid 9 and name HA) (resid 8 and name HG) ! 0.1731 1397:20 ----- 4.19, 6.29 A assign (resid 16 and name HA) (resid 17 and name HG1) 3.65 1.85 1.85 ! 0.0000 1398:20 Seq 4.00, 4.22 A assign (resid 130 and name HB1) (resid 36 and name HD1*) 3.65 1.85 1.85 ! 0.8497 1399:20 Ambig 2.64, 5.98 A or (resid 38 and name HB2) (resid 36 and name HD1*) ! 0.1503 1399:20 ----- 3.53, 6.19 A assign (resid 134 and name HE2) (resid 123 and name HD1*) 3.65 1.85 1.85 ! 0.0000 1401:20 Long 2.05, 4.41 A assign (resid 100 and name HB*) (resid 54 and name HD1*) 2.65 0.85 0.85 ! 0.8407 1402:20 Ambig 2.67, 4.65 A or (resid 22 and name HE1) (resid 54 and name HD1*) ! 0.1383 1402:20 ----- 3.60, 5.78 A assign (resid 101 and name HA) (resid 101 and name HD2*) 3.15 1.35 1.35 ! 0.9967 1404:20 Intra 2.25, 3.09 A assign (resid 29 and name HA) (resid 29 and name HB1) 2.65 0.85 0.85 ! 0.8965 1405:20 Ambig 2.43, 2.51 A or (resid 5 and name HB) (resid 29 and name HB1) ! 0.0809 1405:20 ----- 3.63, 5.03 A assign (resid 29 and name HA) (resid 29 and name HB2) 2.65 0.85 0.85 ! 0.0000 1406:20 Intra 2.98, 3.01 A assign (resid 6 and name HA) (resid 29 and name HB1) 3.15 1.35 1.35 ! 0.0000 1407:20 Long 2.96, 3.70 A assign (resid 6 and name HA) (resid 29 and name HB2) 3.15 1.35 1.35 ! 0.0000 1408:20 Long 2.23, 2.74 A assign (resid 29 and name HE21) (resid 29 and name HB1) 3.15 1.35 1.35 ! 0.0000 1409:20 Intra 1.79, 2.48 A assign (resid 6 and name HN) (resid 29 and name HB1) 4.15 2.35 2.35 ! 0.0000 1410:20 Long 4.70, 5.68 A assign (resid 29 and name HE21) (resid 29 and name HB2) 3.15 1.35 1.35 ! 0.0000 1411:20 Intra 1.90, 3.19 A assign (resid 6 and name HN) (resid 29 and name HB2) 4.15 2.35 2.35 ! 0.0000 1412:20 Long 4.68, 5.17 A assign (resid 61 and name HE2) (resid 61 and name HG1) 2.65 0.85 0.85 ! 0.3494 1413:20 Ambig 2.36, 2.92 A or (resid 2 and name HE*) (resid 2 and name HG1) ! 0.3078 1413:20 ----- 2.41, 3.33 A or (resid 131 and name HE*) (resid 131 and name HG1) ! 0.2422 1413:20 ----- 2.51, 3.41 A or (resid 62 and name HB2) (resid 61 and name HG1) ! 0.0961 1413:20 ----- 2.92, 5.51 A assign (resid 134 and name HE2) (resid 134 and name HG*) 2.65 0.85 0.85 ! 0.0000 1414:20 Intra 2.32, 3.57 A assign (resid 127 and name HB1) (resid 133 and name HG2*) 3.15 1.35 1.35 ! 0.5620 1417:20 Ambig 3.72, 4.89 A or (resid 17 and name HB2) (resid 105 and name HG2*) ! 0.2342 1417:20 ----- 4.31, 5.59 A or (resid 19 and name HB1) (resid 105 and name HG2*) ! 0.1413 1417:20 ----- 4.69, 5.92 A assign (resid 105 and name HB) (resid 105 and name HG2*) 2.30 0.50 0.50 ! 0.0000 1418:20 Intra 2.45, 2.65 A assign (resid 131 and name HE*) (resid 133 and name HG2*) 4.15 2.35 2.35 ! 0.5795 1421:20 Ambig 5.71, 7.86 A or (resid 19 and name HB2) (resid 105 and name HG2*) ! 0.4205 1421:20 ----- 6.02, 7.25 A assign (resid 24 and name HB2) (resid 97 and name HG2*) 2.30 0.50 0.50 ! 0.7289 1422:20 Ambig 2.54, 3.77 A or (resid 56 and name HB1) (resid 97 and name HG2*) ! 0.2711 1422:20 ----- 3.00, 4.70 A assign (resid 56 and name HB2) (resid 97 and name HG2*) 3.15 1.35 1.35 ! 0.0000 1423:20 Long 2.23, 3.75 A assign (resid 97 and name HB) (resid 97 and name HG2*) 2.30 0.50 0.50 ! 0.9846 1424:20 Intra 2.40, 2.63 A assign (resid 39 and name HG*) (resid 80 and name HG2*) 2.65 0.85 0.85 ! 0.8246 1425:20 Ambig 3.11, 4.30 A or (resid 13 and name HB) (resid 142 and name HG2*) ! 0.1178 1425:20 ----- 4.31, 5.61 A assign (resid 80 and name HB) (resid 80 and name HG2*) 2.30 0.50 0.50 ! 0.9796 1426:20 Intra 2.42, 2.64 A assign (resid 71 and name HB1) (resid 69 and name HG2*) 3.15 1.35 1.35 ! 0.4482 1427:20 Ambig 4.13, 5.51 A or (resid 38 and name HB1) (resid 124 and name HG2*) ! 0.3557 1427:20 ----- 4.29, 4.81 A or (resid 38 and name HB1) (resid 37 and name HG2*) ! 0.1160 1427:20 ----- 5.17, 6.11 A or (resid 130 and name HB2) (resid 124 and name HG2*) ! 0.0619 1427:20 ----- 5.74, 7.42 A assign (resid 39 and name HG*) (resid 37 and name HG2*) 2.65 0.85 0.85 ! 0.9618 1428:20 Mid 3.04, 5.20 A assign (resid 41 and name HB) (resid 41 and name HG2*) 2.30 0.50 0.50 ! 0.5078 1429:20 Ambig 2.41, 2.64 A or (resid 104 and name HB) (resid 104 and name HG2*) ! 0.4922 1429:20 ----- 2.42, 2.64 A assign (resid 27 and name HA) (resid 27 and name HG2*) 2.65 0.85 0.85 ! 0.0000 1430:20 Intra 3.72, 3.95 A assign (resid 95 and name HN) (resid 27 and name HG2*) 4.15 2.35 2.35 ! 0.6016 1431:20 Ambig 4.98, 6.25 A or (resid 99 and name HN) (resid 27 and name HG2*) ! 0.3984 1431:20 ----- 5.33, 6.49 A assign (resid 127 and name HB1) (resid 133 and name HD1*) 2.65 0.85 0.85 ! 0.0000 1432:20 Long 2.04, 2.99 A assign (resid 133 and name HG12) (resid 133 and name HD1*) 2.30 0.50 0.50 ! 0.9932 1433:20 Intra 2.38, 2.61 A assign (resid 27 and name HB) (resid 27 and name HG2*) 2.30 0.50 0.50 ! 0.9633 1434:20 Intra 2.40, 2.62 A assign (resid 103 and name HZ) (resid 78 and name HD1*) 2.65 0.85 0.85 ! 0.0000 1435:20 Long 2.37, 2.88 A assign (resid 41 and name HN) (resid 78 and name HD1*) 3.65 1.85 1.85 ! 0.8201 1436:20 Ambig 4.45, 5.68 A or (resid 42 and name HN) (resid 78 and name HD1*) ! 0.1799 1436:20 ----- 5.73, 7.08 A assign (resid 50 and name HB) (resid 78 and name HD1*) 2.30 0.50 0.50 ! 0.6686 1438:20 Ambig 2.22, 3.42 A or (resid 78 and name HB) (resid 78 and name HD1*) ! 0.3314 1438:20 ----- 2.50, 3.09 A assign (resid 41 and name HB) (resid 78 and name HD1*) 3.15 1.35 1.35 ! 0.0000 1439:20 Long 2.25, 3.59 A assign (resid 43 and name HB*) (resid 78 and name HD1*) 3.15 1.35 1.35 ! 0.0000 1441:20 Long 3.96, 5.70 A assign (resid 39 and name HG*) (resid 41 and name HD1*) 2.65 0.85 0.85 ! 0.9844 1442:20 Mid 2.03, 4.43 A assign (resid 37 and name HB) (resid 37 and name HD1*) 2.30 0.50 0.50 ! 0.4559 1443:20 Ambig 2.45, 3.06 A or (resid 41 and name HB) (resid 41 and name HD1*) ! 0.4501 1443:20 ----- 2.45, 3.07 A or (resid 39 and name HB*) (resid 41 and name HD1*) ! 0.0940 1443:20 ----- 3.19, 5.49 A assign (resid 41 and name HG12) (resid 41 and name HD1*) 2.30 0.50 0.50 ! 0.9492 1444:20 Intra 2.39, 2.61 A assign (resid 91 and name HA) (resid 92 and name HD1*) 3.65 1.85 1.85 ! 0.0000 1445:20 Seq 5.84, 6.40 A assign (resid 35 and name HA2) (resid 92 and name HD1*) 3.65 1.85 1.85 ! 0.9680 1447:20 Long 3.19, 5.13 A assign (resid 92 and name HA) (resid 92 and name HD1*) 3.15 1.35 1.35 ! 0.0000 1448:20 Intra 4.39, 4.72 A assign (resid 60 and name HA) (resid 92 and name HD1*) 3.65 1.85 1.85 ! 0.9725 1449:20 Long 2.37, 3.65 A assign (resid 82 and name HB2) (resid 92 and name HD1*) 4.15 2.35 2.35 ! 0.0000 1450:20 Long 4.47, 5.62 A assign (resid 82 and name HB1) (resid 92 and name HD1*) 4.15 2.35 2.35 ! 0.8892 1451:20 Ambig 3.73, 5.05 A or (resid 90 and name HB1) (resid 92 and name HD1*) ! 0.1108 1451:20 ----- 5.28, 6.74 A assign (resid 34 and name HB) (resid 92 and name HD1*) 3.65 1.85 1.85 ! 0.0000 1452:20 Long 5.01, 6.37 A assign (resid 92 and name HB) (resid 92 and name HD1*) 2.30 0.50 0.50 ! 0.9669 1453:20 Intra 2.58, 3.18 A assign (resid 92 and name HG12) (resid 92 and name HD1*) 2.30 0.50 0.50 ! 0.9207 1454:20 Intra 2.42, 2.62 A assign (resid 92 and name HG2*) (resid 92 and name HD1*) 2.65 0.85 0.85 ! 0.0000 1455:20 Intra 1.99, 3.65 A assign (resid 92 and name HG11) (resid 92 and name HD1*) 2.30 0.50 0.50 ! 0.6741 1456:20 Ambig 2.42, 2.63 A or (resid 98 and name HD1*) (resid 92 and name HD1*) ! 0.3169 1456:20 ----- 2.75, 5.21 A assign (resid 59 and name HN) (resid 92 and name HD1*) 4.15 2.35 2.35 ! 0.0000 1458:20 Long 5.77, 6.65 A assign (resid 93 and name HN) (resid 92 and name HD1*) 4.15 2.35 2.35 ! 0.0000 1459:20 Seq 6.37, 6.72 A assign (resid 103 and name HD*) (resid 142 and name HD1*) 3.15 1.35 1.35 ! 0.8250 1462:20 Ambig 2.78, 4.81 A or (resid 48 and name HD*) (resid 142 and name HD1*) ! 0.1750 1462:20 ----- 3.60, 4.83 A assign (resid 48 and name HE*) (resid 142 and name HD1*) 3.65 1.85 1.85 ! 0.6604 1463:20 Ambig 3.07, 4.41 A or (resid 103 and name HE*) (resid 142 and name HD1*) ! 0.3396 1463:20 ----- 3.43, 5.59 A assign (resid 142 and name HA) (resid 142 and name HD1*) 3.15 1.35 1.35 ! 0.7386 1464:20 Ambig 4.43, 4.69 A or (resid 23 and name HA) (resid 142 and name HD1*) ! 0.1904 1464:20 ----- 5.55, 6.62 A assign (resid 141 and name HA) (resid 142 and name HD1*) 3.65 1.85 1.85 ! 0.7830 1465:20 Ambig 5.37, 5.95 A or (resid 43 and name HA) (resid 142 and name HD1*) ! 0.2170 1465:20 ----- 6.66, 7.95 A assign (resid 48 and name HB2) (resid 142 and name HD1*) 3.65 1.85 1.85 ! 0.0000 1466:20 Long 4.70, 5.71 A assign (resid 103 and name HB2) (resid 142 and name HD1*) 3.15 1.35 1.35 ! 0.9257 1467:20 Long 3.27, 3.89 A assign (resid 103 and name HB1) (resid 142 and name HD1*) 3.15 1.35 1.35 ! 0.0000 1468:20 Long 4.13, 4.67 A assign (resid 23 and name HB) (resid 142 and name HD1*) 4.15 2.35 2.35 ! 0.9041 1469:20 Ambig 3.83, 5.61 A or (resid 13 and name HB) (resid 142 and name HD1*) ! 0.0606 1469:20 ----- 6.01, 6.89 A assign (resid 105 and name HG1*) (resid 142 and name HD1*) 3.15 1.35 1.35 ! 0.0000 1470:20 Long 3.71, 5.21 A assign (resid 116 and name HG) (resid 142 and name HD1*) 3.15 1.35 1.35 ! 0.9842 1471:20 Long 3.50, 4.39 A assign (resid 142 and name HB) (resid 142 and name HD1*) 2.30 0.50 0.50 ! 0.9718 1472:20 Intra 2.57, 3.16 A assign (resid 142 and name HN) (resid 142 and name HD1*) 3.15 1.35 1.35 ! 0.9220 1473:20 Intra 4.19, 4.82 A assign (resid 143 and name HN) (resid 142 and name HD1*) 3.65 1.85 1.85 ! 0.0000 1474:20 Seq 5.97, 6.44 A assign (resid 114 and name HN) (resid 142 and name HD1*) 4.15 2.35 2.35 ! 0.0000 1475:20 Long 5.86, 6.80 A assign (resid 21 and name HN) (resid 142 and name HD1*) 3.65 1.85 1.85 ! 0.5529 1476:20 Ambig 5.29, 6.31 A or (resid 44 and name HN) (resid 142 and name HD1*) ! 0.3301 1476:20 ----- 5.76, 7.35 A or (resid 104 and name HN) (resid 142 and name HD1*) ! 0.1170 1476:20 ----- 6.85, 7.48 A assign (resid 21 and name HG1*) (resid 142 and name HD1*) 2.30 0.50 0.50 ! 0.9688 1477:20 Long 2.00, 3.66 A assign (resid 142 and name HG2*) (resid 142 and name HD1*) 2.30 0.50 0.50 ! 0.0000 1478:20 Intra 2.02, 3.68 A assign (resid 142 and name HG11) (resid 142 and name HD1*) 2.30 0.50 0.50 ! 0.0000 1479:20 Intra 2.42, 2.63 A assign (resid 88 and name HN) (resid 86 and name HG2*) 3.65 1.85 1.85 ! 0.8217 1480:20 Ambig 4.34, 5.53 A or (resid 65 and name HN) (resid 86 and name HG2*) ! 0.1783 1480:20 ----- 5.61, 7.83 A assign (resid 87 and name HN) (resid 86 and name HG2*) 3.65 1.85 1.85 ! 0.0000 1481:20 Seq 4.29, 5.27 A assign (resid 89 and name HD21) (resid 86 and name HG2*) 2.65 0.85 0.85 ! 0.0000 1482:20 Mid 1.89, 3.37 A assign (resid 90 and name HN) (resid 86 and name HG2*) 3.65 1.85 1.85 ! 0.0000 1483:20 Mid 2.89, 4.69 A assign (resid 89 and name HN) (resid 86 and name HG2*) 3.65 1.85 1.85 ! 0.0000 1484:20 Mid 3.15, 4.65 A assign (resid 26 and name HN) (resid 10 and name HG2*) 3.65 1.85 1.85 ! 0.7791 1485:20 Ambig 5.63, 6.43 A or (resid 72 and name HN) (resid 70 and name HG2*) ! 0.2209 1485:20 ----- 6.95, 7.47 A assign (resid 90 and name HA) (resid 86 and name HG2*) 4.15 2.35 2.35 ! 0.0000 1486:20 Mid 5.12, 6.94 A assign (resid 85 and name HD*) (resid 86 and name HG2*) 3.65 1.85 1.85 ! 0.9919 1487:20 Seq 2.87, 6.38 A assign (resid 35 and name HN) (resid 34 and name HA) 2.30 0.50 0.50 ! 0.9994 1488:20 Seq 2.16, 2.30 A assign (resid 30 and name HG2*) (resid 93 and name HB1) 3.65 1.85 1.85 ! 0.7398 1490:20 Ambig 4.11, 5.45 A or (resid 30 and name HG1*) (resid 93 and name HB1) ! 0.1456 1490:20 ----- 5.39, 6.78 A or (resid 92 and name HG11) (resid 67 and name HB*) ! 0.0713 1490:20 ----- 6.08, 7.77 A assign (resid 1 and name HG1*) (resid 1 and name HB) 2.30 0.50 0.50 ! 0.0000 1492:20 Intra 2.37, 2.63 A assign (resid 1 and name HB) (resid 1 and name HG2*) 2.30 0.50 0.50 ! 0.0000 1493:20 Intra 2.41, 2.64 A assign (resid 2 and name HG1) (resid 2 and name HA) 2.65 0.85 0.85 ! 0.3631 1495:20 Ambig 2.42, 3.20 A or (resid 131 and name HG1) (resid 2 and name HA) ! 0.3293 1495:20 ----- 2.46, 6.48 A or (resid 2 and name HG2) (resid 2 and name HA) ! 0.3076 1495:20 ----- 2.48, 2.72 A assign (resid 97 and name HG12) (resid 24 and name HB1) 2.65 0.85 0.85 ! 0.8008 1496:20 Ambig 2.42, 3.04 A or (resid 97 and name HD1*) (resid 24 and name HB1) ! 0.1857 1496:20 ----- 3.09, 5.02 A assign (resid 2 and name HA) (resid 2 and name HB2) 2.65 0.85 0.85 ! 0.0000 1497:20 Intra 2.98, 3.02 A assign (resid 2 and name HN) (resid 2 and name HB1) 3.65 1.85 1.85 ! 0.0000 1498:20 Intra 3.56, 3.77 A assign (resid 2 and name HG2) (resid 2 and name HB1) 2.65 0.85 0.85 ! 0.5905 1499:20 Ambig 2.26, 2.53 A or (resid 2 and name HG1) (resid 2 and name HB1) ! 0.3992 1499:20 ----- 2.42, 2.91 A assign (resid 2 and name HG1) (resid 2 and name HB2) 2.30 0.50 0.50 ! 0.3413 1500:20 Ambig 2.36, 2.45 A or (resid 61 and name HG1) (resid 61 and name HB2) ! 0.3292 1500:20 ----- 2.38, 2.63 A or (resid 2 and name HG2) (resid 2 and name HB2) ! 0.2993 1500:20 ----- 2.42, 2.91 A assign (resid 2 and name HN) (resid 2 and name HG1) 3.15 1.35 1.35 ! 0.9304 1501:20 Intra 2.48, 3.17 A assign (resid 2 and name HN) (resid 2 and name HG2) 3.15 1.35 1.35 ! 0.0000 1502:20 Intra 2.38, 3.82 A assign (resid 2 and name HA) (resid 2 and name HG1) 3.15 1.35 1.35 ! 0.0000 1503:20 Intra 2.42, 3.20 A assign (resid 3 and name HD21) (resid 3 and name HB2) 3.15 1.35 1.35 ! 0.0000 1504:20 Intra 2.10, 2.85 A assign (resid 3 and name HD22) (resid 3 and name HB2) 3.15 1.35 1.35 ! 0.9215 1505:20 Intra 3.43, 3.76 A assign (resid 3 and name HA) (resid 3 and name HB1) 2.65 0.85 0.85 ! 0.9982 1506:20 Intra 2.43, 2.55 A assign (resid 3 and name HD21) (resid 3 and name HB1) 3.65 1.85 1.85 ! 0.0000 1507:20 Intra 2.15, 2.58 A assign (resid 4 and name HB1) (resid 4 and name HA) 2.65 0.85 0.85 ! 0.9979 1509:20 Intra 2.40, 2.45 A assign (resid 29 and name HA) (resid 29 and name HG*) 2.30 0.50 0.50 ! 0.0000 1510:20 Intra 2.36, 2.85 A assign (resid 14 and name HN) (resid 13 and name HB) 2.30 0.50 0.50 ! 0.9990 1511:20 Seq 2.36, 2.46 A assign (resid 5 and name HN) (resid 4 and name HG1) 3.65 1.85 1.85 ! 0.9651 1512:20 Seq 3.27, 4.07 A assign (resid 4 and name HN) (resid 4 and name HG1) 3.65 1.85 1.85 ! 0.0000 1513:20 Intra 3.19, 3.79 A assign (resid 5 and name HA) (resid 5 and name HB) 2.65 0.85 0.85 ! 0.9923 1514:20 Intra 2.42, 2.94 A assign (resid 22 and name HB*) (resid 22 and name HA) 2.65 0.85 0.85 ! 0.0000 1515:20 Intra 2.38, 2.74 A assign (resid 23 and name HN) (resid 22 and name HB*) 3.15 1.35 1.35 ! 0.0000 1516:20 Seq 4.01, 4.25 A assign (resid 100 and name HD*) (resid 22 and name HG1) 3.15 1.35 1.35 ! 0.0000 1517:20 Long 2.51, 4.84 A assign (resid 100 and name HB*) (resid 22 and name HG1) 2.65 0.85 0.85 ! 0.9696 1518:20 Long 2.07, 2.97 A assign (resid 141 and name HN) (resid 141 and name HG1) 3.65 1.85 1.85 ! 0.7515 1520:20 Ambig 4.47, 4.70 A or (resid 140 and name HN) (resid 141 and name HG1) ! 0.1507 1520:20 ----- 5.84, 6.91 A or (resid 144 and name HN) (resid 141 and name HG1) ! 0.0978 1520:20 ----- 6.28, 6.70 A assign (resid 100 and name HD*) (resid 22 and name HD2) 3.15 1.35 1.35 ! 0.9451 1521:20 Long 2.37, 4.09 A assign (resid 100 and name HD*) (resid 22 and name HD1) 3.15 1.35 1.35 ! 0.9193 1522:20 Ambig 2.84, 4.74 A or (resid 100 and name HE*) (resid 22 and name HD1) ! 0.0807 1522:20 ----- 4.26, 6.19 A assign (resid 22 and name HB*) (resid 22 and name HD2) 2.65 0.85 0.85 ! 0.8854 1523:20 Ambig 2.46, 3.41 A or (resid 54 and name HB2) (resid 22 and name HD2) ! 0.0678 1523:20 ----- 3.78, 4.95 A assign (resid 22 and name HB*) (resid 22 and name HD1) 2.65 0.85 0.85 ! 0.9218 1524:20 Intra 2.38, 3.15 A assign (resid 37 and name HG2*) (resid 37 and name HB) 2.30 0.50 0.50 ! 0.5361 1525:20 Ambig 2.38, 2.63 A or (resid 37 and name HD1*) (resid 37 and name HB) ! 0.4498 1525:20 ----- 2.45, 3.06 A assign (resid 8 and name HD2*) (resid 8 and name HB1) 2.65 0.85 0.85 ! 0.4864 1527:20 Ambig 2.44, 3.78 A or (resid 8 and name HD1*) (resid 8 and name HB1) ! 0.4607 1527:20 ----- 2.46, 3.24 A assign (resid 9 and name HN) (resid 8 and name HG) 3.65 1.85 1.85 ! 0.9765 1528:20 Seq 3.48, 4.96 A assign (resid 8 and name HG) (resid 8 and name HD1*) 2.30 0.50 0.50 ! 0.5549 1529:20 Ambig 2.40, 2.63 A or (resid 8 and name HB2) (resid 8 and name HD1*) ! 0.4024 1529:20 ----- 2.53, 3.80 A assign (resid 128 and name HB2) (resid 87 and name HD1*) 3.15 1.35 1.35 ! 0.9975 1530:20 Long 2.12, 3.74 A assign (resid 8 and name HB1) (resid 8 and name HD1*) 2.65 0.85 0.85 ! 0.6269 1531:20 Ambig 2.46, 3.24 A or (resid 136 and name HB*) (resid 8 and name HD1*) ! 0.3192 1531:20 ----- 2.76, 6.41 A assign (resid 87 and name HG) (resid 87 and name HD1*) 2.30 0.50 0.50 ! 0.8977 1532:20 Ambig 2.40, 2.62 A or (resid 33 and name HB1) (resid 87 and name HD1*) ! 0.0515 1532:20 ----- 3.87, 6.23 A assign (resid 87 and name HB2) (resid 87 and name HD1*) 2.65 0.85 0.85 ! 0.9568 1533:20 Intra 2.48, 3.09 A assign (resid 137 and name HN) (resid 8 and name HD1*) 3.65 1.85 1.85 ! 0.5023 1534:20 Ambig 4.09, 6.52 A or (resid 8 and name HN) (resid 8 and name HD1*) ! 0.4688 1534:20 ----- 4.14, 5.09 A assign (resid 9 and name HB1) (resid 9 and name HA) 3.15 1.35 1.35 ! 0.0000 1536:20 Intra 2.46, 2.97 A assign (resid 138 and name HB2) (resid 9 and name HA) 4.15 2.35 2.35 ! 0.6843 1537:20 Ambig 5.34, 6.63 A or (resid 28 and name HB2) (resid 9 and name HA) ! 0.3157 1537:20 ----- 6.07, 6.86 A assign (resid 9 and name HN) (resid 9 and name HA) 3.15 1.35 1.35 ! 0.0000 1538:20 Intra 2.90, 2.91 A assign (resid 8 and name HB2) (resid 138 and name HB1) 3.65 1.85 1.85 ! 0.3176 1539:20 Ambig 4.19, 6.24 A or (resid 7 and name HD*) (resid 9 and name HB2) ! 0.3145 1539:20 ----- 4.20, 5.93 A or (resid 8 and name HG) (resid 138 and name HB1) ! 0.2337 1539:20 ----- 4.41, 5.78 A or (resid 8 and name HG) (resid 9 and name HB2) ! 0.0482 1539:20 ----- 5.74, 7.33 A or (resid 8 and name HB2) (resid 9 and name HB2) ! 0.0421 1539:20 ----- 5.88, 6.11 A assign (resid 10 and name HG1*) (resid 138 and name HB1) 2.65 0.85 0.85 ! 0.9914 1540:20 Long 2.38, 3.62 A assign (resid 136 and name HB*) (resid 138 and name HB1) 3.65 1.85 1.85 ! 0.6873 1541:20 Ambig 3.31, 6.14 A or (resid 137 and name HB*) (resid 9 and name HB2) ! 0.2715 1541:20 ----- 3.87, 6.65 A assign (resid 10 and name HG2*) (resid 9 and name HB1) 4.15 2.35 2.35 ! 0.0000 1543:20 Seq 5.09, 6.60 A assign (resid 26 and name HG2*) (resid 9 and name HB1) 3.65 1.85 1.85 ! 0.9803 1544:20 Long 2.82, 4.10 A assign (resid 10 and name HG1*) (resid 10 and name HB) 2.30 0.50 0.50 ! 0.5966 1546:20 Ambig 2.43, 2.64 A or (resid 133 and name HG2*) (resid 131 and name HB2) ! 0.4034 1546:20 ----- 2.59, 3.64 A assign (resid 10 and name HG2*) (resid 10 and name HB) 2.30 0.50 0.50 ! 0.8126 1547:20 Ambig 2.38, 2.63 A or (resid 23 and name HG1*) (resid 10 and name HB) ! 0.0909 1547:20 ----- 3.43, 4.70 A or (resid 23 and name HG2*) (resid 10 and name HB) ! 0.0390 1547:20 ----- 3.95, 7.05 A assign (resid 130 and name HA) (resid 126 and name HB*) 2.30 0.50 0.50 ! 0.9957 1549:20 Mid 1.95, 3.04 A assign (resid 125 and name HA) (resid 126 and name HB*) 3.15 1.35 1.35 ! 0.0000 1550:20 Seq 4.31, 4.90 A assign (resid 10 and name HB) (resid 10 and name HG1*) 2.30 0.50 0.50 ! 0.0000 1552:20 Intra 2.43, 2.64 A assign (resid 63 and name HN) (resid 63 and name HG2*) 2.65 0.85 0.85 ! 0.9004 1553:20 Ambig 2.09, 3.25 A or (resid 10 and name HN) (resid 10 and name HG1*) ! 0.0996 1553:20 ----- 3.02, 4.00 A assign (resid 95 and name HN) (resid 30 and name HG1*) 3.65 1.85 1.85 ! 0.0000 1554:20 Long 3.57, 4.26 A assign (resid 27 and name HA) (resid 30 and name HG1*) 3.65 1.85 1.85 ! 0.0000 1555:20 Mid 5.18, 6.37 A assign (resid 94 and name HB) (resid 30 and name HG1*) 3.65 1.85 1.85 ! 0.0000 1557:20 Long 5.12, 5.89 A assign (resid 30 and name HB) (resid 30 and name HG1*) 2.30 0.50 0.50 ! 0.0000 1558:20 Intra 2.30, 2.61 A assign (resid 12 and name HA) (resid 12 and name HG2*) 2.30 0.50 0.50 ! 0.0000 1560:20 Intra 2.46, 3.10 A assign (resid 12 and name HB) (resid 12 and name HG2*) 2.30 0.50 0.50 ! 0.9923 1561:20 Intra 2.43, 2.65 A assign (resid 141 and name HE*) (resid 12 and name HG2*) 2.65 0.85 0.85 ! 0.0000 1562:20 Long 2.41, 4.22 A assign (resid 13 and name HG1*) (resid 13 and name HB) 2.30 0.50 0.50 ! 0.0000 1564:20 Intra 2.40, 2.64 A assign (resid 13 and name HB) (resid 13 and name HG1*) 2.30 0.50 0.50 ! 0.9663 1565:20 Intra 2.40, 2.64 A assign (resid 34 and name HB) (resid 34 and name HG1*) 2.30 0.50 0.50 ! 0.5429 1566:20 Ambig 2.34, 2.61 A or (resid 13 and name HB) (resid 13 and name HG2*) ! 0.4571 1566:20 ----- 2.41, 2.64 A assign (resid 13 and name HG1*) (resid 14 and name HA) 3.65 1.85 1.85 ! 0.5477 1567:20 Ambig 6.33, 6.59 A or (resid 144 and name HG1*) (resid 14 and name HA) ! 0.4523 1567:20 ----- 6.53, 7.45 A assign (resid 142 and name HG2*) (resid 14 and name HB*) 3.65 1.85 1.85 ! 0.0000 1568:20 Long 5.61, 6.54 A assign (resid 145 and name HG2*) (resid 14 and name HB*) 2.30 0.50 0.50 ! 0.9537 1569:20 Long 2.21, 4.07 A assign (resid 16 and name HB1) (resid 16 and name HA) 3.15 1.35 1.35 ! 0.0000 1570:20 Intra 2.33, 2.41 A assign (resid 105 and name HG2*) (resid 17 and name HA) 2.30 0.50 0.50 ! 0.9981 1572:20 Long 2.09, 2.96 A assign (resid 17 and name HB1) (resid 17 and name HA) 2.65 0.85 0.85 ! 0.7704 1573:20 Ambig 2.27, 2.30 A or (resid 17 and name HG1) (resid 17 and name HA) ! 0.2296 1573:20 ----- 2.77, 3.21 A assign (resid 105 and name HA) (resid 17 and name HA) 3.65 1.85 1.85 ! 0.0000 1574:20 Long 4.46, 4.72 A assign (resid 19 and name HN) (resid 17 and name HA) 3.15 1.35 1.35 ! 0.9479 1575:20 Mid 3.37, 3.50 A assign (resid 17 and name HG2) (resid 17 and name HB2) 2.65 0.85 0.85 ! 0.9924 1576:20 Intra 2.28, 2.31 A assign (resid 50 and name HA) (resid 50 and name HB) 2.65 0.85 0.85 ! 0.0000 1577:20 Intra 2.46, 2.49 A assign (resid 133 and name HG2*) (resid 131 and name HB1) 3.15 1.35 1.35 ! 0.8043 1578:20 Ambig 2.32, 3.80 A or (resid 105 and name HG2*) (resid 17 and name HB1) ! 0.1782 1578:20 ----- 2.98, 4.41 A assign (resid 75 and name HG2) (resid 75 and name HB1) 2.65 0.85 0.85 ! 0.9261 1579:20 Intra 2.85, 2.92 A assign (resid 18 and name HN) (resid 17 and name HB1) 3.65 1.85 1.85 ! 0.0000 1580:20 Seq 3.60, 3.84 A assign (resid 18 and name HN) (resid 17 and name HB2) 3.65 1.85 1.85 ! 0.9114 1581:20 Ambig 3.73, 3.99 A or (resid 16 and name HD21) (resid 17 and name HB2) ! 0.0886 1581:20 ----- 5.49, 7.74 A assign (resid 109 and name HN) (resid 17 and name HB2) 3.65 1.85 1.85 ! 0.0000 1582:20 Long 3.98, 4.76 A assign (resid 17 and name HD2) (resid 17 and name HG2) 2.65 0.85 0.85 ! 0.9944 1583:20 Intra 2.26, 2.33 A assign (resid 17 and name HD1) (resid 17 and name HG1) 2.65 0.85 0.85 ! 0.7463 1584:20 Ambig 2.29, 2.31 A or (resid 17 and name HA) (resid 17 and name HG1) ! 0.2348 1584:20 ----- 2.77, 3.21 A assign (resid 17 and name HD2) (resid 17 and name HG1) 3.15 1.35 1.35 ! 0.0000 1585:20 Intra 2.65, 2.96 A assign (resid 17 and name HB2) (resid 17 and name HG2) 2.65 0.85 0.85 ! 0.9554 1586:20 Intra 2.28, 2.31 A assign (resid 17 and name HB2) (resid 17 and name HG1) 2.65 0.85 0.85 ! 0.0000 1587:20 Intra 2.72, 2.95 A assign (resid 128 and name HN) (resid 128 and name HB2) 3.15 1.35 1.35 ! 0.0000 1588:20 Intra 3.57, 3.64 A assign (resid 121 and name HB*) (resid 120 and name HD2) 3.15 1.35 1.35 ! 0.8854 1589:20 Ambig 3.82, 4.79 A or (resid 123 and name HB2) (resid 120 and name HD2) ! 0.1146 1589:20 ----- 5.37, 5.61 A assign (resid 105 and name HG2*) (resid 17 and name HD1) 3.15 1.35 1.35 ! 0.7894 1590:20 Ambig 3.32, 4.80 A or (resid 144 and name HG2*) (resid 17 and name HD1) ! 0.1193 1590:20 ----- 4.55, 5.68 A or (resid 117 and name HG2*) (resid 120 and name HD2) ! 0.0779 1590:20 ----- 4.88, 6.05 A assign (resid 16 and name HB1) (resid 17 and name HD2) 3.15 1.35 1.35 ! 0.0000 1591:20 Seq 1.99, 2.93 A assign (resid 16 and name HA) (resid 17 and name HD2) 2.65 0.85 0.85 ! 0.0000 1592:20 Seq 2.14, 2.89 A assign (resid 145 and name HN) (resid 17 and name HD1) 3.65 1.85 1.85 ! 0.7782 1593:20 Ambig 3.52, 4.12 A or (resid 16 and name HN) (resid 17 and name HD1) ! 0.1550 1593:20 ----- 4.61, 4.75 A assign (resid 105 and name HB) (resid 18 and name HA1) 3.65 1.85 1.85 ! 0.0000 1594:20 Long 5.13, 5.29 A assign (resid 104 and name HG2*) (resid 18 and name HA1) 3.65 1.85 1.85 ! 0.0000 1595:20 Long 4.96, 5.93 A assign (resid 105 and name HG2*) (resid 18 and name HA1) 4.15 2.35 2.35 ! 0.0000 1596:20 Long 5.91, 6.91 A assign (resid 18 and name HN) (resid 18 and name HA2) 3.65 1.85 1.85 ! 0.0000 1597:20 Intra 2.32, 2.38 A assign (resid 19 and name HN) (resid 19 and name HB1) 2.65 0.85 0.85 ! 0.0000 1598:20 Intra 2.25, 2.44 A assign (resid 105 and name HN) (resid 20 and name HA) 2.65 0.85 0.85 ! 0.9646 1600:20 Long 2.68, 2.94 A assign (resid 20 and name HB) (resid 20 and name HG2*) 2.30 0.50 0.50 ! 0.9943 1601:20 Intra 2.44, 2.66 A assign (resid 20 and name HA) (resid 20 and name HG2*) 2.30 0.50 0.50 ! 0.9925 1603:20 Intra 2.39, 3.03 A assign (resid 104 and name HA) (resid 20 and name HG2*) 3.15 1.35 1.35 ! 0.9964 1604:20 Long 2.47, 3.84 A assign (resid 52 and name HN) (resid 50 and name HG2*) 2.65 0.85 0.85 ! 0.0000 1605:20 Mid 2.69, 3.66 A assign (resid 50 and name HB) (resid 50 and name HG2*) 2.30 0.50 0.50 ! 0.9760 1606:20 Intra 2.40, 2.64 A assign (resid 72 and name HG2*) (resid 50 and name HG2*) 3.15 1.35 1.35 ! 0.9740 1607:20 Long 3.63, 5.85 A assign (resid 101 and name HA) (resid 53 and name HB) 3.15 1.35 1.35 ! 0.9180 1610:20 Ambig 2.89, 3.10 A or (resid 124 and name HA) (resid 125 and name HB) ! 0.0588 1610:20 ----- 4.57, 4.72 A assign (resid 134 and name HB1) (resid 125 and name HB) 3.65 1.85 1.85 ! 0.8388 1611:20 Ambig 1.83, 2.26 A or (resid 134 and name HD*) (resid 125 and name HB) ! 0.1580 1611:20 ----- 2.42, 4.33 A assign (resid 22 and name HA) (resid 21 and name HG1*) 3.15 1.35 1.35 ! 0.7359 1612:20 Ambig 3.96, 5.10 A or (resid 103 and name HA) (resid 21 and name HG1*) ! 0.2641 1612:20 ----- 4.69, 5.46 A assign (resid 102 and name HA) (resid 21 and name HG1*) 3.65 1.85 1.85 ! 0.7869 1613:20 Ambig 4.63, 5.73 A or (resid 14 and name HA) (resid 21 and name HG1*) ! 0.2131 1613:20 ----- 5.75, 7.10 A assign (resid 48 and name HE*) (resid 21 and name HG1*) 3.15 1.35 1.35 ! 0.9596 1614:20 Long 2.95, 5.94 A assign (resid 21 and name HB) (resid 21 and name HG1*) 2.30 0.50 0.50 ! 0.0000 1615:20 Intra 2.39, 2.61 A assign (resid 103 and name HB1) (resid 21 and name HG1*) 2.65 0.85 0.85 ! 0.0000 1616:20 Long 3.38, 4.03 A assign (resid 103 and name HB2) (resid 21 and name HG1*) 2.30 0.50 0.50 ! 0.0000 1617:20 Long 2.20, 2.80 A assign (resid 142 and name HD1*) (resid 21 and name HG1*) 2.65 0.85 0.85 ! 0.0000 1618:20 Long 2.00, 3.66 A assign (resid 119 and name HB2) (resid 118 and name HG1*) 3.15 1.35 1.35 ! 0.4975 1619:20 Ambig 5.05, 6.06 A or (resid 68 and name HB2) (resid 70 and name HG2*) ! 0.4249 1619:20 ----- 5.18, 6.14 A assign (resid 68 and name HB1) (resid 70 and name HG2*) 3.65 1.85 1.85 ! 0.5558 1621:20 Ambig 5.20, 6.22 A or (resid 19 and name HB1) (resid 21 and name HG2*) ! 0.3016 1621:20 ----- 5.76, 6.88 A or (resid 71 and name HB1) (resid 70 and name HG2*) ! 0.1426 1621:20 ----- 6.53, 7.37 A assign (resid 118 and name HB) (resid 118 and name HG2*) 2.30 0.50 0.50 ! 0.5016 1622:20 Ambig 2.39, 2.64 A or (resid 118 and name HB) (resid 118 and name HG1*) ! 0.4984 1622:20 ----- 2.39, 2.63 A assign (resid 21 and name HN) (resid 21 and name HG2*) 3.15 1.35 1.35 ! 0.0000 1623:20 Intra 4.42, 4.68 A assign (resid 22 and name HN) (resid 22 and name HA) 3.15 1.35 1.35 ! 0.0000 1624:20 Intra 2.92, 2.93 A assign (resid 22 and name HD1) (resid 22 and name HA) 3.15 1.35 1.35 ! 0.8415 1625:20 Ambig 2.08, 4.38 A or (resid 22 and name HG2) (resid 22 and name HA) ! 0.1141 1625:20 ----- 2.90, 3.17 A assign (resid 63 and name HA) (resid 63 and name HG2*) 2.30 0.50 0.50 ! 0.9854 1626:20 Intra 2.33, 2.95 A assign (resid 22 and name HA) (resid 22 and name HG2) 3.15 1.35 1.35 ! 0.0000 1628:20 Intra 2.90, 3.17 A assign (resid 22 and name HB*) (resid 22 and name HE2) 2.30 0.50 0.50 ! 0.9940 1629:20 Intra 1.92, 2.45 A assign (resid 22 and name HG1) (resid 22 and name HE1) 3.15 1.35 1.35 ! 0.0000 1630:20 Intra 3.68, 3.79 A assign (resid 22 and name HA) (resid 22 and name HE2) 3.65 1.85 1.85 ! 0.9849 1631:20 Intra 3.21, 4.59 A assign (resid 22 and name HA) (resid 22 and name HE1) 4.15 2.35 2.35 ! 0.0000 1632:20 Intra 4.37, 5.44 A assign (resid 23 and name HG1*) (resid 23 and name HA) 3.15 1.35 1.35 ! 0.5264 1633:20 Ambig 2.50, 3.18 A or (resid 23 and name HG2*) (resid 23 and name HA) ! 0.4316 1633:20 ----- 2.59, 3.23 A assign (resid 24 and name HD1) (resid 23 and name HA) 3.65 1.85 1.85 ! 0.0000 1634:20 Seq 1.87, 2.13 A assign (resid 24 and name HD2) (resid 23 and name HA) 3.65 1.85 1.85 ! 0.0000 1635:20 Seq 2.25, 2.42 A assign (resid 23 and name HB) (resid 23 and name HA) 3.65 1.85 1.85 ! 0.8987 1636:20 Ambig 2.43, 2.97 A or (resid 24 and name HG1) (resid 23 and name HA) ! 0.0453 1636:20 ----- 4.01, 4.31 A assign (resid 83 and name HN) (resid 83 and name HA) 3.65 1.85 1.85 ! 0.0000 1637:20 Intra 2.84, 2.90 A assign (resid 83 and name HB) (resid 83 and name HA) 3.15 1.35 1.35 ! 0.0000 1638:20 Intra 2.39, 2.45 A assign (resid 83 and name HG2*) (resid 83 and name HA) 2.65 0.85 0.85 ! 0.0000 1639:20 Intra 2.40, 3.61 A assign (resid 23 and name HA) (resid 23 and name HB) 3.15 1.35 1.35 ! 0.9851 1641:20 Intra 2.43, 2.97 A assign (resid 34 and name HG1*) (resid 34 and name HB) 2.30 0.50 0.50 ! 0.7585 1642:20 Ambig 2.34, 2.61 A or (resid 125 and name HG1*) (resid 34 and name HB) ! 0.0847 1642:20 ----- 3.37, 4.57 A or (resid 142 and name HG12) (resid 23 and name HB) ! 0.0746 1642:20 ----- 3.45, 5.16 A or (resid 6 and name HG1*) (resid 34 and name HB) ! 0.0600 1642:20 ----- 3.57, 5.32 A assign (resid 29 and name HB1) (resid 29 and name HG*) 2.30 0.50 0.50 ! 0.0000 1643:20 Intra 2.37, 2.73 A assign (resid 101 and name HN) (resid 23 and name HB) 4.15 2.35 2.35 ! 0.0000 1644:20 Long 3.02, 3.45 A assign (resid 22 and name HA) (resid 23 and name HG2*) 4.15 2.35 2.35 ! 0.5858 1645:20 Ambig 3.58, 4.84 A or (resid 22 and name HA) (resid 23 and name HG1*) ! 0.3929 1645:20 ----- 3.82, 6.42 A assign (resid 23 and name HB) (resid 23 and name HG1*) 2.30 0.50 0.50 ! 0.5252 1646:20 Ambig 2.39, 2.62 A or (resid 23 and name HB) (resid 23 and name HG2*) ! 0.4748 1646:20 ----- 2.43, 2.64 A assign (resid 25 and name HN) (resid 24 and name HB1) 3.15 1.35 1.35 ! 0.9638 1647:20 Seq 3.74, 4.04 A assign (resid 97 and name HG2*) (resid 24 and name HB1) 3.65 1.85 1.85 ! 0.0000 1648:20 Long 2.54, 3.84 A assign (resid 97 and name HG2*) (resid 24 and name HB2) 3.15 1.35 1.35 ! 0.0000 1649:20 Long 2.54, 3.77 A assign (resid 24 and name HD2) (resid 24 and name HG2) 2.65 0.85 0.85 ! 0.0000 1650:20 Intra 2.25, 2.27 A assign (resid 24 and name HD1) (resid 24 and name HG1) 2.30 0.50 0.50 ! 0.8274 1651:20 Ambig 2.24, 2.27 A or (resid 75 and name HD1) (resid 75 and name HG2) ! 0.1726 1651:20 ----- 2.91, 2.97 A assign (resid 24 and name HB1) (resid 24 and name HG1) 2.30 0.50 0.50 ! 0.9936 1653:20 Intra 2.25, 2.29 A assign (resid 24 and name HA) (resid 24 and name HG2) 3.65 1.85 1.85 ! 0.7406 1654:20 Ambig 3.89, 3.96 A or (resid 25 and name HA) (resid 24 and name HG2) ! 0.1440 1654:20 ----- 5.12, 5.36 A or (resid 100 and name HA) (resid 24 and name HG2) ! 0.0598 1654:20 ----- 5.92, 6.16 A assign (resid 24 and name HB1) (resid 24 and name HG2) 2.65 0.85 0.85 ! 0.0000 1655:20 Intra 2.83, 2.95 A assign (resid 97 and name HD1*) (resid 24 and name HG2) 3.15 1.35 1.35 ! 0.4397 1656:20 Ambig 3.67, 5.73 A or (resid 97 and name HG12) (resid 24 and name HG2) ! 0.3261 1656:20 ----- 3.86, 4.69 A or (resid 23 and name HG2*) (resid 24 and name HG2) ! 0.1187 1656:20 ----- 4.56, 7.22 A or (resid 23 and name HG1*) (resid 24 and name HG2) ! 0.1022 1656:20 ----- 4.68, 5.72 A assign (resid 97 and name HG12) (resid 24 and name HG1) 3.15 1.35 1.35 ! 0.4632 1657:20 Ambig 3.91, 4.50 A or (resid 97 and name HD1*) (resid 24 and name HG1) ! 0.2806 1657:20 ----- 4.25, 5.87 A or (resid 118 and name HG1*) (resid 120 and name HG*) ! 0.1145 1657:20 ----- 4.94, 7.06 A or (resid 23 and name HG2*) (resid 24 and name HG1) ! 0.0830 1657:20 ----- 5.21, 7.33 A assign (resid 100 and name HD*) (resid 24 and name HG1) 3.65 1.85 1.85 ! 0.6299 1658:20 Ambig 3.16, 6.18 A or (resid 100 and name HE*) (resid 24 and name HG1) ! 0.3701 1658:20 ----- 3.45, 6.39 A assign (resid 100 and name HE*) (resid 24 and name HG2) 3.65 1.85 1.85 ! 0.5003 1659:20 Ambig 4.64, 7.35 A or (resid 100 and name HD*) (resid 24 and name HG2) ! 0.4997 1659:20 ----- 4.64, 7.12 A assign (resid 74 and name HG2*) (resid 75 and name HD2) 3.15 1.35 1.35 ! 0.9993 1660:20 Seq 2.06, 2.84 A assign (resid 75 and name HB1) (resid 75 and name HD2) 3.65 1.85 1.85 ! 0.0000 1661:20 Intra 3.93, 4.02 A assign (resid 75 and name HB2) (resid 75 and name HD2) 3.65 1.85 1.85 ! 0.0000 1662:20 Intra 3.72, 3.91 A assign (resid 22 and name HD2) (resid 24 and name HD1) 3.65 1.85 1.85 ! 0.7416 1663:20 Ambig 4.67, 5.79 A or (resid 45 and name HB*) (resid 75 and name HD1) ! 0.2584 1663:20 ----- 5.56, 6.48 A assign (resid 32 and name HG2*) (resid 33 and name HD1) 3.15 1.35 1.35 ! 0.0000 1664:20 Seq 3.39, 4.28 A assign (resid 100 and name HD*) (resid 24 and name HD1) 3.65 1.85 1.85 ! 0.7369 1665:20 Ambig 3.77, 6.43 A or (resid 100 and name HE*) (resid 24 and name HD1) ! 0.2631 1665:20 ----- 4.47, 7.44 A assign (resid 25 and name HA) (resid 25 and name HB) 3.15 1.35 1.35 ! 0.8279 1667:20 Ambig 3.04, 3.05 A or (resid 24 and name HA) (resid 25 and name HB) ! 0.0711 1667:20 ----- 4.58, 4.65 A or (resid 26 and name HA) (resid 25 and name HB) ! 0.0533 1667:20 ----- 4.81, 4.87 A assign (resid 99 and name HN) (resid 25 and name HB) 3.15 1.35 1.35 ! 0.0000 1668:20 Long 2.20, 2.32 A assign (resid 61 and name HN) (resid 61 and name HB2) 2.65 0.85 0.85 ! 0.6308 1669:20 Ambig 2.27, 2.63 A or (resid 25 and name HN) (resid 25 and name HB) ! 0.3687 1669:20 ----- 2.48, 2.52 A assign (resid 98 and name HN) (resid 25 and name HB) 3.15 1.35 1.35 ! 0.8090 1670:20 Ambig 3.10, 3.29 A or (resid 26 and name HN) (resid 25 and name HB) ! 0.1452 1670:20 ----- 4.13, 4.20 A assign (resid 98 and name HB2) (resid 25 and name HG1*) 2.65 0.85 0.85 ! 0.7026 1671:20 Ambig 3.54, 4.60 A or (resid 8 and name HB1) (resid 25 and name HG1*) ! 0.2704 1671:20 ----- 4.15, 5.36 A assign (resid 25 and name HB) (resid 25 and name HG1*) 2.30 0.50 0.50 ! 0.9622 1673:20 Intra 2.42, 2.63 A assign (resid 101 and name HA) (resid 53 and name HG1*) 2.65 0.85 0.85 ! 0.9345 1674:20 Long 2.02, 3.19 A assign (resid 8 and name HD1*) (resid 27 and name HA) 2.65 0.85 0.85 ! 0.4291 1677:20 Ambig 2.39, 4.13 A or (resid 27 and name HG11) (resid 27 and name HA) ! 0.3034 1677:20 ----- 2.53, 2.56 A or (resid 8 and name HD2*) (resid 27 and name HA) ! 0.2229 1677:20 ----- 2.66, 4.91 A assign (resid 27 and name HB) (resid 27 and name HA) 2.65 0.85 0.85 ! 0.9988 1678:20 Intra 2.44, 2.46 A assign (resid 27 and name HD1*) (resid 27 and name HA) 3.15 1.35 1.35 ! 0.5978 1679:20 Ambig 4.37, 4.67 A or (resid 25 and name HG1*) (resid 27 and name HA) ! 0.4022 1679:20 ----- 4.67, 5.89 A assign (resid 27 and name HG2*) (resid 27 and name HB) 2.30 0.50 0.50 ! 0.2977 1680:20 Ambig 2.40, 2.62 A or (resid 8 and name HD1*) (resid 27 and name HB) ! 0.2961 1680:20 ----- 2.40, 3.94 A or (resid 27 and name HG11) (resid 27 and name HB) ! 0.2543 1680:20 ----- 2.46, 2.47 A or (resid 8 and name HD2*) (resid 27 and name HB) ! 0.1437 1680:20 ----- 2.71, 4.96 A assign (resid 80 and name HG1*) (resid 80 and name HB) 2.30 0.50 0.50 ! 0.4924 1681:20 Ambig 2.44, 2.74 A or (resid 80 and name HD1*) (resid 80 and name HB) ! 0.3843 1681:20 ----- 2.54, 3.16 A or (resid 98 and name HD2*) (resid 27 and name HB) ! 0.1170 1681:20 ----- 3.10, 4.50 A assign (resid 80 and name HG2*) (resid 80 and name HB) 2.30 0.50 0.50 ! 0.0000 1682:20 Intra 2.42, 2.64 A assign (resid 27 and name HA) (resid 27 and name HB) 3.15 1.35 1.35 ! 0.9986 1684:20 Intra 2.44, 2.46 A assign (resid 39 and name HG*) (resid 80 and name HB) 2.65 0.85 0.85 ! 0.9979 1685:20 Long 2.08, 2.36 A assign (resid 27 and name HB) (resid 27 and name HG11) 2.30 0.50 0.50 ! 0.9876 1686:20 Intra 2.46, 2.47 A assign (resid 27 and name HA) (resid 27 and name HG11) 3.65 1.85 1.85 ! 0.9985 1687:20 Intra 2.53, 2.56 A assign (resid 28 and name HN) (resid 27 and name HG11) 3.65 1.85 1.85 ! 0.0000 1688:20 Seq 2.82, 2.93 A assign (resid 27 and name HB) (resid 27 and name HD1*) 2.30 0.50 0.50 ! 0.4604 1690:20 Ambig 2.58, 3.17 A or (resid 133 and name HB) (resid 133 and name HD1*) ! 0.4393 1690:20 ----- 2.60, 3.22 A or (resid 134 and name HB1) (resid 133 and name HD1*) ! 0.0676 1690:20 ----- 3.56, 6.49 A assign (resid 95 and name HB1) (resid 27 and name HG2*) 3.65 1.85 1.85 ! 0.0000 1691:20 Long 3.60, 5.31 A assign (resid 95 and name HB2) (resid 27 and name HG2*) 3.65 1.85 1.85 ! 0.0000 1692:20 Long 2.57, 4.47 A assign (resid 28 and name HA) (resid 28 and name HB2) 2.65 0.85 0.85 ! 0.0000 1693:20 Intra 2.99, 3.02 A assign (resid 30 and name HN) (resid 28 and name HB2) 4.15 2.35 2.35 ! 0.0000 1694:20 Mid 5.17, 5.36 A assign (resid 29 and name HG*) (resid 28 and name HB2) 3.65 1.85 1.85 ! 0.0000 1695:20 Seq 3.05, 4.30 A assign (resid 30 and name HB) (resid 29 and name HA) 3.65 1.85 1.85 ! 0.0000 1697:20 Seq 5.37, 5.50 A assign (resid 30 and name HG1*) (resid 29 and name HA) 3.65 1.85 1.85 ! 0.0000 1698:20 Seq 4.70, 5.68 A assign (resid 30 and name HB) (resid 30 and name HA) 2.65 0.85 0.85 ! 0.9984 1701:20 Intra 2.38, 2.42 A assign (resid 6 and name HG1*) (resid 30 and name HA) 2.65 0.85 0.85 ! 0.9700 1702:20 Long 2.85, 4.35 A assign (resid 30 and name HG1*) (resid 30 and name HB) 2.30 0.50 0.50 ! 0.5684 1710:20 Ambig 2.30, 2.61 A or (resid 30 and name HG2*) (resid 30 and name HB) ! 0.4316 1710:20 ----- 2.41, 2.63 A assign (resid 30 and name HA) (resid 30 and name HB) 2.65 0.85 0.85 ! 0.9976 1711:20 Intra 2.38, 2.42 A assign (resid 94 and name HA) (resid 30 and name HB) 4.15 2.35 2.35 ! 0.0000 1712:20 Long 5.90, 6.31 A assign (resid 33 and name HG1) (resid 30 and name HG2*) 4.15 2.35 2.35 ! 0.5775 1714:20 Ambig 5.73, 7.30 A or (resid 29 and name HB2) (resid 30 and name HG2*) ! 0.2462 1714:20 ----- 6.61, 7.44 A or (resid 94 and name HB) (resid 30 and name HG2*) ! 0.1763 1714:20 ----- 6.98, 7.97 A assign (resid 30 and name HB) (resid 30 and name HG2*) 2.30 0.50 0.50 ! 0.9948 1715:20 Intra 2.41, 2.63 A assign (resid 34 and name HN) (resid 30 and name HG2*) 3.65 1.85 1.85 ! 0.0000 1716:20 Mid 3.19, 4.00 A assign (resid 71 and name HN) (resid 79 and name HB2) 3.65 1.85 1.85 ! 0.0000 1718:20 Long 3.15, 3.36 A assign (resid 41 and name HN) (resid 79 and name HB2) 4.15 2.35 2.35 ! 0.0000 1719:20 Long 6.04, 6.22 A assign (resid 80 and name HN) (resid 79 and name HB2) 3.65 1.85 1.85 ! 0.0000 1720:20 Seq 4.24, 4.31 A assign (resid 71 and name HB1) (resid 79 and name HB2) 2.65 0.85 0.85 ! 0.0000 1721:20 Long 1.85, 2.07 A assign (resid 33 and name HG2) (resid 33 and name HA) 3.15 1.35 1.35 ! 0.0000 1722:20 Intra 3.85, 3.91 A assign (resid 33 and name HB1) (resid 33 and name HA) 3.65 1.85 1.85 ! 0.0000 1723:20 Intra 2.26, 2.29 A assign (resid 74 and name HA) (resid 75 and name HD2) 2.65 0.85 0.85 ! 0.0000 1724:20 Seq 1.97, 2.01 A assign (resid 33 and name HA) (resid 34 and name HB) 3.65 1.85 1.85 ! 0.8379 1732:20 Ambig 4.45, 4.54 A or (resid 6 and name HA) (resid 34 and name HB) ! 0.0899 1732:20 ----- 6.46, 7.53 A assign (resid 92 and name HB) (resid 34 and name HG1*) 3.15 1.35 1.35 ! 0.9240 1733:20 Long 2.02, 2.76 A assign (resid 83 and name HA) (resid 36 and name HA) 3.65 1.85 1.85 ! 0.0000 1734:20 Long 2.44, 2.75 A assign (resid 104 and name HN) (resid 104 and name HG12) 3.15 1.35 1.35 ! 0.0000 1735:20 Intra 3.49, 3.66 A assign (resid 105 and name HN) (resid 104 and name HG12) 3.15 1.35 1.35 ! 0.8664 1736:20 Ambig 4.34, 4.59 A or (resid 103 and name HN) (resid 104 and name HG12) ! 0.1336 1736:20 ----- 5.93, 6.08 A assign (resid 37 and name HN) (resid 36 and name HG) 3.65 1.85 1.85 ! 0.0000 1737:20 Seq 3.81, 4.57 A assign (resid 36 and name HA) (resid 36 and name HG) 3.15 1.35 1.35 ! 0.7122 1738:20 Ambig 2.62, 2.98 A or (resid 20 and name HA) (resid 104 and name HG12) ! 0.2713 1738:20 ----- 3.08, 3.72 A assign (resid 126 and name HN) (resid 36 and name HD1*) 3.15 1.35 1.35 ! 0.6985 1739:20 Ambig 3.03, 5.25 A or (resid 38 and name HN) (resid 36 and name HD1*) ! 0.3015 1739:20 ----- 3.49, 7.07 A assign (resid 125 and name HN) (resid 123 and name HD2*) 4.15 2.35 2.35 ! 0.7773 1740:20 Ambig 3.86, 5.13 A or (resid 125 and name HN) (resid 36 and name HD2*) ! 0.2227 1740:20 ----- 4.75, 7.70 A assign (resid 36 and name HN) (resid 36 and name HD2*) 3.65 1.85 1.85 ! 0.0000 1741:20 Intra 3.94, 5.15 A assign (resid 37 and name HN) (resid 37 and name HA) 3.65 1.85 1.85 ! 0.0000 1744:20 Intra 2.93, 2.94 A assign (resid 82 and name HB1) (resid 37 and name HB) 3.15 1.35 1.35 ! 0.0000 1746:20 Long 3.61, 3.78 A assign (resid 37 and name HA) (resid 37 and name HB) 3.65 1.85 1.85 ! 0.9373 1748:20 Intra 3.02, 3.04 A assign (resid 8 and name HN) (resid 8 and name HB2) 3.65 1.85 1.85 ! 0.8082 1749:20 Ambig 2.33, 2.57 A or (resid 137 and name HN) (resid 8 and name HB2) ! 0.1855 1749:20 ----- 2.97, 4.12 A assign (resid 37 and name HN) (resid 37 and name HB) 3.65 1.85 1.85 ! 0.0000 1750:20 Intra 2.53, 2.70 A assign (resid 92 and name HD1*) (resid 37 and name HD1*) 2.65 0.85 0.85 ! 0.0000 1751:20 Long 2.55, 4.62 A assign (resid 34 and name HG2*) (resid 37 and name HD1*) 2.30 0.50 0.50 ! 0.5444 1752:20 Ambig 2.28, 4.13 A or (resid 37 and name HG11) (resid 37 and name HD1*) ! 0.4487 1752:20 ----- 2.36, 2.62 A assign (resid 82 and name HB1) (resid 37 and name HD1*) 3.65 1.85 1.85 ! 0.0000 1753:20 Long 2.84, 4.28 A assign (resid 37 and name HG12) (resid 37 and name HD1*) 2.30 0.50 0.50 ! 0.0000 1754:20 Intra 2.39, 2.62 A assign (resid 37 and name HA) (resid 37 and name HD1*) 3.65 1.85 1.85 ! 0.0000 1755:20 Intra 3.51, 4.45 A assign (resid 82 and name HB2) (resid 37 and name HD1*) 2.65 0.85 0.85 ! 0.0000 1756:20 Long 2.05, 3.34 A assign (resid 38 and name HB2) (resid 38 and name HA) 2.65 0.85 0.85 ! 0.0000 1758:20 Intra 2.44, 2.52 A assign (resid 38 and name HB1) (resid 38 and name HA) 3.15 1.35 1.35 ! 0.0000 1759:20 Intra 2.62, 3.01 A assign (resid 37 and name HG2*) (resid 38 and name HA) 3.15 1.35 1.35 ! 0.8302 1760:20 Ambig 3.35, 4.64 A or (resid 39 and name HE*) (resid 38 and name HA) ! 0.0661 1760:20 ----- 5.10, 7.06 A or (resid 124 and name HD1*) (resid 38 and name HA) ! 0.0560 1760:20 ----- 5.25, 6.84 A assign (resid 38 and name HN) (resid 38 and name HA) 3.65 1.85 1.85 ! 0.9957 1761:20 Intra 2.92, 2.93 A assign (resid 39 and name HA) (resid 39 and name HG*) 3.15 1.35 1.35 ! 0.9127 1764:20 Ambig 3.70, 3.78 A or (resid 41 and name HA) (resid 39 and name HG*) ! 0.0873 1764:20 ----- 5.47, 6.56 A assign (resid 39 and name HN) (resid 39 and name HG*) 2.65 0.85 0.85 ! 0.0000 1765:20 Intra 2.47, 3.04 A assign (resid 39 and name HB*) (resid 39 and name HG*) 2.30 0.50 0.50 ! 0.9821 1766:20 Intra 2.37, 2.72 A assign (resid 38 and name HA) (resid 39 and name HG*) 3.65 1.85 1.85 ! 0.7003 1767:20 Ambig 3.59, 4.52 A or (resid 81 and name HA) (resid 39 and name HG*) ! 0.2997 1767:20 ----- 4.14, 5.12 A assign (resid 80 and name HB) (resid 39 and name HG*) 2.30 0.50 0.50 ! 0.9971 1768:20 Long 2.08, 2.36 A assign (resid 80 and name HD1*) (resid 39 and name HG*) 2.65 0.85 0.85 ! 0.6751 1769:20 Ambig 2.80, 4.45 A or (resid 80 and name HG1*) (resid 39 and name HG*) ! 0.2784 1769:20 ----- 3.24, 4.68 A assign (resid 41 and name HD1*) (resid 39 and name HG*) 2.30 0.50 0.50 ! 0.6753 1770:20 Ambig 2.03, 4.43 A or (resid 39 and name HE*) (resid 39 and name HG*) ! 0.1456 1770:20 ----- 2.62, 3.74 A or (resid 41 and name HG11) (resid 39 and name HG*) ! 0.0963 1770:20 ----- 2.81, 4.37 A or (resid 37 and name HG2*) (resid 39 and name HG*) ! 0.0595 1770:20 ----- 3.04, 5.20 A assign (resid 80 and name HG2*) (resid 39 and name HG*) 3.15 1.35 1.35 ! 0.0000 1771:20 Long 3.11, 4.30 A assign (resid 40 and name HN) (resid 40 and name HA) 3.15 1.35 1.35 ! 0.8598 1772:20 Ambig 2.91, 2.94 A or (resid 78 and name HN) (resid 40 and name HA) ! 0.1402 1772:20 ----- 3.93, 4.32 A assign (resid 80 and name HN) (resid 40 and name HA) 3.15 1.35 1.35 ! 0.0000 1773:20 Long 2.77, 3.09 A assign (resid 41 and name HG12) (resid 40 and name HA) 3.65 1.85 1.85 ! 0.4895 1774:20 Ambig 4.76, 5.20 A or (resid 77 and name HD*) (resid 40 and name HA) ! 0.4459 1774:20 ----- 4.84, 6.81 A assign (resid 78 and name HB) (resid 40 and name HA) 3.65 1.85 1.85 ! 0.9609 1775:20 Long 4.28, 4.57 A assign (resid 40 and name HB1) (resid 40 and name HA) 2.65 0.85 0.85 ! 0.0000 1776:20 Intra 3.02, 3.03 A assign (resid 40 and name HB2) (resid 40 and name HA) 3.15 1.35 1.35 ! 0.0000 1777:20 Intra 2.43, 2.49 A assign (resid 41 and name HD1*) (resid 40 and name HA) 2.65 0.85 0.85 ! 0.6947 1778:20 Ambig 2.75, 4.99 A or (resid 41 and name HG11) (resid 40 and name HA) ! 0.2340 1778:20 ----- 3.30, 3.97 A assign (resid 41 and name HA) (resid 41 and name HB) 3.65 1.85 1.85 ! 0.9850 1779:20 Intra 3.02, 3.03 A assign (resid 41 and name HG2*) (resid 41 and name HB) 2.30 0.50 0.50 ! 0.3532 1780:20 Ambig 2.41, 2.64 A or (resid 41 and name HD1*) (resid 41 and name HB) ! 0.3140 1780:20 ----- 2.45, 3.07 A or (resid 41 and name HG11) (resid 41 and name HB) ! 0.2862 1780:20 ----- 2.49, 2.71 A assign (resid 78 and name HB) (resid 41 and name HB) 2.65 0.85 0.85 ! 0.9983 1781:20 Long 2.00, 2.16 A assign (resid 41 and name HN) (resid 41 and name HG12) 3.15 1.35 1.35 ! 0.6555 1782:20 Ambig 3.55, 3.88 A or (resid 42 and name HN) (resid 41 and name HG12) ! 0.1572 1782:20 ----- 4.51, 4.90 A or (resid 41 and name HN) (resid 77 and name HD*) ! 0.1390 1782:20 ----- 4.60, 6.69 A assign (resid 41 and name HA) (resid 41 and name HG12) 3.15 1.35 1.35 ! 0.9915 1783:20 Intra 2.60, 3.08 A assign (resid 40 and name HA) (resid 41 and name HD1*) 3.65 1.85 1.85 ! 0.0000 1784:20 Seq 2.75, 4.99 A assign (resid 103 and name HZ) (resid 41 and name HG2*) 3.65 1.85 1.85 ! 0.0000 1786:20 Long 2.65, 3.98 A assign (resid 78 and name HN) (resid 41 and name HG2*) 3.65 1.85 1.85 ! 0.9347 1787:20 Long 4.27, 5.22 A assign (resid 44 and name HN) (resid 43 and name HB*) 3.15 1.35 1.35 ! 0.9000 1788:20 Ambig 2.17, 3.03 A or (resid 21 and name HN) (resid 103 and name HB2) ! 0.0588 1788:20 ----- 3.41, 3.66 A assign (resid 43 and name HE*) (resid 43 and name HB*) 3.65 1.85 1.85 ! 0.0000 1789:20 Intra 4.54, 5.06 A assign (resid 41 and name HG2*) (resid 43 and name HB*) 2.65 0.85 0.85 ! 0.0000 1791:20 Mid 2.70, 4.58 A assign (resid 44 and name HN) (resid 44 and name HB2) 3.65 1.85 1.85 ! 0.0000 1792:20 Intra 2.36, 2.63 A assign (resid 44 and name HN) (resid 44 and name HB1) 3.15 1.35 1.35 ! 0.0000 1793:20 Intra 2.45, 2.78 A assign (resid 47 and name HB*) (resid 44 and name HB2) 3.65 1.85 1.85 ! 0.9950 1794:20 Mid 1.94, 3.96 A assign (resid 47 and name HB*) (resid 44 and name HB1) 3.65 1.85 1.85 ! 0.9869 1795:20 Mid 2.02, 2.88 A assign (resid 32 and name HG2*) (resid 129 and name HB2) 3.65 1.85 1.85 ! 0.7811 1796:20 Ambig 3.81, 5.69 A or (resid 131 and name HG1) (resid 129 and name HB2) ! 0.1843 1796:20 ----- 4.84, 5.36 A assign (resid 46 and name HB1) (resid 46 and name HA) 2.30 0.50 0.50 ! 0.5699 1797:20 Ambig 2.31, 2.52 A or (resid 46 and name HB2) (resid 46 and name HA) ! 0.4231 1797:20 ----- 2.43, 2.89 A assign (resid 46 and name HA) (resid 46 and name HB1) 2.65 0.85 0.85 ! 0.9978 1799:20 Intra 2.31, 2.52 A assign (resid 46 and name HA) (resid 46 and name HB2) 2.65 0.85 0.85 ! 0.0000 1800:20 Intra 2.43, 2.89 A assign (resid 46 and name HN) (resid 47 and name HA) 3.65 1.85 1.85 ! 0.8929 1801:20 Ambig 4.78, 4.88 A or (resid 45 and name HN) (resid 47 and name HA) ! 0.1071 1801:20 ----- 6.80, 7.03 A assign (resid 47 and name HD2) (resid 47 and name HB*) 3.15 1.35 1.35 ! 0.0000 1802:20 Intra 2.29, 2.74 A assign (resid 47 and name HD1) (resid 47 and name HB*) 2.65 0.85 0.85 ! 0.5567 1803:20 Ambig 2.48, 3.43 A or (resid 109 and name HB*) (resid 47 and name HB*) ! 0.4433 1803:20 ----- 2.58, 4.94 A assign (resid 47 and name HG2) (resid 47 and name HB*) 2.65 0.85 0.85 ! 0.8570 1804:20 Ambig 2.34, 2.72 A or (resid 144 and name HG2*) (resid 47 and name HB*) ! 0.0897 1804:20 ----- 3.41, 6.47 A assign (resid 47 and name HG1) (resid 47 and name HB*) 2.65 0.85 0.85 ! 0.0000 1805:20 Intra 2.34, 2.70 A assign (resid 47 and name HE*) (resid 47 and name HB*) 3.15 1.35 1.35 ! 0.9949 1806:20 Intra 1.98, 3.61 A assign (resid 47 and name HA) (resid 47 and name HB*) 2.65 0.85 0.85 ! 0.0000 1807:20 Intra 2.45, 2.76 A assign (resid 48 and name HN) (resid 47 and name HB*) 3.65 1.85 1.85 ! 0.8819 1808:20 Ambig 2.63, 3.36 A or (resid 110 and name HN) (resid 47 and name HB*) ! 0.1181 1808:20 ----- 3.67, 4.91 A assign (resid 47 and name HA) (resid 47 and name HG2) 3.15 1.35 1.35 ! 0.9896 1809:20 Intra 2.58, 3.00 A assign (resid 47 and name HB*) (resid 47 and name HG2) 2.65 0.85 0.85 ! 0.9970 1810:20 Intra 2.34, 2.72 A assign (resid 47 and name HE*) (resid 47 and name HG2) 2.65 0.85 0.85 ! 0.9706 1811:20 Intra 2.55, 3.54 A assign (resid 109 and name HA) (resid 47 and name HG2) 3.65 1.85 1.85 ! 0.9581 1812:20 Long 2.35, 4.06 A assign (resid 47 and name HN) (resid 47 and name HG2) 3.15 1.35 1.35 ! 0.0000 1813:20 Intra 4.00, 4.44 A assign (resid 48 and name HN) (resid 47 and name HG2) 3.65 1.85 1.85 ! 0.0000 1814:20 Seq 3.96, 4.30 A assign (resid 47 and name HE*) (resid 47 and name HG1) 2.65 0.85 0.85 ! 0.9620 1815:20 Intra 2.38, 2.82 A assign (resid 59 and name HD1*) (resid 59 and name HG) 2.30 0.50 0.50 ! 0.0000 1816:20 Intra 2.36, 2.61 A assign (resid 141 and name HE*) (resid 141 and name HD1) 2.65 0.85 0.85 ! 0.9614 1817:20 Intra 2.32, 2.59 A assign (resid 47 and name HB*) (resid 47 and name HD1) 2.65 0.85 0.85 ! 0.9918 1818:20 Intra 2.48, 3.43 A assign (resid 12 and name HB) (resid 141 and name HE*) 3.15 1.35 1.35 ! 0.6558 1819:20 Ambig 3.74, 5.22 A or (resid 47 and name HA) (resid 47 and name HE*) ! 0.3145 1819:20 ----- 4.23, 4.81 A assign (resid 48 and name HN) (resid 48 and name HA) 3.65 1.85 1.85 ! 0.0000 1821:20 Intra 2.92, 2.94 A assign (resid 48 and name HA) (resid 48 and name HB2) 3.65 1.85 1.85 ! 0.0000 1822:20 Intra 3.01, 3.02 A assign (resid 48 and name HA) (resid 48 and name HB1) 3.65 1.85 1.85 ! 0.0000 1823:20 Intra 2.40, 2.44 A assign (resid 48 and name HD*) (resid 48 and name HB2) 3.65 1.85 1.85 ! 0.8534 1824:20 Ambig 2.25, 3.00 A or (resid 103 and name HD*) (resid 48 and name HB2) ! 0.1466 1824:20 ----- 3.02, 4.81 A assign (resid 43 and name HD*) (resid 48 and name HB2) 3.15 1.35 1.35 ! 0.9940 1825:20 Long 1.92, 4.07 A assign (resid 48 and name HN) (resid 48 and name HB2) 3.65 1.85 1.85 ! 0.0000 1826:20 Intra 2.64, 2.73 A assign (resid 48 and name HN) (resid 48 and name HB1) 3.65 1.85 1.85 ! 0.0000 1827:20 Intra 3.75, 3.81 A assign (resid 43 and name HD*) (resid 48 and name HB1) 3.15 1.35 1.35 ! 0.9582 1828:20 Long 3.41, 5.38 A assign (resid 103 and name HD*) (resid 48 and name HB1) 3.65 1.85 1.85 ! 0.6242 1829:20 Ambig 2.30, 3.83 A or (resid 48 and name HD*) (resid 48 and name HB1) ! 0.3758 1829:20 ----- 2.50, 3.06 A assign (resid 49 and name HN) (resid 48 and name HB2) 3.65 1.85 1.85 ! 0.0000 1830:20 Seq 3.44, 3.84 A assign (resid 49 and name HN) (resid 48 and name HB1) 3.65 1.85 1.85 ! 0.0000 1831:20 Seq 2.45, 2.83 A assign (resid 104 and name HN) (resid 49 and name HB) 3.15 1.35 1.35 ! 0.9979 1832:20 Long 2.56, 2.90 A assign (resid 50 and name HG1*) (resid 50 and name HA) 2.65 0.85 0.85 ! 0.0000 1833:20 Intra 3.74, 3.95 A assign (resid 53 and name HG1*) (resid 50 and name HA) 3.65 1.85 1.85 ! 0.4492 1834:20 Ambig 5.99, 6.75 A or (resid 78 and name HG2*) (resid 50 and name HA) ! 0.3241 1834:20 ----- 6.33, 7.53 A or (resid 21 and name HG1*) (resid 50 and name HA) ! 0.2267 1834:20 ----- 6.71, 7.54 A assign (resid 103 and name HB1) (resid 50 and name HA) 3.65 1.85 1.85 ! 0.0000 1835:20 Long 3.71, 4.01 A assign (resid 103 and name HB2) (resid 50 and name HA) 3.65 1.85 1.85 ! 0.8661 1836:20 Ambig 4.72, 4.90 A or (resid 52 and name HB2) (resid 50 and name HA) ! 0.0699 1836:20 ----- 7.18, 7.88 A assign (resid 50 and name HB) (resid 50 and name HA) 2.65 0.85 0.85 ! 0.0000 1837:20 Intra 2.46, 2.49 A assign (resid 103 and name HA) (resid 50 and name HA) 2.65 0.85 0.85 ! 0.9994 1838:20 Long 2.14, 2.38 A assign (resid 103 and name HE*) (resid 50 and name HA) 3.65 1.85 1.85 ! 0.0000 1839:20 Long 3.54, 4.97 A assign (resid 50 and name HG1*) (resid 50 and name HB) 2.30 0.50 0.50 ! 0.9864 1840:20 Intra 2.38, 2.63 A assign (resid 78 and name HD1*) (resid 50 and name HB) 2.30 0.50 0.50 ! 0.6086 1842:20 Ambig 2.22, 3.42 A or (resid 50 and name HG2*) (resid 50 and name HB) ! 0.3901 1842:20 ----- 2.40, 2.64 A assign (resid 103 and name HZ) (resid 50 and name HG1*) 3.65 1.85 1.85 ! 0.0000 1844:20 Long 5.36, 6.27 A assign (resid 52 and name HN) (resid 50 and name HG1*) 3.65 1.85 1.85 ! 0.0000 1845:20 Mid 4.77, 5.76 A assign (resid 50 and name HB) (resid 50 and name HG1*) 2.30 0.50 0.50 ! 0.9759 1846:20 Intra 2.38, 2.63 A assign (resid 43 and name HB*) (resid 50 and name HG1*) 4.15 2.35 2.35 ! 0.0000 1847:20 Long 6.47, 7.94 A assign (resid 103 and name HD*) (resid 50 and name HG2*) 3.65 1.85 1.85 ! 0.0000 1848:20 Long 3.60, 5.42 A assign (resid 53 and name HN) (resid 50 and name HG2*) 3.65 1.85 1.85 ! 0.0000 1849:20 Mid 4.68, 5.55 A assign (resid 51 and name HG*) (resid 51 and name HA) 2.65 0.85 0.85 ! 0.9085 1850:20 Ambig 2.40, 2.93 A or (resid 49 and name HG2*) (resid 51 and name HA) ! 0.0915 1850:20 ----- 3.52, 5.03 A assign (resid 51 and name HD2) (resid 51 and name HA) 3.65 1.85 1.85 ! 0.0000 1851:20 Intra 1.96, 3.73 A assign (resid 51 and name HG*) (resid 51 and name HB*) 2.30 0.50 0.50 ! 0.9938 1852:20 Intra 2.32, 2.66 A assign (resid 77 and name HE*) (resid 77 and name HG2) 3.15 1.35 1.35 ! 0.9957 1853:20 Intra 2.37, 3.22 A assign (resid 51 and name HE*) (resid 51 and name HG*) 3.15 1.35 1.35 ! 0.0000 1854:20 Intra 2.42, 3.49 A assign (resid 104 and name HD1*) (resid 51 and name HG*) 2.30 0.50 0.50 ! 0.9785 1855:20 Long 2.60, 3.92 A assign (resid 51 and name HN) (resid 51 and name HG*) 3.65 1.85 1.85 ! 0.0000 1856:20 Intra 2.26, 3.23 A assign (resid 78 and name HN) (resid 77 and name HG2) 3.65 1.85 1.85 ! 0.0000 1857:20 Seq 3.40, 3.76 A assign (resid 136 and name HN) (resid 134 and name HG*) 3.65 1.85 1.85 ! 0.9517 1858:20 Mid 3.03, 5.40 A assign (resid 51 and name HE*) (resid 51 and name HD1) 2.30 0.50 0.50 ! 0.9900 1859:20 Intra 2.38, 2.67 A assign (resid 51 and name HE*) (resid 51 and name HD2) 2.30 0.50 0.50 ! 0.0000 1860:20 Intra 2.34, 2.63 A assign (resid 51 and name HG*) (resid 51 and name HE*) 3.15 1.35 1.35 ! 0.9960 1861:20 Intra 2.42, 3.49 A assign (resid 51 and name HD2) (resid 51 and name HE*) 2.30 0.50 0.50 ! 0.0000 1862:20 Intra 2.34, 2.63 A assign (resid 50 and name HG2*) (resid 52 and name HA) 3.65 1.85 1.85 ! 0.7543 1863:20 Ambig 2.85, 4.00 A or (resid 50 and name HG2*) (resid 101 and name HA) ! 0.0891 1863:20 ----- 4.07, 5.22 A or (resid 101 and name HD1*) (resid 101 and name HA) ! 0.0585 1863:20 ----- 4.37, 4.74 A or (resid 78 and name HD1*) (resid 101 and name HA) ! 0.0289 1863:20 ----- 4.91, 5.96 A assign (resid 53 and name HB) (resid 52 and name HA) 4.15 2.35 2.35 ! 0.0000 1864:20 Seq 5.63, 5.69 A assign (resid 52 and name HN) (resid 52 and name HB2) 3.65 1.85 1.85 ! 0.0000 1866:20 Intra 2.88, 3.97 A assign (resid 52 and name HN) (resid 52 and name HB1) 3.65 1.85 1.85 ! 0.0000 1867:20 Intra 3.45, 3.62 A assign (resid 53 and name HG1*) (resid 53 and name HB) 2.30 0.50 0.50 ! 0.5173 1868:20 Ambig 2.39, 2.62 A or (resid 53 and name HG2*) (resid 53 and name HB) ! 0.4827 1868:20 ----- 2.42, 2.64 A assign (resid 68 and name HB1) (resid 60 and name HG1*) 3.15 1.35 1.35 ! 0.6874 1869:20 Ambig 4.16, 5.55 A or (resid 84 and name HB1) (resid 60 and name HG1*) ! 0.1807 1869:20 ----- 5.20, 6.77 A or (resid 84 and name HB1) (resid 60 and name HG2*) ! 0.0823 1869:20 ----- 5.93, 7.77 A assign (resid 60 and name HB) (resid 60 and name HG2*) 2.30 0.50 0.50 ! 0.4675 1870:20 Ambig 2.42, 2.64 A or (resid 60 and name HB) (resid 60 and name HG1*) ! 0.4664 1870:20 ----- 2.42, 2.63 A assign (resid 56 and name HB1) (resid 60 and name HG2*) 3.15 1.35 1.35 ! 0.9784 1871:20 Mid 3.62, 5.14 A assign (resid 61 and name HN) (resid 60 and name HG1*) 3.15 1.35 1.35 ! 0.9163 1872:20 Ambig 2.86, 3.90 A or (resid 61 and name HN) (resid 60 and name HG2*) ! 0.0603 1872:20 ----- 4.49, 5.21 A assign (resid 82 and name HE*) (resid 60 and name HG1*) 3.15 1.35 1.35 ! 0.6189 1873:20 Ambig 2.73, 5.94 A or (resid 82 and name HE*) (resid 60 and name HG2*) ! 0.3640 1873:20 ----- 2.98, 5.08 A assign (resid 82 and name HZ) (resid 60 and name HG2*) 3.15 1.35 1.35 ! 0.7115 1874:20 Ambig 4.04, 5.27 A or (resid 82 and name HZ) (resid 60 and name HG1*) ! 0.2885 1874:20 ----- 4.69, 6.41 A assign (resid 63 and name HG2*) (resid 60 and name HG1*) 2.30 0.50 0.50 ! 0.9728 1875:20 Mid 2.02, 3.66 A assign (resid 92 and name HD1*) (resid 60 and name HG2*) 2.65 0.85 0.85 ! 0.9226 1876:20 Long 2.18, 4.61 A assign (resid 53 and name HN) (resid 53 and name HG2*) 3.15 1.35 1.35 ! 0.7914 1877:20 Ambig 2.23, 3.18 A or (resid 53 and name HN) (resid 53 and name HG1*) ! 0.2086 1877:20 ----- 2.78, 3.72 A assign (resid 54 and name HN) (resid 54 and name HB2) 3.65 1.85 1.85 ! 0.0000 1878:20 Intra 2.45, 2.52 A assign (resid 54 and name HN) (resid 54 and name HB1) 3.65 1.85 1.85 ! 0.0000 1879:20 Intra 3.60, 3.67 A assign (resid 54 and name HA) (resid 54 and name HB1) 3.65 1.85 1.85 ! 0.0000 1880:20 Intra 2.42, 2.47 A assign (resid 54 and name HA) (resid 54 and name HB2) 3.65 1.85 1.85 ! 0.0000 1881:20 Intra 3.00, 3.02 A assign (resid 55 and name HD2) (resid 54 and name HB2) 3.65 1.85 1.85 ! 0.0000 1882:20 Seq 4.35, 4.47 A assign (resid 100 and name HB*) (resid 54 and name HB2) 3.65 1.85 1.85 ! 0.9982 1883:20 Long 1.91, 2.89 A assign (resid 100 and name HB*) (resid 54 and name HB1) 3.65 1.85 1.85 ! 0.9700 1884:20 Long 3.59, 4.54 A assign (resid 126 and name HB*) (resid 36 and name HD1*) 2.65 0.85 0.85 ! 0.6909 1885:20 Ambig 2.16, 4.51 A or (resid 22 and name HD2) (resid 54 and name HD1*) ! 0.3091 1885:20 ----- 2.47, 4.98 A assign (resid 83 and name HB) (resid 36 and name HD1*) 4.15 2.35 2.35 ! 0.0000 1886:20 Long 4.05, 5.73 A assign (resid 36 and name HB1) (resid 36 and name HD1*) 2.30 0.50 0.50 ! 0.0000 1887:20 Intra 2.45, 3.10 A assign (resid 52 and name HB1) (resid 54 and name HD2*) 3.65 1.85 1.85 ! 0.0000 1888:20 Mid 4.16, 6.53 A assign (resid 54 and name HG) (resid 54 and name HD2*) 2.30 0.50 0.50 ! 0.9253 1889:20 Intra 2.41, 2.63 A assign (resid 100 and name HN) (resid 55 and name HA) 3.65 1.85 1.85 ! 0.0000 1890:20 Long 3.42, 3.68 A assign (resid 55 and name HG2) (resid 55 and name HA) 3.15 1.35 1.35 ! 0.9672 1891:20 Intra 3.86, 3.90 A assign (resid 60 and name HG2*) (resid 55 and name HA) 3.15 1.35 1.35 ! 0.6761 1892:20 Ambig 3.50, 4.86 A or (resid 53 and name HG2*) (resid 55 and name HA) ! 0.1669 1892:20 ----- 4.42, 5.64 A or (resid 60 and name HG1*) (resid 55 and name HA) ! 0.1220 1892:20 ----- 4.66, 6.12 A assign (resid 60 and name HB) (resid 55 and name HA) 3.65 1.85 1.85 ! 0.7545 1893:20 Ambig 4.01, 4.59 A or (resid 54 and name HB2) (resid 55 and name HA) ! 0.1950 1893:20 ----- 5.03, 5.15 A assign (resid 56 and name HA) (resid 55 and name HA) 3.65 1.85 1.85 ! 0.9017 1894:20 Ambig 4.30, 4.34 A or (resid 100 and name HA) (resid 55 and name HA) ! 0.0983 1894:20 ----- 6.23, 6.48 A assign (resid 56 and name HB2) (resid 55 and name HA) 3.65 1.85 1.85 ! 0.8139 1895:20 Ambig 4.52, 4.74 A or (resid 68 and name HB2) (resid 55 and name HA) ! 0.1861 1895:20 ----- 5.78, 6.67 A assign (resid 55 and name HA) (resid 55 and name HB2) 3.15 1.35 1.35 ! 0.0000 1898:20 Intra 2.65, 2.69 A assign (resid 55 and name HG2) (resid 55 and name HB1) 3.15 1.35 1.35 ! 0.0000 1899:20 Intra 2.95, 2.98 A assign (resid 55 and name HG2) (resid 55 and name HB2) 3.15 1.35 1.35 ! 0.0000 1900:20 Intra 2.28, 2.31 A assign (resid 55 and name HD1) (resid 55 and name HB1) 3.65 1.85 1.85 ! 0.9664 1901:20 Intra 3.08, 3.16 A assign (resid 60 and name HB) (resid 55 and name HB2) 2.65 0.85 0.85 ! 0.9989 1902:20 Long 1.96, 2.45 A assign (resid 60 and name HB) (resid 55 and name HB1) 3.65 1.85 1.85 ! 0.9817 1903:20 Long 3.20, 3.78 A assign (resid 55 and name HD1) (resid 55 and name HB2) 3.65 1.85 1.85 ! 0.7406 1904:20 Ambig 3.96, 4.00 A or (resid 60 and name HA) (resid 55 and name HB2) ! 0.2042 1904:20 ----- 4.91, 5.42 A assign (resid 55 and name HA) (resid 55 and name HB1) 3.15 1.35 1.35 ! 0.0000 1905:20 Intra 2.29, 2.32 A assign (resid 56 and name HN) (resid 55 and name HB2) 3.65 1.85 1.85 ! 0.9843 1906:20 Seq 3.12, 3.31 A assign (resid 68 and name HD*) (resid 55 and name HB2) 3.65 1.85 1.85 ! 0.8411 1907:20 Ambig 3.50, 5.59 A or (resid 82 and name HD*) (resid 55 and name HB2) ! 0.1589 1907:20 ----- 4.62, 6.25 A assign (resid 56 and name HN) (resid 55 and name HB1) 3.65 1.85 1.85 ! 0.0000 1908:20 Seq 3.85, 3.95 A assign (resid 55 and name HD1) (resid 55 and name HG2) 3.15 1.35 1.35 ! 0.9928 1909:20 Intra 2.92, 2.95 A assign (resid 55 and name HD1) (resid 55 and name HG1) 3.15 1.35 1.35 ! 0.9961 1910:20 Intra 2.28, 2.29 A assign (resid 55 and name HD2) (resid 55 and name HG1) 3.15 1.35 1.35 ! 0.0000 1911:20 Intra 2.74, 2.77 A assign (resid 55 and name HD2) (resid 55 and name HG2) 2.65 0.85 0.85 ! 0.0000 1912:20 Intra 2.26, 2.27 A assign (resid 55 and name HB1) (resid 55 and name HG2) 3.15 1.35 1.35 ! 0.0000 1913:20 Intra 2.95, 2.98 A assign (resid 55 and name HB1) (resid 55 and name HG1) 3.65 1.85 1.85 ! 0.0000 1914:20 Intra 2.28, 2.31 A assign (resid 54 and name HA) (resid 55 and name HG2) 3.65 1.85 1.85 ! 0.0000 1915:20 Seq 4.29, 4.36 A assign (resid 54 and name HA) (resid 55 and name HG1) 3.65 1.85 1.85 ! 0.0000 1916:20 Seq 4.29, 4.34 A assign (resid 54 and name HA) (resid 55 and name HD2) 2.65 0.85 0.85 ! 0.0000 1917:20 Seq 2.13, 2.24 A assign (resid 54 and name HA) (resid 55 and name HD1) 2.30 0.50 0.50 ! 0.0000 1918:20 Seq 2.07, 2.19 A assign (resid 55 and name HB1) (resid 55 and name HD1) 3.15 1.35 1.35 ! 0.0000 1919:20 Intra 3.08, 3.16 A assign (resid 68 and name HE*) (resid 55 and name HD1) 3.15 1.35 1.35 ! 0.9841 1920:20 Long 2.09, 3.87 A assign (resid 68 and name HD*) (resid 55 and name HD1) 3.65 1.85 1.85 ! 0.0000 1921:20 Long 3.46, 5.01 A assign (resid 68 and name HD*) (resid 55 and name HD2) 3.65 1.85 1.85 ! 0.0000 1922:20 Long 4.71, 6.22 A assign (resid 68 and name HE*) (resid 55 and name HD2) 3.65 1.85 1.85 ! 0.9008 1923:20 Ambig 3.85, 5.40 A or (resid 82 and name HE*) (resid 55 and name HD2) ! 0.0992 1923:20 ----- 5.56, 7.42 A assign (resid 97 and name HG2*) (resid 56 and name HB2) 3.65 1.85 1.85 ! 0.0000 1924:20 Long 2.23, 3.75 A assign (resid 97 and name HG2*) (resid 56 and name HB1) 3.15 1.35 1.35 ! 0.0000 1925:20 Long 3.00, 4.70 A assign (resid 60 and name HG2*) (resid 56 and name HB2) 3.65 1.85 1.85 ! 0.6625 1926:20 Ambig 5.15, 6.54 A or (resid 59 and name HD2*) (resid 56 and name HB2) ! 0.3375 1926:20 ----- 5.76, 7.07 A assign (resid 59 and name HN) (resid 58 and name HB2) 3.65 1.85 1.85 ! 0.0000 1927:20 Seq 2.69, 3.57 A assign (resid 58 and name HN) (resid 58 and name HB1) 2.65 0.85 0.85 ! 0.9912 1928:20 Intra 2.46, 2.92 A assign (resid 58 and name HA) (resid 58 and name HB1) 2.65 0.85 0.85 ! 0.9410 1929:20 Intra 2.43, 2.85 A assign (resid 58 and name HN) (resid 58 and name HB2) 2.65 0.85 0.85 ! 0.9974 1930:20 Intra 2.28, 2.53 A assign (resid 59 and name HG) (resid 59 and name HA) 3.65 1.85 1.85 ! 0.0000 1931:20 Intra 3.23, 3.35 A assign (resid 59 and name HD2*) (resid 59 and name HA) 3.15 1.35 1.35 ! 0.0000 1932:20 Intra 2.10, 2.89 A assign (resid 59 and name HD1*) (resid 59 and name HB1) 2.65 0.85 0.85 ! 0.9970 1933:20 Intra 2.37, 2.98 A assign (resid 59 and name HD1*) (resid 59 and name HB2) 2.65 0.85 0.85 ! 0.0000 1934:20 Intra 2.49, 3.14 A assign (resid 59 and name HD2*) (resid 59 and name HB1) 2.30 0.50 0.50 ! 0.8244 1935:20 Ambig 2.58, 3.23 A or (resid 60 and name HG2*) (resid 59 and name HB1) ! 0.1532 1935:20 ----- 3.42, 4.37 A assign (resid 60 and name HG2*) (resid 59 and name HB2) 2.65 0.85 0.85 ! 0.9018 1936:20 Ambig 2.42, 3.63 A or (resid 59 and name HD2*) (resid 59 and name HB2) ! 0.0831 1936:20 ----- 3.60, 3.87 A assign (resid 92 and name HD1*) (resid 59 and name HG) 3.65 1.85 1.85 ! 0.0000 1937:20 Long 5.16, 6.75 A assign (resid 104 and name HG11) (resid 51 and name HD1) 2.30 0.50 0.50 ! 0.4056 1938:20 Ambig 2.20, 2.92 A or (resid 134 and name HG*) (resid 134 and name HD*) ! 0.3293 1938:20 ----- 2.28, 2.66 A or (resid 47 and name HG2) (resid 47 and name HD2) ! 0.2158 1938:20 ----- 2.45, 2.66 A assign (resid 8 and name HN) (resid 134 and name HD*) 3.65 1.85 1.85 ! 0.7705 1939:20 Ambig 3.84, 5.25 A or (resid 137 and name HN) (resid 134 and name HD*) ! 0.2295 1939:20 ----- 4.70, 6.08 A assign (resid 60 and name HN) (resid 59 and name HG) 3.65 1.85 1.85 ! 0.0000 1940:20 Seq 3.75, 4.01 A assign (resid 43 and name HD*) (resid 116 and name HD2*) 3.65 1.85 1.85 ! 0.7384 1941:20 Ambig 3.62, 5.21 A or (resid 59 and name HN) (resid 59 and name HD1*) ! 0.2616 1941:20 ----- 4.31, 4.91 A assign (resid 43 and name HB*) (resid 116 and name HD2*) 2.30 0.50 0.50 ! 0.9943 1942:20 Long 1.97, 3.11 A assign (resid 59 and name HB1) (resid 59 and name HD1*) 2.30 0.50 0.50 ! 0.9938 1943:20 Intra 2.37, 2.98 A assign (resid 59 and name HG) (resid 59 and name HD1*) 2.30 0.50 0.50 ! 0.8806 1944:20 Ambig 2.36, 2.61 A or (resid 116 and name HB2) (resid 116 and name HD2*) ! 0.0591 1944:20 ----- 3.71, 3.91 A assign (resid 142 and name HD1*) (resid 116 and name HD2*) 2.65 0.85 0.85 ! 0.0000 1945:20 Long 2.27, 4.40 A assign (resid 92 and name HD1*) (resid 59 and name HD1*) 3.15 1.35 1.35 ! 0.0000 1946:20 Long 3.75, 6.20 A assign (resid 48 and name HE*) (resid 48 and name HD*) 2.65 0.85 0.85 ! 0.5025 1948:20 Ambig 2.44, 3.69 A or (resid 103 and name HE*) (resid 103 and name HD*) ! 0.4887 1948:20 ----- 2.45, 3.68 A assign (resid 45 and name HA) (resid 49 and name HB) 4.15 2.35 2.35 ! 0.6074 1949:20 Ambig 6.27, 7.38 A or (resid 141 and name HA) (resid 12 and name HB) ! 0.3926 1949:20 ----- 6.75, 6.95 A assign (resid 53 and name HB) (resid 53 and name HG1*) 2.30 0.50 0.50 ! 0.5127 1950:20 Ambig 2.39, 2.62 A or (resid 53 and name HB) (resid 53 and name HG2*) ! 0.4785 1950:20 ----- 2.42, 2.64 A assign (resid 54 and name HD1*) (resid 54 and name HB1) 2.65 0.85 0.85 ! 0.9962 1951:20 Intra 2.41, 3.09 A assign (resid 54 and name HD1*) (resid 54 and name HB2) 2.30 0.50 0.50 ! 0.9891 1952:20 Intra 2.43, 3.04 A assign (resid 58 and name HB1) (resid 59 and name HD2*) 2.65 0.85 0.85 ! 0.7827 1953:20 Ambig 2.38, 4.21 A or (resid 58 and name HB2) (resid 59 and name HD2*) ! 0.2173 1953:20 ----- 2.95, 5.30 A assign (resid 59 and name HG) (resid 59 and name HD2*) 2.30 0.50 0.50 ! 0.9789 1955:20 Intra 2.33, 2.62 A assign (resid 59 and name HB2) (resid 59 and name HD2*) 2.65 0.85 0.85 ! 0.0000 1956:20 Intra 3.60, 3.87 A assign (resid 59 and name HN) (resid 59 and name HD2*) 3.15 1.35 1.35 ! 0.0000 1957:20 Intra 2.90, 4.22 A assign (resid 60 and name HN) (resid 59 and name HD2*) 3.15 1.35 1.35 ! 0.7711 1958:20 Ambig 4.69, 5.42 A or (resid 102 and name HN) (resid 101 and name HD1*) ! 0.2289 1958:20 ----- 5.75, 6.39 A assign (resid 93 and name HN) (resid 59 and name HD2*) 3.65 1.85 1.85 ! 0.0000 1959:20 Long 3.33, 5.21 A assign (resid 60 and name HG2*) (resid 60 and name HB) 2.30 0.50 0.50 ! 0.5006 1960:20 Ambig 2.42, 2.64 A or (resid 60 and name HG1*) (resid 60 and name HB) ! 0.4994 1960:20 ----- 2.42, 2.63 A assign (resid 60 and name HA) (resid 60 and name HB) 3.65 1.85 1.85 ! 0.9817 1961:20 Intra 2.99, 3.03 A assign (resid 57 and name HA) (resid 60 and name HB) 3.65 1.85 1.85 ! 0.9439 1962:20 Mid 2.59, 3.47 A assign (resid 61 and name HA) (resid 61 and name HB2) 3.15 1.35 1.35 ! 0.9553 1963:20 Intra 2.40, 2.85 A assign (resid 61 and name HA) (resid 61 and name HB1) 3.65 1.85 1.85 ! 0.9813 1964:20 Intra 2.41, 2.66 A assign (resid 61 and name HN) (resid 61 and name HB1) 3.15 1.35 1.35 ! 0.0000 1965:20 Intra 2.56, 3.36 A assign (resid 61 and name HE2) (resid 61 and name HG2) 2.65 0.85 0.85 ! 0.4360 1966:20 Ambig 2.30, 2.91 A or (resid 131 and name HE*) (resid 131 and name HG2) ! 0.4348 1966:20 ----- 2.30, 3.13 A or (resid 62 and name HB2) (resid 61 and name HG2) ! 0.1094 1966:20 ----- 2.90, 5.30 A assign (resid 62 and name HB2) (resid 61 and name HD2) 2.65 0.85 0.85 ! 0.6460 1967:20 Ambig 2.17, 5.84 A or (resid 61 and name HE2) (resid 61 and name HD2) ! 0.3540 1967:20 ----- 2.40, 2.79 A assign (resid 61 and name HE1) (resid 61 and name HD2) 2.65 0.85 0.85 ! 0.0000 1968:20 Intra 2.36, 2.46 A assign (resid 61 and name HE1) (resid 61 and name HD1) 2.65 0.85 0.85 ! 0.0000 1969:20 Intra 2.40, 2.80 A assign (resid 62 and name HB1) (resid 62 and name HA) 3.15 1.35 1.35 ! 0.9836 1971:20 Intra 2.53, 2.91 A assign (resid 62 and name HA) (resid 62 and name HB1) 3.15 1.35 1.35 ! 0.9918 1972:20 Intra 2.53, 2.91 A assign (resid 62 and name HN) (resid 62 and name HB2) 3.65 1.85 1.85 ! 0.0000 1973:20 Intra 2.71, 3.07 A assign (resid 108 and name HN) (resid 106 and name HB1) 3.15 1.35 1.35 ! 0.9993 1974:20 Mid 1.93, 2.92 A assign (resid 123 and name HG) (resid 120 and name HA) 3.15 1.35 1.35 ! 0.6043 1975:20 Ambig 2.99, 4.24 A or (resid 45 and name HB*) (resid 75 and name HA) ! 0.3900 1975:20 ----- 3.22, 4.14 A assign (resid 123 and name HB1) (resid 120 and name HA) 3.15 1.35 1.35 ! 0.9970 1976:20 Mid 1.98, 2.51 A assign (resid 67 and name HB*) (resid 63 and name HG2*) 2.65 0.85 0.85 ! 0.8649 1977:20 Ambig 2.69, 5.02 A or (resid 55 and name HD1) (resid 63 and name HG2*) ! 0.0731 1977:20 ----- 4.07, 5.70 A assign (resid 68 and name HB2) (resid 63 and name HG2*) 2.65 0.85 0.85 ! 0.9978 1978:20 Long 1.99, 3.05 A assign (resid 68 and name HB1) (resid 63 and name HG2*) 2.65 0.85 0.85 ! 0.9936 1979:20 Long 2.29, 4.16 A assign (resid 55 and name HB1) (resid 63 and name HG2*) 3.15 1.35 1.35 ! 0.6212 1980:20 Ambig 3.28, 4.60 A or (resid 55 and name HB1) (resid 99 and name HB*) ! 0.3788 1980:20 ----- 3.56, 4.80 A assign (resid 108 and name HA) (resid 108 and name HB2) 2.30 0.50 0.50 ! 0.0000 1981:20 Intra 2.46, 2.52 A assign (resid 65 and name HD22) (resid 65 and name HB2) 3.15 1.35 1.35 ! 0.0000 1982:20 Intra 3.42, 3.52 A assign (resid 85 and name HG1) (resid 65 and name HB1) 3.65 1.85 1.85 ! 0.0000 1983:20 Long 2.62, 3.29 A assign (resid 85 and name HG1) (resid 65 and name HB2) 3.65 1.85 1.85 ! 0.8146 1984:20 Ambig 3.87, 4.61 A or (resid 61 and name HB2) (resid 65 and name HB2) ! 0.0938 1984:20 ----- 5.55, 7.77 A or (resid 61 and name HB1) (resid 65 and name HB2) ! 0.0916 1984:20 ----- 5.57, 7.45 A assign (resid 43 and name HE*) (resid 43 and name HD*) 2.30 0.50 0.50 ! 0.3349 1987:20 Ambig 2.44, 3.68 A or (resid 66 and name HE*) (resid 66 and name HD*) ! 0.3327 1987:20 ----- 2.44, 3.69 A or (resid 68 and name HE*) (resid 68 and name HZ) ! 0.3255 1987:20 ----- 2.45, 2.46 A assign (resid 43 and name HD*) (resid 43 and name HE*) 2.30 0.50 0.50 ! 0.5016 1988:20 Ambig 2.44, 3.68 A or (resid 66 and name HD*) (resid 66 and name HE*) ! 0.4984 1988:20 ----- 2.44, 3.69 A assign (resid 61 and name HN) (resid 67 and name HB*) 3.15 1.35 1.35 ! 0.0000 1989:20 Long 3.53, 4.84 A assign (resid 69 and name HD1*) (resid 67 and name HB*) 4.15 2.35 2.35 ! 0.3992 1990:20 Ambig 5.30, 6.12 A or (resid 94 and name HG2*) (resid 93 and name HB1) ! 0.3087 1990:20 ----- 5.54, 6.79 A or (resid 92 and name HG2*) (resid 93 and name HB1) ! 0.2921 1990:20 ----- 5.59, 6.58 A assign (resid 67 and name HN) (resid 67 and name HB*) 2.65 0.85 0.85 ! 0.9973 1992:20 Intra 2.43, 2.87 A assign (resid 68 and name HN) (resid 68 and name HA) 3.65 1.85 1.85 ! 0.0000 1993:20 Intra 2.92, 2.93 A assign (resid 82 and name HD*) (resid 68 and name HA) 3.15 1.35 1.35 ! 0.8426 1994:20 Ambig 2.06, 4.30 A or (resid 68 and name HD*) (resid 68 and name HA) ! 0.1564 1994:20 ----- 2.72, 3.60 A assign (resid 82 and name HA) (resid 68 and name HA) 3.15 1.35 1.35 ! 0.0000 1995:20 Long 2.94, 3.30 A assign (resid 68 and name HB2) (resid 68 and name HA) 3.65 1.85 1.85 ! 0.0000 1996:20 Intra 2.40, 2.44 A assign (resid 69 and name HA) (resid 68 and name HA) 3.65 1.85 1.85 ! 0.4323 1997:20 Ambig 4.38, 4.40 A or (resid 63 and name HA) (resid 68 and name HA) ! 0.3721 1997:20 ----- 4.49, 5.02 A or (resid 66 and name HA) (resid 68 and name HA) ! 0.1956 1997:20 ----- 5.00, 5.52 A assign (resid 69 and name HD1*) (resid 68 and name HA) 3.65 1.85 1.85 ! 0.7742 1998:20 Ambig 3.23, 4.38 A or (resid 70 and name HG2*) (resid 68 and name HA) ! 0.2028 1998:20 ----- 4.04, 5.10 A assign (resid 63 and name HG2*) (resid 68 and name HA) 3.65 1.85 1.85 ! 0.7504 1999:20 Ambig 3.90, 5.16 A or (resid 69 and name HG11) (resid 68 and name HA) ! 0.1928 1999:20 ----- 4.89, 5.13 A assign (resid 68 and name HB1) (resid 68 and name HA) 3.15 1.35 1.35 ! 0.0000 2000:20 Intra 3.02, 3.03 A assign (resid 67 and name HN) (resid 68 and name HB1) 3.65 1.85 1.85 ! 0.7119 2001:20 Ambig 3.83, 4.23 A or (resid 66 and name HD*) (resid 68 and name HB1) ! 0.2265 2001:20 ----- 4.64, 6.96 A assign (resid 68 and name HD*) (resid 68 and name HB1) 3.15 1.35 1.35 ! 0.9730 2002:20 Intra 2.32, 3.03 A assign (resid 68 and name HE*) (resid 68 and name HB1) 3.65 1.85 1.85 ! 0.5093 2003:20 Ambig 4.60, 5.03 A or (resid 82 and name HE*) (resid 68 and name HB1) ! 0.4907 2003:20 ----- 4.63, 7.22 A assign (resid 68 and name HN) (resid 68 and name HB1) 3.65 1.85 1.85 ! 0.0000 2004:20 Intra 2.28, 2.41 A assign (resid 68 and name HN) (resid 68 and name HB2) 3.65 1.85 1.85 ! 0.0000 2005:20 Intra 2.69, 2.89 A assign (resid 68 and name HA) (resid 68 and name HB2) 3.65 1.85 1.85 ! 0.0000 2006:20 Intra 2.40, 2.44 A assign (resid 68 and name HA) (resid 68 and name HB1) 3.65 1.85 1.85 ! 0.0000 2007:20 Intra 3.02, 3.03 A assign (resid 69 and name HD1*) (resid 68 and name HB2) 3.65 1.85 1.85 ! 0.4682 2008:20 Ambig 5.11, 6.28 A or (resid 70 and name HG2*) (resid 68 and name HB2) ! 0.4313 2008:20 ----- 5.18, 6.14 A or (resid 53 and name HG2*) (resid 68 and name HB2) ! 0.1005 2008:20 ----- 6.61, 7.51 A assign (resid 63 and name HG2*) (resid 68 and name HB2) 3.65 1.85 1.85 ! 0.9991 2009:20 Long 1.99, 3.05 A assign (resid 69 and name HG12) (resid 69 and name HA) 2.65 0.85 0.85 ! 0.7002 2010:20 Ambig 3.72, 3.75 A or (resid 45 and name HB*) (resid 46 and name HA) ! 0.2998 2010:20 ----- 4.29, 4.91 A assign (resid 70 and name HB) (resid 69 and name HA) 3.65 1.85 1.85 ! 0.8527 2011:20 Ambig 4.67, 4.71 A or (resid 75 and name HB1) (resid 46 and name HA) ! 0.1473 2011:20 ----- 6.26, 6.99 A assign (resid 69 and name HN) (resid 69 and name HA) 3.65 1.85 1.85 ! 0.9944 2012:20 Intra 2.92, 2.93 A assign (resid 49 and name HB) (resid 104 and name HB) 2.65 0.85 0.85 ! 0.9988 2013:20 Long 1.92, 2.08 A assign (resid 66 and name HB*) (resid 69 and name HG11) 3.65 1.85 1.85 ! 0.8616 2014:20 Ambig 2.67, 5.05 A or (resid 38 and name HB2) (resid 124 and name HG11) ! 0.1384 2014:20 ----- 3.62, 4.61 A assign (resid 38 and name HB1) (resid 124 and name HG11) 3.65 1.85 1.85 ! 0.9811 2015:20 Long 2.77, 3.17 A assign (resid 69 and name HB) (resid 69 and name HG12) 2.30 0.50 0.50 ! 0.9954 2017:20 Intra 2.56, 2.60 A assign (resid 69 and name HN) (resid 69 and name HG11) 3.15 1.35 1.35 ! 0.0000 2020:20 Intra 3.58, 3.76 A assign (resid 138 and name HN) (resid 123 and name HG) 3.65 1.85 1.85 ! 0.4805 2021:20 Ambig 4.68, 7.28 A or (resid 81 and name HN) (resid 69 and name HG12) ! 0.1986 2021:20 ----- 5.43, 5.70 A or (resid 70 and name HN) (resid 69 and name HG12) ! 0.1823 2021:20 ----- 5.50, 5.60 A or (resid 137 and name HN) (resid 123 and name HG) ! 0.1386 2021:20 ----- 5.76, 7.83 A assign (resid 70 and name HN) (resid 69 and name HG11) 3.65 1.85 1.85 ! 0.8124 2022:20 Ambig 4.52, 4.67 A or (resid 81 and name HN) (resid 69 and name HG11) ! 0.1876 2022:20 ----- 5.77, 5.95 A assign (resid 68 and name HN) (resid 69 and name HG11) 3.65 1.85 1.85 ! 0.5718 2023:20 Ambig 4.37, 4.67 A or (resid 125 and name HN) (resid 124 and name HG11) ! 0.4282 2023:20 ----- 4.59, 5.09 A assign (resid 69 and name HN) (resid 69 and name HG12) 3.15 1.35 1.35 ! 0.0000 2024:20 Intra 4.37, 4.40 A assign (resid 66 and name HB*) (resid 69 and name HD1*) 2.65 0.85 0.85 ! 0.7659 2025:20 Ambig 2.54, 5.49 A or (resid 38 and name HB2) (resid 124 and name HD1*) ! 0.2341 2025:20 ----- 3.09, 4.74 A assign (resid 69 and name HB) (resid 69 and name HD1*) 2.65 0.85 0.85 ! 0.9930 2026:20 Intra 2.46, 3.04 A assign (resid 69 and name HG12) (resid 69 and name HD1*) 2.30 0.50 0.50 ! 0.0000 2027:20 Intra 2.39, 2.62 A assign (resid 69 and name HG11) (resid 69 and name HD1*) 2.30 0.50 0.50 ! 0.5352 2028:20 Ambig 2.41, 2.62 A or (resid 81 and name HG2*) (resid 69 and name HD1*) ! 0.4648 2028:20 ----- 2.47, 4.83 A assign (resid 68 and name HN) (resid 69 and name HD1*) 3.15 1.35 1.35 ! 0.9750 2029:20 Seq 3.05, 4.30 A assign (resid 81 and name HN) (resid 69 and name HD1*) 3.65 1.85 1.85 ! 0.6681 2030:20 Ambig 4.70, 5.53 A or (resid 70 and name HN) (resid 69 and name HD1*) ! 0.3319 2030:20 ----- 5.28, 6.10 A assign (resid 142 and name HB) (resid 142 and name HG2*) 2.30 0.50 0.50 ! 0.5486 2031:20 Ambig 2.43, 2.65 A or (resid 144 and name HG2*) (resid 142 and name HG2*) ! 0.4274 2031:20 ----- 2.53, 4.35 A assign (resid 37 and name HB) (resid 80 and name HG2*) 3.15 1.35 1.35 ! 0.7289 2033:20 Ambig 4.69, 6.13 A or (resid 39 and name HB*) (resid 80 and name HG2*) ! 0.2711 2033:20 ----- 5.53, 6.60 A assign (resid 105 and name HG1*) (resid 142 and name HG2*) 3.15 1.35 1.35 ! 0.9310 2034:20 Long 3.06, 4.58 A assign (resid 142 and name HD1*) (resid 142 and name HG2*) 2.30 0.50 0.50 ! 0.0000 2035:20 Intra 2.02, 3.68 A assign (resid 143 and name HB) (resid 142 and name HG2*) 3.15 1.35 1.35 ! 0.5228 2036:20 Ambig 5.00, 5.74 A or (resid 81 and name HB) (resid 80 and name HG2*) ! 0.4772 2036:20 ----- 5.07, 5.96 A assign (resid 114 and name HB1) (resid 142 and name HG2*) 3.15 1.35 1.35 ! 0.5835 2037:20 Ambig 5.14, 6.73 A or (resid 14 and name HB*) (resid 142 and name HG2*) ! 0.3457 2037:20 ----- 5.61, 6.54 A assign (resid 14 and name HA) (resid 142 and name HG2*) 3.65 1.85 1.85 ! 0.9864 2038:20 Long 3.30, 4.19 A assign (resid 13 and name HN) (resid 142 and name HG2*) 3.15 1.35 1.35 ! 0.0000 2039:20 Long 4.48, 5.53 A assign (resid 69 and name HN) (resid 80 and name HG2*) 3.65 1.85 1.85 ! 0.6395 2040:20 Ambig 4.27, 5.33 A or (resid 145 and name HN) (resid 142 and name HG2*) ! 0.2035 2040:20 ----- 5.17, 6.32 A or (resid 16 and name HN) (resid 142 and name HG2*) ! 0.0975 2040:20 ----- 5.84, 6.32 A assign (resid 80 and name HN) (resid 80 and name HG2*) 3.65 1.85 1.85 ! 0.8376 2041:20 Ambig 4.32, 4.63 A or (resid 105 and name HN) (resid 142 and name HG2*) ! 0.1075 2041:20 ----- 6.08, 7.18 A assign (resid 70 and name HB) (resid 70 and name HG1*) 2.30 0.50 0.50 ! 0.9905 2042:20 Intra 2.44, 2.65 A assign (resid 71 and name HN) (resid 71 and name HB2) 3.65 1.85 1.85 ! 0.0000 2043:20 Intra 2.77, 2.97 A assign (resid 71 and name HD22) (resid 71 and name HB2) 3.65 1.85 1.85 ! 0.0000 2044:20 Intra 3.47, 3.74 A assign (resid 71 and name HD21) (resid 71 and name HB2) 3.65 1.85 1.85 ! 0.0000 2045:20 Intra 2.19, 2.84 A assign (resid 71 and name HD22) (resid 71 and name HB1) 3.65 1.85 1.85 ! 0.9760 2046:20 Intra 3.47, 3.54 A assign (resid 79 and name HB2) (resid 71 and name HB1) 2.65 0.85 0.85 ! 0.9901 2047:20 Long 1.85, 2.07 A assign (resid 79 and name HB1) (resid 71 and name HB1) 3.15 1.35 1.35 ! 0.7053 2048:20 Ambig 3.20, 3.57 A or (resid 67 and name HB*) (resid 84 and name HB1) ! 0.2771 2048:20 ----- 3.73, 5.18 A assign (resid 79 and name HB1) (resid 71 and name HB2) 3.65 1.85 1.85 ! 0.0000 2049:20 Long 4.63, 4.94 A assign (resid 79 and name HB2) (resid 71 and name HB2) 3.65 1.85 1.85 ! 0.0000 2050:20 Long 3.39, 3.70 A assign (resid 73 and name HB*) (resid 73 and name HA) 2.30 0.50 0.50 ! 0.9731 2051:20 Intra 2.26, 2.73 A assign (resid 74 and name HN) (resid 73 and name HA) 3.65 1.85 1.85 ! 0.0000 2053:20 Seq 2.46, 2.51 A assign (resid 74 and name HN) (resid 73 and name HB*) 3.15 1.35 1.35 ! 0.0000 2054:20 Seq 2.28, 3.32 A assign (resid 73 and name HA) (resid 73 and name HB*) 2.30 0.50 0.50 ! 0.9981 2055:20 Intra 2.26, 2.73 A assign (resid 77 and name HN) (resid 75 and name HA) 3.65 1.85 1.85 ! 0.0000 2061:20 Mid 3.23, 3.46 A assign (resid 111 and name HN) (resid 144 and name HB) 3.65 1.85 1.85 ! 0.6821 2062:20 Ambig 4.50, 4.84 A or (resid 77 and name HN) (resid 75 and name HB2) ! 0.3179 2062:20 ----- 5.11, 5.23 A assign (resid 76 and name HN) (resid 75 and name HB2) 3.65 1.85 1.85 ! 0.0000 2063:20 Seq 3.59, 3.85 A assign (resid 75 and name HD1) (resid 75 and name HB2) 3.15 1.35 1.35 ! 0.0000 2064:20 Intra 3.86, 3.91 A assign (resid 75 and name HD1) (resid 75 and name HB1) 2.65 0.85 0.85 ! 0.0000 2065:20 Intra 2.99, 3.24 A assign (resid 111 and name HA) (resid 144 and name HB) 2.30 0.50 0.50 ! 0.9939 2066:20 Long 1.89, 2.11 A assign (resid 75 and name HA) (resid 75 and name HB1) 2.65 0.85 0.85 ! 0.7692 2067:20 Ambig 2.23, 2.25 A or (resid 2 and name HA) (resid 131 and name HB1) ! 0.2090 2067:20 ----- 2.78, 7.01 A assign (resid 112 and name HA2) (resid 144 and name HB) 3.15 1.35 1.35 ! 0.6020 2068:20 Ambig 3.99, 4.40 A or (resid 143 and name HA) (resid 144 and name HB) ! 0.2612 2068:20 ----- 4.58, 4.69 A or (resid 74 and name HA) (resid 75 and name HB2) ! 0.1181 2068:20 ----- 5.23, 5.39 A assign (resid 120 and name HD2) (resid 120 and name HG*) 2.30 0.50 0.50 ! 0.7602 2069:20 Ambig 2.30, 2.65 A or (resid 24 and name HD2) (resid 24 and name HG1) ! 0.2398 2069:20 ----- 2.78, 2.84 A assign (resid 75 and name HB2) (resid 75 and name HD1) 3.15 1.35 1.35 ! 0.0000 2070:20 Intra 3.86, 3.91 A assign (resid 77 and name HB1) (resid 77 and name HA) 2.65 0.85 0.85 ! 0.9411 2071:20 Intra 2.46, 2.56 A assign (resid 77 and name HG1) (resid 77 and name HA) 3.65 1.85 1.85 ! 0.0000 2072:20 Intra 2.51, 2.97 A assign (resid 77 and name HE*) (resid 77 and name HB2) 3.65 1.85 1.85 ! 0.0000 2073:20 Intra 2.17, 4.40 A assign (resid 77 and name HE*) (resid 77 and name HB1) 3.65 1.85 1.85 ! 0.9994 2074:20 Intra 2.06, 4.29 A assign (resid 73 and name HB*) (resid 77 and name HB2) 3.65 1.85 1.85 ! 0.9354 2075:20 Mid 2.11, 3.27 A assign (resid 77 and name HA) (resid 77 and name HB2) 3.15 1.35 1.35 ! 0.0000 2076:20 Intra 2.93, 2.99 A assign (resid 77 and name HN) (resid 77 and name HG2) 3.65 1.85 1.85 ! 0.0000 2077:20 Intra 3.81, 4.31 A assign (resid 77 and name HN) (resid 77 and name HG1) 3.65 1.85 1.85 ! 0.0000 2078:20 Intra 3.10, 3.47 A assign (resid 77 and name HE*) (resid 77 and name HG1) 3.15 1.35 1.35 ! 0.0000 2081:20 Intra 2.59, 3.29 A assign (resid 77 and name HD*) (resid 77 and name HG1) 2.30 0.50 0.50 ! 0.8030 2082:20 Ambig 2.34, 2.67 A or (resid 77 and name HB1) (resid 77 and name HG1) ! 0.1970 2082:20 ----- 2.96, 3.00 A assign (resid 51 and name HD2) (resid 51 and name HG*) 2.30 0.50 0.50 ! 0.3884 2083:20 Ambig 2.31, 2.50 A or (resid 77 and name HB1) (resid 77 and name HG2) ! 0.3136 2083:20 ----- 2.39, 2.47 A or (resid 77 and name HD*) (resid 77 and name HG2) ! 0.2980 2083:20 ----- 2.41, 2.75 A assign (resid 77 and name HN) (resid 77 and name HD*) 3.65 1.85 1.85 ! 0.0000 2084:20 Intra 4.58, 5.13 A assign (resid 79 and name HA) (resid 77 and name HD*) 4.15 2.35 2.35 ! 0.0000 2085:20 Mid 5.65, 6.93 A assign (resid 77 and name HA) (resid 77 and name HD*) 3.15 1.35 1.35 ! 0.0000 2086:20 Intra 3.90, 4.45 A assign (resid 77 and name HG1) (resid 77 and name HD*) 2.30 0.50 0.50 ! 0.0000 2087:20 Intra 2.34, 2.67 A assign (resid 136 and name HN) (resid 134 and name HE2) 3.65 1.85 1.85 ! 0.4923 2089:20 Ambig 3.88, 5.17 A or (resid 121 and name HN) (resid 119 and name HB1) ! 0.4430 2089:20 ----- 3.95, 4.15 A assign (resid 77 and name HD*) (resid 77 and name HE*) 2.30 0.50 0.50 ! 0.9905 2090:20 Intra 2.34, 2.60 A assign (resid 79 and name HN) (resid 78 and name HA) 3.65 1.85 1.85 ! 0.0000 2091:20 Seq 2.20, 2.23 A assign (resid 78 and name HD1*) (resid 78 and name HB) 2.65 0.85 0.85 ! 0.7067 2092:20 Ambig 2.50, 3.09 A or (resid 80 and name HG1*) (resid 78 and name HB) ! 0.1816 2092:20 ----- 3.14, 4.03 A or (resid 80 and name HD1*) (resid 78 and name HB) ! 0.0824 2092:20 ----- 3.58, 4.55 A assign (resid 41 and name HB) (resid 78 and name HB) 2.65 0.85 0.85 ! 0.9989 2093:20 Long 2.00, 2.16 A assign (resid 41 and name HD1*) (resid 78 and name HB) 2.30 0.50 0.50 ! 0.5260 2094:20 Ambig 2.28, 3.62 A or (resid 78 and name HG2*) (resid 78 and name HB) ! 0.3561 2094:20 ----- 2.43, 2.64 A or (resid 41 and name HG11) (resid 78 and name HB) ! 0.0713 2094:20 ----- 3.18, 3.94 A assign (resid 78 and name HN) (resid 78 and name HB) 3.65 1.85 1.85 ! 0.0000 2095:20 Intra 2.71, 2.80 A assign (resid 41 and name HN) (resid 78 and name HB) 3.65 1.85 1.85 ! 0.0000 2096:20 Long 2.76, 2.99 A assign (resid 78 and name HB) (resid 78 and name HG1*) 2.65 0.85 0.85 ! 0.0000 2098:20 Intra 2.47, 2.76 A assign (resid 78 and name HA) (resid 78 and name HG1*) 3.65 1.85 1.85 ! 0.9678 2099:20 Intra 2.70, 2.99 A assign (resid 78 and name HB) (resid 78 and name HG2*) 2.30 0.50 0.50 ! 0.9740 2100:20 Intra 2.43, 2.64 A assign (resid 33 and name HG2) (resid 32 and name HA) 3.15 1.35 1.35 ! 0.5725 2103:20 Ambig 4.25, 4.46 A or (resid 118 and name HB) (resid 117 and name HA) ! 0.3610 2103:20 ----- 4.59, 4.73 A assign (resid 80 and name HG2*) (resid 80 and name HA) 3.15 1.35 1.35 ! 0.0000 2104:20 Intra 2.50, 3.13 A assign (resid 80 and name HG1*) (resid 80 and name HA) 3.15 1.35 1.35 ! 0.9595 2105:20 Intra 2.53, 2.83 A assign (resid 80 and name HN) (resid 80 and name HA) 3.65 1.85 1.85 ! 0.9770 2107:20 Intra 2.93, 2.94 A assign (resid 80 and name HA) (resid 80 and name HB) 3.65 1.85 1.85 ! 0.9342 2108:20 Intra 3.03, 3.03 A assign (resid 39 and name HN) (resid 80 and name HB) 3.65 1.85 1.85 ! 0.9545 2109:20 Long 3.39, 3.55 A assign (resid 81 and name HN) (resid 80 and name HB) 3.65 1.85 1.85 ! 0.8596 2110:20 Ambig 3.92, 4.09 A or (resid 79 and name HN) (resid 80 and name HB) ! 0.0701 2110:20 ----- 5.96, 6.18 A assign (resid 80 and name HB) (resid 80 and name HG1*) 2.30 0.50 0.50 ! 0.0000 2111:20 Intra 2.44, 2.74 A assign (resid 80 and name HA) (resid 80 and name HG1*) 3.65 1.85 1.85 ! 0.9909 2113:20 Intra 2.53, 2.83 A assign (resid 80 and name HB) (resid 80 and name HD1*) 2.30 0.50 0.50 ! 0.9942 2114:20 Intra 2.54, 3.16 A assign (resid 99 and name HB*) (resid 80 and name HD1*) 3.15 1.35 1.35 ! 0.0000 2115:20 Long 3.91, 5.31 A assign (resid 41 and name HB) (resid 80 and name HD1*) 3.15 1.35 1.35 ! 0.6128 2116:20 Ambig 4.56, 5.33 A or (resid 39 and name HB*) (resid 80 and name HD1*) ! 0.3872 2116:20 ----- 4.92, 6.53 A assign (resid 80 and name HG2*) (resid 80 and name HD1*) 2.30 0.50 0.50 ! 0.0000 2117:20 Intra 1.96, 3.61 A assign (resid 39 and name HG*) (resid 80 and name HD1*) 2.65 0.85 0.85 ! 0.0000 2118:20 Long 2.80, 4.45 A assign (resid 53 and name HA) (resid 80 and name HD1*) 4.15 2.35 2.35 ! 0.6616 2119:20 Ambig 5.65, 6.30 A or (resid 99 and name HA) (resid 80 and name HD1*) ! 0.3384 2119:20 ----- 6.32, 7.55 A assign (resid 70 and name HA) (resid 80 and name HD1*) 3.65 1.85 1.85 ! 0.8694 2120:20 Ambig 5.35, 6.04 A or (resid 100 and name HA) (resid 80 and name HD1*) ! 0.1306 2120:20 ----- 7.33, 7.96 A assign (resid 82 and name HZ) (resid 80 and name HD1*) 3.15 1.35 1.35 ! 0.0000 2121:20 Mid 3.34, 5.07 A assign (resid 82 and name HE*) (resid 80 and name HD1*) 3.65 1.85 1.85 ! 0.0000 2122:20 Mid 3.81, 6.00 A assign (resid 56 and name HD21) (resid 97 and name HD1*) 3.65 1.85 1.85 ! 0.5246 2123:20 Ambig 5.36, 6.35 A or (resid 99 and name HN) (resid 97 and name HD1*) ! 0.4754 2123:20 ----- 5.45, 7.16 A assign (resid 67 and name HN) (resid 69 and name HD1*) 3.65 1.85 1.85 ! 0.0000 2125:20 Mid 4.39, 5.30 A assign (resid 81 and name HN) (resid 80 and name HD1*) 3.65 1.85 1.85 ! 0.5586 2126:20 Ambig 5.51, 6.14 A or (resid 79 and name HN) (resid 80 and name HD1*) ! 0.4414 2126:20 ----- 5.73, 6.64 A assign (resid 39 and name HN) (resid 80 and name HD1*) 3.65 1.85 1.85 ! 0.6410 2127:20 Ambig 5.62, 6.56 A or (resid 54 and name HN) (resid 80 and name HD1*) ! 0.3590 2127:20 ----- 6.19, 7.18 A assign (resid 21 and name HN) (resid 142 and name HG2*) 3.65 1.85 1.85 ! 0.5287 2128:20 Ambig 5.77, 6.62 A or (resid 38 and name HN) (resid 80 and name HG2*) ! 0.3377 2128:20 ----- 6.21, 7.68 A or (resid 41 and name HN) (resid 80 and name HG2*) ! 0.1336 2128:20 ----- 7.25, 7.73 A assign (resid 82 and name HN) (resid 80 and name HG2*) 3.65 1.85 1.85 ! 0.0000 2129:20 Mid 3.74, 5.11 A assign (resid 81 and name HN) (resid 81 and name HA) 3.15 1.35 1.35 ! 0.9969 2130:20 Intra 2.88, 2.89 A assign (resid 39 and name HN) (resid 81 and name HA) 3.15 1.35 1.35 ! 0.9140 2131:20 Ambig 3.39, 3.52 A or (resid 83 and name HN) (resid 81 and name HA) ! 0.0547 2131:20 ----- 5.42, 5.59 A assign (resid 81 and name HB) (resid 81 and name HG2*) 2.30 0.50 0.50 ! 0.0000 2132:20 Intra 2.44, 2.65 A assign (resid 38 and name HB2) (resid 81 and name HG2*) 3.15 1.35 1.35 ! 0.0000 2134:20 Long 2.36, 3.72 A assign (resid 83 and name HB) (resid 81 and name HG2*) 4.15 2.35 2.35 ! 0.9936 2135:20 Mid 3.00, 4.54 A assign (resid 69 and name HB) (resid 81 and name HG2*) 2.65 0.85 0.85 ! 0.9688 2136:20 Long 3.32, 4.09 A assign (resid 83 and name HN) (resid 81 and name HG2*) 2.65 0.85 0.85 ! 0.8452 2139:20 Ambig 3.50, 4.81 A or (resid 39 and name HN) (resid 81 and name HG2*) ! 0.1548 2139:20 ----- 4.65, 5.78 A assign (resid 103 and name HN) (resid 20 and name HG2*) 2.65 0.85 0.85 ! 0.6535 2140:20 Ambig 3.54, 4.26 A or (resid 105 and name HN) (resid 20 and name HG2*) ! 0.1715 2140:20 ----- 4.42, 5.60 A or (resid 124 and name HN) (resid 122 and name HG2*) ! 0.0786 2140:20 ----- 5.04, 6.86 A or (resid 51 and name HN) (resid 20 and name HG2*) ! 0.0499 2140:20 ----- 5.44, 6.39 A assign (resid 82 and name HA) (resid 83 and name HG2*) 3.65 1.85 1.85 ! 0.0000 2141:20 Seq 3.80, 4.92 A assign (resid 36 and name HA) (resid 83 and name HG2*) 3.65 1.85 1.85 ! 0.9783 2142:20 Long 2.31, 4.62 A assign (resid 84 and name HN) (resid 84 and name HB2) 3.15 1.35 1.35 ! 0.0000 2143:20 Intra 2.63, 2.93 A assign (resid 85 and name HD*) (resid 85 and name HB2) 3.65 1.85 1.85 ! 0.0000 2146:20 Intra 3.89, 3.98 A assign (resid 85 and name HB2) (resid 85 and name HG1) 2.65 0.85 0.85 ! 0.0000 2147:20 Intra 2.66, 2.68 A assign (resid 85 and name HD*) (resid 85 and name HG1) 3.15 1.35 1.35 ! 0.0000 2148:20 Intra 2.24, 2.51 A assign (resid 85 and name HA) (resid 85 and name HG1) 3.15 1.35 1.35 ! 0.7621 2149:20 Ambig 4.02, 4.07 A or (resid 86 and name HB) (resid 85 and name HG1) ! 0.2084 2149:20 ----- 4.99, 6.26 A assign (resid 65 and name HA) (resid 85 and name HG1) 3.15 1.35 1.35 ! 0.5275 2150:20 Ambig 4.32, 4.97 A or (resid 67 and name HA) (resid 85 and name HG1) ! 0.4725 2150:20 ----- 4.40, 5.29 A assign (resid 65 and name HB2) (resid 85 and name HG2) 3.65 1.85 1.85 ! 0.0000 2151:20 Long 3.73, 4.16 A assign (resid 85 and name HD*) (resid 85 and name HG2) 2.65 0.85 0.85 ! 0.0000 2152:20 Intra 2.25, 2.61 A assign (resid 74 and name HA) (resid 75 and name HD1) 2.30 0.50 0.50 ! 0.0000 2153:20 Seq 2.42, 2.68 A assign (resid 90 and name HB1) (resid 86 and name HG2*) 4.15 2.35 2.35 ! 0.0000 2154:20 Mid 4.95, 6.67 A assign (resid 85 and name HB2) (resid 86 and name HG2*) 3.65 1.85 1.85 ! 0.0000 2155:20 Seq 3.64, 5.97 A assign (resid 89 and name HB2) (resid 86 and name HG2*) 2.65 0.85 0.85 ! 0.9446 2156:20 Mid 1.89, 3.33 A assign (resid 85 and name HG2) (resid 86 and name HG2*) 2.65 0.85 0.85 ! 0.6586 2157:20 Ambig 2.89, 4.96 A or (resid 89 and name HB1) (resid 86 and name HG2*) ! 0.3414 2157:20 ----- 3.22, 4.69 A assign (resid 127 and name HN) (resid 126 and name HB*) 2.30 0.50 0.50 ! 0.4060 2159:20 Ambig 2.78, 3.64 A or (resid 137 and name HN) (resid 136 and name HB*) ! 0.3354 2159:20 ----- 2.87, 3.82 A or (resid 8 and name HN) (resid 136 and name HB*) ! 0.2294 2159:20 ----- 3.06, 4.67 A assign (resid 87 and name HN) (resid 86 and name HA) 3.65 1.85 1.85 ! 0.0000 2160:20 Seq 2.70, 3.03 A assign (resid 88 and name HN) (resid 87 and name HA) 3.65 1.85 1.85 ! 0.7328 2161:20 Ambig 3.31, 3.37 A or (resid 56 and name HN) (resid 98 and name HA) ! 0.2549 2161:20 ----- 3.94, 4.12 A assign (resid 87 and name HA) (resid 87 and name HG) 3.65 1.85 1.85 ! 0.0000 2162:20 Intra 3.70, 3.75 A assign (resid 87 and name HN) (resid 87 and name HG) 3.65 1.85 1.85 ! 0.9996 2163:20 Intra 2.00, 2.10 A assign (resid 87 and name HB1) (resid 87 and name HG) 2.65 0.85 0.85 ! 0.9460 2164:20 Intra 2.51, 2.54 A assign (resid 87 and name HB2) (resid 87 and name HG) 3.15 1.35 1.35 ! 0.9923 2165:20 Intra 3.02, 3.02 A assign (resid 87 and name HA) (resid 87 and name HD1*) 3.15 1.35 1.35 ! 0.7744 2167:20 Ambig 3.97, 4.57 A or (resid 7 and name HA) (resid 8 and name HD1*) ! 0.1612 2167:20 ----- 5.15, 6.64 A assign (resid 87 and name HN) (resid 87 and name HD1*) 3.65 1.85 1.85 ! 0.0000 2168:20 Intra 3.21, 4.06 A assign (resid 8 and name HG) (resid 123 and name HD2*) 2.30 0.50 0.50 ! 0.3982 2170:20 Ambig 2.07, 3.93 A or (resid 39 and name HB*) (resid 123 and name HD2*) ! 0.2820 2170:20 ----- 2.19, 4.17 A or (resid 87 and name HB1) (resid 87 and name HD2*) ! 0.1766 2170:20 ----- 2.37, 2.98 A or (resid 123 and name HB1) (resid 123 and name HD2*) ! 0.1315 2170:20 ----- 2.49, 3.22 A assign (resid 87 and name HB2) (resid 87 and name HD2*) 2.65 0.85 0.85 ! 0.9085 2171:20 Ambig 2.54, 3.18 A or (resid 118 and name HB) (resid 123 and name HD2*) ! 0.0651 2171:20 ----- 3.94, 6.88 A assign (resid 87 and name HG) (resid 87 and name HD2*) 2.30 0.50 0.50 ! 0.5356 2172:20 Ambig 2.41, 2.62 A or (resid 123 and name HB2) (resid 123 and name HD2*) ! 0.3707 2172:20 ----- 2.56, 3.84 A or (resid 134 and name HB1) (resid 123 and name HD2*) ! 0.0535 2172:20 ----- 3.53, 5.88 A assign (resid 128 and name HB1) (resid 88 and name HA) 4.15 2.35 2.35 ! 0.0000 2173:20 Long 5.60, 6.25 A assign (resid 87 and name HB2) (resid 88 and name HA) 3.65 1.85 1.85 ! 0.0000 2174:20 Seq 4.50, 4.57 A assign (resid 89 and name HN) (resid 88 and name HA) 3.65 1.85 1.85 ! 0.0000 2176:20 Seq 3.32, 3.42 A assign (resid 89 and name HN) (resid 88 and name HB*) 2.65 0.85 0.85 ! 0.0000 2177:20 Seq 2.78, 3.64 A assign (resid 88 and name HN) (resid 88 and name HB*) 2.65 0.85 0.85 ! 0.0000 2181:20 Intra 2.45, 2.93 A assign (resid 51 and name HB2) (resid 102 and name HB1) 2.65 0.85 0.85 ! 0.0000 2182:20 Ambig 2.21, 3.40 A or (resid 51 and name HB1) (resid 102 and name HB1) ! 0.0000 2182:20 ----- 0.00, 0.00 A assign (resid 90 and name HA) (resid 90 and name HB1) 3.65 1.85 1.85 ! 0.0000 2183:20 Intra 2.38, 2.44 A assign (resid 140 and name HA1) (resid 10 and name HB) 3.15 1.35 1.35 ! 0.8361 2185:20 Ambig 2.81, 3.36 A or (resid 149 and name HD2) (resid 149 and name HB1) ! 0.1273 2185:20 ----- 3.84, 3.90 A assign (resid 149 and name HD1) (resid 149 and name HB1) 2.65 0.85 0.85 ! 0.8783 2186:20 Ambig 2.94, 3.06 A or (resid 138 and name HB1) (resid 10 and name HB) ! 0.0623 2186:20 ----- 4.56, 5.30 A assign (resid 149 and name HD2) (resid 149 and name HG*) 2.65 0.85 0.85 ! 0.0000 2187:20 Intra 2.26, 2.50 A assign (resid 149 and name HD1) (resid 149 and name HG*) 2.65 0.85 0.85 ! 0.0000 2188:20 Intra 2.25, 2.64 A assign (resid 149 and name HB2) (resid 149 and name HG*) 2.30 0.50 0.50 ! 0.0000 2189:20 Intra 2.27, 2.50 A assign (resid 149 and name HB2) (resid 149 and name HD1) 3.65 1.85 1.85 ! 0.0000 2190:20 Intra 3.88, 3.94 A assign (resid 149 and name HB2) (resid 149 and name HD2) 3.65 1.85 1.85 ! 0.0000 2191:20 Intra 3.78, 4.00 A assign (resid 92 and name HD1*) (resid 92 and name HA) 3.65 1.85 1.85 ! 0.0000 2192:20 Intra 4.39, 4.72 A assign (resid 94 and name HN) (resid 92 and name HA) 3.15 1.35 1.35 ! 0.9265 2193:20 Mid 3.08, 3.26 A assign (resid 92 and name HD1*) (resid 92 and name HG11) 2.65 0.85 0.85 ! 0.0000 2194:20 Intra 2.42, 2.63 A assign (resid 92 and name HD1*) (resid 92 and name HG12) 2.65 0.85 0.85 ! 0.0000 2195:20 Intra 2.42, 2.62 A assign (resid 92 and name HA) (resid 92 and name HG12) 3.15 1.35 1.35 ! 0.9722 2197:20 Intra 2.59, 2.65 A assign (resid 92 and name HA) (resid 92 and name HG11) 3.15 1.35 1.35 ! 0.6834 2198:20 Ambig 3.08, 3.17 A or (resid 87 and name HA) (resid 92 and name HG11) ! 0.2387 2198:20 ----- 3.67, 4.70 A assign (resid 92 and name HN) (resid 92 and name HG12) 3.65 1.85 1.85 ! 0.0000 2199:20 Intra 3.22, 3.44 A assign (resid 37 and name HG12) (resid 92 and name HD1*) 3.65 1.85 1.85 ! 0.7083 2200:20 Ambig 4.48, 6.08 A or (resid 87 and name HB2) (resid 92 and name HD1*) ! 0.2917 2200:20 ----- 5.19, 6.86 A assign (resid 34 and name HA) (resid 92 and name HD1*) 4.15 2.35 2.35 ! 0.0000 2201:20 Long 5.33, 6.84 A assign (resid 92 and name HD1*) (resid 92 and name HG2*) 2.30 0.50 0.50 ! 0.0000 2202:20 Intra 1.99, 3.65 A assign (resid 92 and name HB) (resid 92 and name HG2*) 2.30 0.50 0.50 ! 0.0000 2203:20 Intra 2.39, 2.65 A assign (resid 59 and name HN) (resid 92 and name HG2*) 4.15 2.35 2.35 ! 0.0000 2205:20 Long 5.01, 6.20 A assign (resid 24 and name HB1) (resid 97 and name HG2*) 2.65 0.85 0.85 ! 0.9030 2206:20 Ambig 2.54, 3.84 A or (resid 25 and name HB) (resid 97 and name HG2*) ! 0.0970 2206:20 ----- 3.68, 4.70 A assign (resid 99 and name HB*) (resid 97 and name HG2*) 3.15 1.35 1.35 ! 0.5557 2208:20 Ambig 5.02, 5.88 A or (resid 26 and name HG2*) (resid 97 and name HG2*) ! 0.4443 2208:20 ----- 5.21, 7.27 A assign (resid 30 and name HG2*) (resid 93 and name HB2) 3.15 1.35 1.35 ! 0.7399 2209:20 Ambig 3.94, 5.62 A or (resid 30 and name HG1*) (resid 93 and name HB2) ! 0.2601 2209:20 ----- 4.69, 6.39 A assign (resid 93 and name HA) (resid 93 and name HB2) 2.65 0.85 0.85 ! 0.9962 2210:20 Intra 2.52, 2.57 A assign (resid 93 and name HA) (resid 93 and name HB1) 2.30 0.50 0.50 ! 0.0000 2211:20 Intra 2.34, 2.38 A assign (resid 94 and name HN) (resid 93 and name HB1) 3.15 1.35 1.35 ! 0.3258 2212:20 Ambig 4.38, 4.51 A or (resid 82 and name HD*) (resid 67 and name HB*) ! 0.3077 2212:20 ----- 4.42, 6.86 A or (resid 66 and name HN) (resid 67 and name HB*) ! 0.2458 2212:20 ----- 4.59, 5.17 A or (resid 68 and name HD*) (resid 67 and name HB*) ! 0.1207 2212:20 ----- 5.17, 6.96 A assign (resid 94 and name HN) (resid 94 and name HA) 3.65 1.85 1.85 ! 0.0000 2213:20 Intra 2.88, 2.90 A assign (resid 134 and name HE2) (resid 134 and name HB1) 4.15 2.35 2.35 ! 0.9687 2214:20 Intra 2.82, 4.67 A assign (resid 94 and name HN) (resid 94 and name HB) 3.65 1.85 1.85 ! 0.0000 2215:20 Intra 3.70, 3.79 A assign (resid 95 and name HN) (resid 94 and name HG1*) 3.15 1.35 1.35 ! 0.0000 2216:20 Seq 3.73, 4.51 A assign (resid 94 and name HB) (resid 94 and name HG1*) 2.30 0.50 0.50 ! 0.0000 2217:20 Intra 2.40, 2.64 A assign (resid 142 and name HD1*) (resid 23 and name HG2*) 2.65 0.85 0.85 ! 0.9331 2218:20 Long 2.18, 4.07 A assign (resid 106 and name HB2) (resid 106 and name HA) 3.15 1.35 1.35 ! 0.0000 2219:20 Intra 2.50, 2.65 A assign (resid 95 and name HB1) (resid 95 and name HA) 3.15 1.35 1.35 ! 0.0000 2220:20 Intra 2.41, 2.50 A assign (resid 95 and name HN) (resid 95 and name HA) 3.65 1.85 1.85 ! 0.0000 2221:20 Intra 2.86, 2.91 A assign (resid 95 and name HA) (resid 95 and name HB1) 2.65 0.85 0.85 ! 0.9801 2222:20 Intra 2.41, 2.50 A assign (resid 124 and name HG2*) (resid 132 and name HB2) 4.15 2.35 2.35 ! 0.9671 2223:20 Long 2.20, 3.84 A assign (resid 27 and name HG2*) (resid 96 and name HA2) 3.65 1.85 1.85 ! 0.0000 2226:20 Long 4.61, 5.32 A assign (resid 26 and name HG2*) (resid 97 and name HA) 2.65 0.85 0.85 ! 0.8807 2228:20 Ambig 3.28, 4.48 A or (resid 105 and name HG2*) (resid 107 and name HA) ! 0.1098 2228:20 ----- 4.64, 6.03 A assign (resid 97 and name HB) (resid 97 and name HA) 3.15 1.35 1.35 ! 0.9220 2229:20 Intra 3.04, 3.05 A assign (resid 99 and name HN) (resid 97 and name HA) 3.15 1.35 1.35 ! 0.0000 2231:20 Mid 4.10, 4.25 A assign (resid 98 and name HB1) (resid 97 and name HA) 3.65 1.85 1.85 ! 0.0000 2232:20 Seq 4.50, 4.57 A assign (resid 97 and name HG2*) (resid 97 and name HB) 2.30 0.50 0.50 ! 0.0000 2233:20 Intra 2.40, 2.63 A assign (resid 98 and name HN) (resid 97 and name HG11) 4.15 2.35 2.35 ! 0.5911 2235:20 Ambig 3.97, 4.19 A or (resid 26 and name HN) (resid 97 and name HG11) ! 0.2118 2235:20 ----- 4.70, 5.24 A or (resid 27 and name HN) (resid 97 and name HG11) ! 0.1971 2235:20 ----- 4.76, 5.30 A assign (resid 59 and name HB1) (resid 92 and name HD1*) 2.65 0.85 0.85 ! 0.9865 2236:20 Long 2.38, 3.82 A assign (resid 19 and name HB2) (resid 105 and name HD1*) 3.65 1.85 1.85 ! 0.0000 2237:20 Long 4.39, 5.98 A assign (resid 19 and name HB1) (resid 105 and name HD1*) 2.65 0.85 0.85 ! 0.9613 2238:20 Long 2.72, 4.30 A assign (resid 105 and name HB) (resid 105 and name HD1*) 2.65 0.85 0.85 ! 0.0000 2239:20 Intra 2.57, 3.18 A assign (resid 105 and name HG1*) (resid 105 and name HD1*) 2.30 0.50 0.50 ! 0.0000 2240:20 Intra 2.40, 2.62 A assign (resid 105 and name HG2*) (resid 105 and name HD1*) 2.30 0.50 0.50 ! 0.9957 2241:20 Intra 2.01, 3.62 A assign (resid 104 and name HA) (resid 105 and name HD1*) 3.65 1.85 1.85 ! 0.6842 2242:20 Ambig 5.73, 6.29 A or (resid 143 and name HA) (resid 105 and name HD1*) ! 0.3158 2242:20 ----- 6.52, 7.32 A assign (resid 16 and name HD21) (resid 105 and name HD1*) 3.15 1.35 1.35 ! 0.6026 2243:20 Ambig 4.43, 6.08 A or (resid 18 and name HN) (resid 105 and name HD1*) ! 0.3974 2243:20 ----- 4.74, 5.67 A assign (resid 98 and name HB2) (resid 98 and name HA) 3.15 1.35 1.35 ! 0.7422 2244:20 Ambig 2.44, 2.46 A or (resid 59 and name HB2) (resid 98 and name HA) ! 0.2578 2244:20 ----- 2.91, 3.63 A assign (resid 98 and name HN) (resid 98 and name HA) 3.15 1.35 1.35 ! 0.9574 2245:20 Intra 2.88, 2.91 A assign (resid 25 and name HG2*) (resid 98 and name HB1) 3.15 1.35 1.35 ! 0.2605 2246:20 Ambig 4.18, 4.95 A or (resid 39 and name HE*) (resid 98 and name HB1) ! 0.2521 2246:20 ----- 4.21, 6.09 A or (resid 8 and name HD1*) (resid 98 and name HB1) ! 0.2048 2246:20 ----- 4.35, 5.44 A or (resid 8 and name HD2*) (resid 98 and name HB1) ! 0.1787 2246:20 ----- 4.45, 7.27 A or (resid 37 and name HG2*) (resid 98 and name HB1) ! 0.0940 2246:20 ----- 4.96, 6.33 A assign (resid 25 and name HG1*) (resid 98 and name HB2) 3.65 1.85 1.85 ! 0.4902 2247:20 Ambig 3.54, 4.60 A or (resid 8 and name HD2*) (resid 98 and name HB2) ! 0.1509 2247:20 ----- 4.31, 6.68 A or (resid 37 and name HD1*) (resid 98 and name HB2) ! 0.1346 2247:20 ----- 4.39, 6.42 A or (resid 37 and name HG2*) (resid 98 and name HB2) ! 0.0877 2247:20 ----- 4.71, 6.26 A or (resid 39 and name HE*) (resid 98 and name HB2) ! 0.0651 2247:20 ----- 4.95, 7.07 A assign (resid 98 and name HN) (resid 98 and name HD1*) 3.65 1.85 1.85 ! 0.7543 2248:20 Ambig 4.74, 5.22 A or (resid 27 and name HN) (resid 98 and name HD1*) ! 0.2457 2248:20 ----- 5.72, 6.86 A assign (resid 37 and name HB) (resid 98 and name HD1*) 4.15 2.35 2.35 ! 0.0000 2249:20 Long 3.56, 5.28 A assign (resid 98 and name HB1) (resid 98 and name HD1*) 2.65 0.85 0.85 ! 0.5617 2250:20 Ambig 3.68, 3.90 A or (resid 37 and name HG11) (resid 98 and name HD1*) ! 0.2435 2250:20 ----- 4.23, 5.60 A or (resid 92 and name HG12) (resid 98 and name HD1*) ! 0.1069 2250:20 ----- 4.85, 6.42 A or (resid 34 and name HG2*) (resid 98 and name HD1*) ! 0.0879 2250:20 ----- 5.01, 7.20 A assign (resid 98 and name HG) (resid 98 and name HD1*) 2.30 0.50 0.50 ! 0.8533 2251:20 Ambig 2.41, 2.63 A or (resid 27 and name HB) (resid 98 and name HD1*) ! 0.1028 2251:20 ----- 3.43, 4.89 A assign (resid 98 and name HA) (resid 98 and name HD2*) 3.65 1.85 1.85 ! 0.0000 2252:20 Intra 4.41, 4.71 A assign (resid 98 and name HG) (resid 98 and name HD2*) 2.30 0.50 0.50 ! 0.4832 2253:20 Ambig 2.41, 2.63 A or (resid 98 and name HB2) (resid 98 and name HD2*) ! 0.4070 2253:20 ----- 2.48, 3.12 A or (resid 27 and name HB) (resid 98 and name HD2*) ! 0.1057 2253:20 ----- 3.10, 4.50 A assign (resid 37 and name HB) (resid 98 and name HD2*) 3.15 1.35 1.35 ! 0.8451 2254:20 Ambig 3.00, 4.71 A or (resid 8 and name HG) (resid 98 and name HD2*) ! 0.1017 2254:20 ----- 4.27, 5.86 A assign (resid 98 and name HB1) (resid 98 and name HD2*) 2.65 0.85 0.85 ! 0.9126 2255:20 Ambig 2.37, 3.02 A or (resid 37 and name HG11) (resid 98 and name HD2*) ! 0.0802 2255:20 ----- 3.55, 5.51 A assign (resid 92 and name HD1*) (resid 98 and name HD2*) 3.65 1.85 1.85 ! 0.0000 2256:20 Long 4.97, 7.74 A assign (resid 98 and name HN) (resid 98 and name HD2*) 3.65 1.85 1.85 ! 0.6778 2257:20 Ambig 4.74, 5.27 A or (resid 27 and name HN) (resid 98 and name HD2*) ! 0.1936 2257:20 ----- 5.84, 6.85 A or (resid 26 and name HN) (resid 98 and name HD2*) ! 0.1287 2257:20 ----- 6.25, 7.23 A assign (resid 99 and name HN) (resid 98 and name HD2*) 3.65 1.85 1.85 ! 0.0000 2258:20 Seq 3.98, 5.01 A assign (resid 82 and name HE*) (resid 98 and name HD2*) 3.65 1.85 1.85 ! 0.0000 2259:20 Long 2.68, 5.51 A assign (resid 101 and name HN) (resid 100 and name HB*) 3.65 1.85 1.85 ! 0.0000 2261:20 Seq 3.17, 3.80 A assign (resid 53 and name HB) (resid 101 and name HB*) 3.65 1.85 1.85 ! 0.0000 2262:20 Long 4.71, 5.42 A assign (resid 101 and name HA) (resid 101 and name HB*) 3.65 1.85 1.85 ! 0.9986 2263:20 Intra 2.35, 2.70 A assign (resid 25 and name HG2*) (resid 101 and name HG) 2.30 0.50 0.50 ! 0.3623 2264:20 Ambig 2.31, 3.11 A or (resid 101 and name HB*) (resid 101 and name HG) ! 0.2753 2264:20 ----- 2.42, 2.73 A or (resid 101 and name HD2*) (resid 101 and name HG) ! 0.2644 2264:20 ----- 2.43, 2.64 A or (resid 23 and name HG1*) (resid 101 and name HG) ! 0.0714 2264:20 ----- 3.03, 4.64 A assign (resid 101 and name HN) (resid 101 and name HG) 3.15 1.35 1.35 ! 0.9984 2265:20 Intra 2.21, 2.32 A assign (resid 101 and name HG) (resid 101 and name HD1*) 2.30 0.50 0.50 ! 0.9884 2266:20 Intra 2.40, 2.62 A assign (resid 53 and name HB) (resid 101 and name HD1*) 3.65 1.85 1.85 ! 0.0000 2267:20 Long 5.96, 6.47 A assign (resid 23 and name HB) (resid 101 and name HD1*) 3.65 1.85 1.85 ! 0.9963 2268:20 Long 2.23, 3.74 A assign (resid 101 and name HA) (resid 101 and name HD1*) 3.15 1.35 1.35 ! 0.0000 2269:20 Intra 4.37, 4.74 A assign (resid 53 and name HB) (resid 101 and name HD2*) 2.65 0.85 0.85 ! 0.9977 2270:20 Long 2.51, 3.55 A assign (resid 101 and name HG) (resid 101 and name HD2*) 2.30 0.50 0.50 ! 0.9726 2271:20 Intra 2.43, 2.64 A assign (resid 23 and name HB) (resid 101 and name HD2*) 3.65 1.85 1.85 ! 0.5222 2272:20 Ambig 4.99, 5.56 A or (resid 39 and name HG*) (resid 101 and name HD2*) ! 0.4778 2272:20 ----- 5.06, 6.66 A assign (resid 101 and name HN) (resid 101 and name HD2*) 3.15 1.35 1.35 ! 0.9805 2273:20 Intra 3.24, 4.08 A assign (resid 23 and name HN) (resid 102 and name HA) 3.15 1.35 1.35 ! 0.0000 2274:20 Long 3.48, 3.65 A assign (resid 20 and name HG2*) (resid 102 and name HB1) 3.65 1.85 1.85 ! 0.0000 2275:20 Long 4.85, 5.31 A assign (resid 20 and name HG2*) (resid 102 and name HB2) 3.65 1.85 1.85 ! 0.0000 2276:20 Long 5.12, 5.75 A assign (resid 102 and name HA) (resid 102 and name HB2) 3.65 1.85 1.85 ! 0.0000 2277:20 Intra 2.48, 2.58 A assign (resid 103 and name HN) (resid 102 and name HB2) 3.65 1.85 1.85 ! 0.0000 2278:20 Seq 4.39, 4.47 A assign (resid 102 and name HN) (resid 102 and name HB2) 3.15 1.35 1.35 ! 0.9964 2279:20 Intra 2.53, 2.69 A assign (resid 103 and name HN) (resid 103 and name HB2) 3.65 1.85 1.85 ! 0.9735 2280:20 Intra 2.54, 2.60 A assign (resid 103 and name HN) (resid 103 and name HB1) 3.65 1.85 1.85 ! 0.6973 2281:20 Ambig 3.71, 3.75 A or (resid 105 and name HN) (resid 103 and name HB1) ! 0.1777 2281:20 ----- 4.66, 4.90 A or (resid 51 and name HN) (resid 103 and name HB1) ! 0.1250 2281:20 ----- 4.94, 5.32 A assign (resid 103 and name HD*) (resid 103 and name HB2) 3.15 1.35 1.35 ! 0.9291 2282:20 Intra 2.30, 3.01 A assign (resid 103 and name HD*) (resid 103 and name HB1) 3.15 1.35 1.35 ! 0.7391 2283:20 Ambig 2.38, 3.03 A or (resid 48 and name HD*) (resid 103 and name HB1) ! 0.2609 2283:20 ----- 2.84, 4.36 A assign (resid 103 and name HA) (resid 103 and name HB1) 3.65 1.85 1.85 ! 0.9964 2284:20 Intra 2.46, 2.49 A assign (resid 21 and name HG1*) (resid 103 and name HB2) 2.65 0.85 0.85 ! 0.9918 2285:20 Long 2.20, 2.80 A assign (resid 21 and name HG1*) (resid 103 and name HB1) 3.15 1.35 1.35 ! 0.9544 2286:20 Long 3.38, 4.03 A assign (resid 142 and name HD1*) (resid 142 and name HB) 2.65 0.85 0.85 ! 0.0000 2287:20 Intra 2.57, 3.16 A assign (resid 142 and name HG2*) (resid 142 and name HB) 2.65 0.85 0.85 ! 0.0000 2288:20 Intra 2.43, 2.65 A assign (resid 142 and name HG11) (resid 142 and name HB) 3.15 1.35 1.35 ! 0.0000 2289:20 Intra 2.48, 2.49 A assign (resid 142 and name HN) (resid 142 and name HB) 3.15 1.35 1.35 ! 0.9930 2290:20 Intra 2.50, 2.59 A assign (resid 116 and name HD1*) (resid 142 and name HB) 3.65 1.85 1.85 ! 0.0000 2291:20 Long 4.07, 5.71 A assign (resid 142 and name HA) (resid 142 and name HB) 3.65 1.85 1.85 ! 0.9957 2294:20 Intra 3.03, 3.04 A assign (resid 104 and name HA) (resid 104 and name HD1*) 3.15 1.35 1.35 ! 0.0000 2295:20 Intra 4.40, 4.71 A assign (resid 51 and name HE*) (resid 104 and name HD1*) 3.15 1.35 1.35 ! 0.0000 2296:20 Long 2.76, 4.67 A assign (resid 104 and name HG12) (resid 104 and name HD1*) 2.30 0.50 0.50 ! 0.0000 2297:20 Intra 2.35, 2.63 A assign (resid 104 and name HG11) (resid 104 and name HD1*) 2.30 0.50 0.50 ! 0.0000 2298:20 Intra 2.36, 2.63 A assign (resid 104 and name HB) (resid 104 and name HD1*) 2.65 0.85 0.85 ! 0.0000 2300:20 Intra 2.46, 3.11 A assign (resid 19 and name HN) (resid 105 and name HB) 3.65 1.85 1.85 ! 0.9972 2302:20 Long 2.73, 3.01 A assign (resid 105 and name HG1*) (resid 105 and name HB) 3.15 1.35 1.35 ! 0.0000 2303:20 Intra 2.43, 2.74 A assign (resid 105 and name HN) (resid 105 and name HG1*) 3.15 1.35 1.35 ! 0.9898 2304:20 Intra 2.17, 2.84 A assign (resid 124 and name HN) (resid 124 and name HG11) 3.65 1.85 1.85 ! 0.0000 2305:20 Intra 2.45, 2.88 A assign (resid 106 and name HN) (resid 106 and name HA) 3.65 1.85 1.85 ! 0.0000 2306:20 Intra 2.74, 2.78 A assign (resid 106 and name HD21) (resid 106 and name HB1) 3.15 1.35 1.35 ! 0.9981 2307:20 Intra 2.14, 2.77 A assign (resid 108 and name HD22) (resid 108 and name HB2) 3.65 1.85 1.85 ! 0.8520 2308:20 Ambig 3.44, 3.78 A or (resid 106 and name HD21) (resid 108 and name HB2) ! 0.1480 2308:20 ----- 4.60, 5.37 A assign (resid 106 and name HD21) (resid 108 and name HB1) 3.15 1.35 1.35 ! 0.7083 2309:20 Ambig 2.98, 3.93 A or (resid 108 and name HD22) (resid 108 and name HB1) ! 0.2917 2309:20 ----- 3.46, 3.65 A assign (resid 111 and name HN) (resid 111 and name HB*) 2.30 0.50 0.50 ! 0.9930 2310:20 Intra 2.44, 2.91 A assign (resid 106 and name HD21) (resid 109 and name HB*) 3.15 1.35 1.35 ! 0.0000 2311:20 Mid 3.73, 5.40 A assign (resid 106 and name HB1) (resid 109 and name HB*) 2.65 0.85 0.85 ! 0.9198 2312:20 Ambig 1.93, 3.31 A or (resid 47 and name HE*) (resid 109 and name HB*) ! 0.0791 2312:20 ----- 2.91, 5.24 A assign (resid 106 and name HB2) (resid 109 and name HB*) 3.15 1.35 1.35 ! 0.9825 2313:20 Mid 2.13, 4.14 A assign (resid 144 and name HB) (resid 111 and name HB*) 2.65 0.85 0.85 ! 0.8915 2314:20 Ambig 3.36, 4.34 A or (resid 144 and name HB) (resid 109 and name HB*) ! 0.1085 2314:20 ----- 4.77, 6.10 A assign (resid 17 and name HG1) (resid 109 and name HB*) 2.65 0.85 0.85 ! 0.5659 2315:20 Ambig 2.35, 4.56 A or (resid 17 and name HB1) (resid 109 and name HB*) ! 0.3804 2315:20 ----- 2.51, 4.08 A assign (resid 47 and name HG1) (resid 109 and name HB*) 2.30 0.50 0.50 ! 0.8742 2316:20 Ambig 1.88, 3.02 A or (resid 144 and name HG1*) (resid 111 and name HB*) ! 0.0816 2316:20 ----- 2.79, 4.64 A assign (resid 144 and name HN) (resid 111 and name HA) 3.65 1.85 1.85 ! 0.9622 2317:20 Long 4.08, 4.49 A assign (resid 23 and name HG1*) (resid 140 and name HA1) 3.15 1.35 1.35 ! 0.7965 2319:20 Ambig 2.37, 4.01 A or (resid 10 and name HG2*) (resid 140 and name HA1) ! 0.1154 2319:20 ----- 3.27, 4.66 A or (resid 23 and name HG2*) (resid 140 and name HA1) ! 0.0564 2319:20 ----- 3.69, 5.45 A assign (resid 116 and name HD2*) (resid 116 and name HB2) 3.65 1.85 1.85 ! 0.0000 2320:20 Intra 3.71, 3.91 A assign (resid 116 and name HD2*) (resid 116 and name HB1) 3.15 1.35 1.35 ! 0.0000 2321:20 Intra 2.53, 3.15 A assign (resid 117 and name HN) (resid 117 and name HA) 3.65 1.85 1.85 ! 0.9306 2322:20 Intra 2.87, 2.91 A assign (resid 33 and name HD1) (resid 32 and name HA) 2.65 0.85 0.85 ! 0.0000 2323:20 Seq 2.00, 2.27 A assign (resid 33 and name HD2) (resid 32 and name HA) 3.15 1.35 1.35 ! 0.9710 2324:20 Seq 2.07, 2.47 A assign (resid 137 and name HB*) (resid 10 and name HG2*) 3.65 1.85 1.85 ! 0.9480 2325:20 Long 3.62, 6.10 A assign (resid 118 and name HG2*) (resid 118 and name HB) 2.30 0.50 0.50 ! 0.4530 2327:20 Ambig 2.39, 2.64 A or (resid 118 and name HG1*) (resid 118 and name HB) ! 0.4502 2327:20 ----- 2.39, 2.63 A or (resid 8 and name HD2*) (resid 6 and name HB) ! 0.0494 2327:20 ----- 3.46, 5.57 A assign (resid 7 and name HN) (resid 7 and name HB*) 2.30 0.50 0.50 ! 0.9344 2328:20 Intra 2.35, 3.05 A assign (resid 120 and name HB1) (resid 121 and name HA) 3.65 1.85 1.85 ! 0.6867 2330:20 Ambig 4.95, 5.19 A or (resid 120 and name HG*) (resid 121 and name HA) ! 0.3133 2330:20 ----- 5.65, 6.19 A assign (resid 122 and name HN) (resid 121 and name HA) 3.65 1.85 1.85 ! 0.0000 2331:20 Seq 3.47, 3.51 A assign (resid 120 and name HG*) (resid 121 and name HB*) 3.65 1.85 1.85 ! 0.6268 2332:20 Ambig 5.23, 6.75 A or (resid 120 and name HB1) (resid 121 and name HB*) ! 0.3732 2332:20 ----- 5.70, 6.60 A assign (resid 124 and name HG12) (resid 124 and name HA) 3.15 1.35 1.35 ! 0.6449 2334:20 Ambig 2.58, 2.72 A or (resid 124 and name HB) (resid 124 and name HA) ! 0.2421 2334:20 ----- 3.03, 3.04 A or (resid 124 and name HG12) (resid 122 and name HA) ! 0.0345 2334:20 ----- 4.20, 4.66 A assign (resid 122 and name HN) (resid 122 and name HA) 3.65 1.85 1.85 ! 0.0000 2335:20 Intra 2.83, 2.87 A assign (resid 123 and name HN) (resid 123 and name HB1) 3.65 1.85 1.85 ! 0.0000 2338:20 Intra 2.43, 2.72 A assign (resid 123 and name HN) (resid 123 and name HB2) 3.65 1.85 1.85 ! 0.0000 2339:20 Intra 2.09, 2.38 A assign (resid 123 and name HD1*) (resid 123 and name HB1) 2.65 0.85 0.85 ! 0.9603 2342:20 Intra 2.43, 3.09 A assign (resid 123 and name HB1) (resid 123 and name HD1*) 2.30 0.50 0.50 ! 0.8461 2345:20 Ambig 2.43, 3.09 A or (resid 39 and name HB*) (resid 123 and name HD1*) ! 0.1539 2345:20 ----- 3.23, 4.60 A assign (resid 136 and name HB*) (resid 123 and name HD1*) 2.65 0.85 0.85 ! 0.9385 2346:20 Long 2.05, 3.88 A assign (resid 134 and name HD*) (resid 123 and name HD1*) 2.30 0.50 0.50 ! 0.3487 2347:20 Ambig 2.35, 4.98 A or (resid 123 and name HB2) (resid 123 and name HD1*) ! 0.3269 2347:20 ----- 2.37, 3.12 A or (resid 36 and name HG) (resid 36 and name HD1*) ! 0.3168 2347:20 ----- 2.39, 2.62 A assign (resid 124 and name HN) (resid 123 and name HD1*) 3.65 1.85 1.85 ! 0.0000 2348:20 Seq 3.12, 5.74 A assign (resid 138 and name HN) (resid 123 and name HD1*) 3.65 1.85 1.85 ! 0.5382 2349:20 Ambig 4.12, 5.55 A or (resid 137 and name HN) (resid 123 and name HD1*) ! 0.3898 2349:20 ----- 4.34, 5.93 A assign (resid 136 and name HN) (resid 123 and name HD1*) 4.15 2.35 2.35 ! 0.6190 2350:20 Ambig 5.12, 6.53 A or (resid 118 and name HN) (resid 123 and name HD1*) ! 0.3810 2350:20 ----- 5.55, 7.01 A assign (resid 128 and name HB2) (resid 87 and name HD2*) 2.65 0.85 0.85 ! 0.9629 2351:20 Long 2.63, 4.19 A assign (resid 71 and name HB1) (resid 80 and name HA) 4.15 2.35 2.35 ! 0.0000 2352:20 Long 4.64, 5.21 A assign (resid 139 and name HB2) (resid 117 and name HA) 3.65 1.85 1.85 ! 0.8701 2353:20 Ambig 3.01, 4.26 A or (resid 38 and name HB2) (resid 124 and name HA) ! 0.1299 2353:20 ----- 4.13, 5.97 A assign (resid 124 and name HN) (resid 124 and name HA) 3.65 1.85 1.85 ! 0.9643 2354:20 Intra 2.93, 2.95 A assign (resid 139 and name HA) (resid 117 and name HA) 3.15 1.35 1.35 ! 0.9675 2355:20 Long 2.46, 2.93 A assign (resid 124 and name HA) (resid 124 and name HB) 3.15 1.35 1.35 ! 0.9618 2356:20 Intra 3.03, 3.04 A assign (resid 38 and name HB1) (resid 124 and name HB) 2.65 0.85 0.85 ! 0.0000 2358:20 Long 2.01, 2.29 A assign (resid 124 and name HG2*) (resid 124 and name HB) 2.30 0.50 0.50 ! 0.5601 2359:20 Ambig 2.41, 2.64 A or (resid 124 and name HD1*) (resid 124 and name HB) ! 0.4399 2359:20 ----- 2.51, 3.13 A assign (resid 124 and name HG11) (resid 124 and name HB) 3.15 1.35 1.35 ! 0.9665 2360:20 Intra 2.48, 2.53 A assign (resid 124 and name HN) (resid 124 and name HB) 2.65 0.85 0.85 ! 0.0000 2361:20 Intra 2.60, 2.73 A assign (resid 38 and name HN) (resid 124 and name HB) 3.15 1.35 1.35 ! 0.9589 2362:20 Long 2.81, 3.23 A assign (resid 124 and name HN) (resid 124 and name HG12) 3.65 1.85 1.85 ! 0.0000 2364:20 Intra 3.72, 4.01 A assign (resid 124 and name HN) (resid 124 and name HD1*) 3.15 1.35 1.35 ! 0.0000 2365:20 Intra 2.36, 4.88 A assign (resid 124 and name HG12) (resid 124 and name HD1*) 2.30 0.50 0.50 ! 0.5595 2366:20 Ambig 2.41, 2.62 A or (resid 124 and name HB) (resid 124 and name HD1*) ! 0.4349 2366:20 ----- 2.51, 3.13 A assign (resid 38 and name HB1) (resid 124 and name HD1*) 2.65 0.85 0.85 ! 0.9826 2367:20 Long 2.40, 3.97 A assign (resid 122 and name HA) (resid 124 and name HD1*) 2.65 0.85 0.85 ! 0.7790 2368:20 Ambig 2.88, 4.76 A or (resid 124 and name HA) (resid 124 and name HD1*) ! 0.1782 2368:20 ----- 3.68, 4.70 A assign (resid 38 and name HB2) (resid 124 and name HG2*) 3.15 1.35 1.35 ! 0.8806 2369:20 Ambig 3.67, 5.46 A or (resid 38 and name HB2) (resid 37 and name HG2*) ! 0.1194 2369:20 ----- 5.12, 6.15 A assign (resid 125 and name HB) (resid 125 and name HG1*) 2.30 0.50 0.50 ! 0.5122 2371:20 Ambig 2.38, 2.62 A or (resid 125 and name HB) (resid 125 and name HG2*) ! 0.4878 2371:20 ----- 2.40, 2.64 A assign (resid 127 and name HN) (resid 127 and name HB1) 3.15 1.35 1.35 ! 0.9921 2372:20 Intra 2.38, 2.49 A assign (resid 128 and name HN) (resid 128 and name HB1) 3.15 1.35 1.35 ! 0.8913 2373:20 Ambig 2.53, 2.71 A or (resid 60 and name HN) (resid 61 and name HD1) ! 0.0963 2373:20 ----- 3.67, 6.47 A assign (resid 87 and name HD1*) (resid 128 and name HB2) 2.65 0.85 0.85 ! 0.7690 2374:20 Ambig 2.12, 3.74 A or (resid 87 and name HD2*) (resid 128 and name HB2) ! 0.2121 2374:20 ----- 2.63, 4.19 A assign (resid 8 and name HD2*) (resid 8 and name HG) 2.30 0.50 0.50 ! 0.5030 2375:20 Ambig 2.40, 2.63 A or (resid 8 and name HD1*) (resid 8 and name HG) ! 0.4970 2375:20 ----- 2.40, 2.63 A assign (resid 4 and name HG1) (resid 4 and name HB2) 2.30 0.50 0.50 ! 0.5872 2376:20 Ambig 2.19, 2.32 A or (resid 4 and name HG2) (resid 4 and name HB2) ! 0.4111 2376:20 ----- 2.33, 2.56 A assign (resid 4 and name HG2) (resid 4 and name HB1) 2.30 0.50 0.50 ! 0.3910 2377:20 Ambig 2.36, 2.92 A or (resid 4 and name HG1) (resid 4 and name HB1) ! 0.3064 2377:20 ----- 2.45, 2.58 A or (resid 128 and name HB2) (resid 128 and name HG1) ! 0.2955 2377:20 ----- 2.47, 2.72 A assign (resid 131 and name HB2) (resid 129 and name HB1) 3.15 1.35 1.35 ! 0.6529 2378:20 Ambig 3.43, 3.70 A or (resid 128 and name HG1) (resid 129 and name HB1) ! 0.3471 2378:20 ----- 3.81, 4.55 A assign (resid 131 and name HG1) (resid 129 and name HB1) 3.15 1.35 1.35 ! 0.6683 2379:20 Ambig 3.41, 3.92 A or (resid 32 and name HG2*) (resid 129 and name HB1) ! 0.3317 2379:20 ----- 3.83, 5.67 A assign (resid 3 and name HD22) (resid 129 and name HB2) 3.65 1.85 1.85 ! 0.9636 2380:20 Long 2.13, 3.90 A assign (resid 130 and name HN) (resid 129 and name HB1) 3.15 1.35 1.35 ! 0.8040 2381:20 Ambig 3.51, 3.69 A or (resid 128 and name HN) (resid 129 and name HB1) ! 0.1960 2381:20 ----- 4.44, 4.83 A assign (resid 130 and name HN) (resid 129 and name HB2) 3.15 1.35 1.35 ! 0.5953 2382:20 Ambig 4.23, 4.36 A or (resid 128 and name HN) (resid 129 and name HB2) ! 0.4047 2382:20 ----- 4.51, 4.92 A assign (resid 65 and name HN) (resid 64 and name HB2) 3.65 1.85 1.85 ! 0.7297 2383:20 Ambig 3.89, 4.12 A or (resid 65 and name HD21) (resid 64 and name HB2) ! 0.2703 2383:20 ----- 4.59, 6.08 A assign (resid 65 and name HN) (resid 64 and name HB1) 3.15 1.35 1.35 ! 0.6603 2384:20 Ambig 2.60, 3.02 A or (resid 65 and name HD21) (resid 64 and name HB1) ! 0.3397 2384:20 ----- 2.91, 4.50 A assign (resid 36 and name HD2*) (resid 130 and name HA) 4.15 2.35 2.35 ! 0.7219 2385:20 Ambig 5.51, 7.17 A or (resid 87 and name HD2*) (resid 130 and name HA) ! 0.2781 2385:20 ----- 6.46, 7.25 A assign (resid 126 and name HB*) (resid 130 and name HB2) 3.65 1.85 1.85 ! 0.0000 2387:20 Mid 3.08, 4.46 A assign (resid 126 and name HB*) (resid 130 and name HB1) 3.65 1.85 1.85 ! 0.0000 2389:20 Mid 3.97, 5.17 A assign (resid 36 and name HD1*) (resid 130 and name HB2) 4.15 2.35 2.35 ! 0.9917 2390:20 Long 2.59, 5.30 A assign (resid 36 and name HD1*) (resid 130 and name HB1) 4.15 2.35 2.35 ! 0.0000 2391:20 Long 2.64, 5.98 A assign (resid 108 and name HN) (resid 106 and name HB2) 3.65 1.85 1.85 ! 0.6394 2392:20 Ambig 3.04, 4.11 A or (resid 19 and name HN) (resid 16 and name HB2) ! 0.3606 2392:20 ----- 3.34, 4.28 A assign (resid 131 and name HN) (resid 130 and name HB2) 3.15 1.35 1.35 ! 0.6673 2393:20 Ambig 4.47, 4.53 A or (resid 129 and name HN) (resid 130 and name HB2) ! 0.3327 2393:20 ----- 5.02, 6.09 A assign (resid 130 and name HN) (resid 130 and name HB1) 3.15 1.35 1.35 ! 0.9892 2394:20 Intra 3.11, 3.27 A assign (resid 7 and name HE*) (resid 7 and name HB*) 2.65 0.85 0.85 ! 0.9661 2395:20 Intra 1.97, 3.54 A assign (resid 131 and name HN) (resid 131 and name HB2) 2.65 0.85 0.85 ! 0.8807 2396:20 Ambig 2.37, 2.51 A or (resid 139 and name HN) (resid 10 and name HB) ! 0.1152 2396:20 ----- 3.33, 4.08 A assign (resid 131 and name HB1) (resid 131 and name HG1) 2.65 0.85 0.85 ! 0.0000 2397:20 Intra 2.37, 2.45 A assign (resid 131 and name HB1) (resid 131 and name HG2) 2.65 0.85 0.85 ! 0.0000 2398:20 Intra 3.00, 3.02 A assign (resid 134 and name HE2) (resid 8 and name HG) 3.65 1.85 1.85 ! 0.7229 2399:20 Ambig 3.40, 5.23 A or (resid 130 and name HB2) (resid 131 and name HD*) ! 0.1719 2399:20 ----- 4.31, 6.46 A or (resid 129 and name HB1) (resid 131 and name HD*) ! 0.1052 2399:20 ----- 4.68, 5.70 A assign (resid 131 and name HB1) (resid 131 and name HD*) 2.30 0.50 0.50 ! 0.4999 2400:20 Ambig 2.31, 2.89 A or (resid 7 and name HB*) (resid 7 and name HD*) ! 0.4936 2400:20 ----- 2.32, 3.07 A assign (resid 131 and name HG2) (resid 131 and name HD*) 2.30 0.50 0.50 ! 0.5070 2401:20 Ambig 2.43, 2.77 A or (resid 134 and name HD*) (resid 8 and name HG) ! 0.4318 2401:20 ----- 2.50, 4.79 A assign (resid 131 and name HD*) (resid 131 and name HE*) 2.30 0.50 0.50 ! 0.0000 2402:20 Intra 2.37, 2.62 A assign (resid 131 and name HG1) (resid 131 and name HE*) 2.65 0.85 0.85 ! 0.9957 2403:20 Intra 2.51, 3.41 A assign (resid 77 and name HA) (resid 77 and name HE*) 3.65 1.85 1.85 ! 0.0000 2405:20 Intra 4.39, 5.40 A assign (resid 81 and name HA) (resid 69 and name HB) 3.65 1.85 1.85 ! 0.6303 2406:20 Ambig 4.20, 4.46 A or (resid 68 and name HA) (resid 69 and name HB) ! 0.3006 2406:20 ----- 4.76, 4.89 A assign (resid 105 and name HN) (resid 104 and name HB) 3.65 1.85 1.85 ! 0.8735 2407:20 Ambig 3.87, 4.12 A or (resid 51 and name HN) (resid 104 and name HB) ! 0.0880 2407:20 ----- 5.68, 6.07 A assign (resid 103 and name HA) (resid 104 and name HB) 3.65 1.85 1.85 ! 0.0000 2408:20 Seq 4.61, 4.76 A assign (resid 104 and name HA) (resid 104 and name HB) 3.65 1.85 1.85 ! 0.0000 2409:20 Intra 3.02, 3.04 A assign (resid 24 and name HB2) (resid 97 and name HD1*) 2.65 0.85 0.85 ! 0.9988 2410:20 Long 2.02, 4.25 A assign (resid 81 and name HB) (resid 69 and name HD1*) 3.15 1.35 1.35 ! 0.0000 2411:20 Long 2.81, 4.22 A assign (resid 7 and name HB*) (resid 137 and name HB*) 3.65 1.85 1.85 ! 0.6664 2412:20 Ambig 4.80, 7.89 A or (resid 118 and name HB) (resid 136 and name HB*) ! 0.3336 2412:20 ----- 5.38, 6.95 A assign (resid 139 and name HD21) (resid 139 and name HB2) 3.15 1.35 1.35 ! 0.0000 2417:20 Intra 2.17, 2.74 A assign (resid 117 and name HA) (resid 139 and name HB2) 4.15 2.35 2.35 ! 0.9801 2418:20 Long 3.01, 4.26 A assign (resid 141 and name HG2) (resid 141 and name HB1) 2.30 0.50 0.50 ! 0.5384 2419:20 Ambig 2.32, 2.40 A or (resid 141 and name HD1) (resid 141 and name HB1) ! 0.4594 2419:20 ----- 2.38, 3.21 A assign (resid 141 and name HD1) (resid 141 and name HB2) 2.30 0.50 0.50 ! 0.8285 2420:20 Ambig 2.27, 2.63 A or (resid 141 and name HG2) (resid 141 and name HB2) ! 0.1648 2420:20 ----- 2.97, 2.99 A assign (resid 141 and name HA) (resid 141 and name HB1) 2.65 0.85 0.85 ! 0.9802 2422:20 Intra 2.98, 3.01 A assign (resid 115 and name HA) (resid 141 and name HB2) 3.65 1.85 1.85 ! 0.0000 2423:20 Long 2.74, 3.17 A assign (resid 115 and name HA) (resid 141 and name HB1) 3.15 1.35 1.35 ! 0.0000 2424:20 Long 4.15, 4.43 A assign (resid 130 and name HB1) (resid 126 and name HB*) 3.15 1.35 1.35 ! 0.9682 2425:20 Mid 3.97, 5.17 A assign (resid 134 and name HE2) (resid 136 and name HB*) 3.15 1.35 1.35 ! 0.8760 2427:20 Ambig 2.18, 3.90 A or (resid 130 and name HB2) (resid 126 and name HB*) ! 0.1119 2427:20 ----- 3.08, 4.46 A assign (resid 36 and name HN) (resid 126 and name HB*) 4.15 2.35 2.35 ! 0.0000 2428:20 Long 3.27, 4.69 A assign (resid 125 and name HN) (resid 126 and name HB*) 3.15 1.35 1.35 ! 0.5618 2430:20 Ambig 4.18, 5.18 A or (resid 13 and name HN) (resid 141 and name HG2) ! 0.4382 2430:20 ----- 4.36, 4.94 A assign (resid 143 and name HN) (resid 142 and name HA) 3.65 1.85 1.85 ! 0.9955 2431:20 Seq 2.04, 2.10 A assign (resid 13 and name HG2*) (resid 142 and name HA) 3.65 1.85 1.85 ! 0.4954 2432:20 Ambig 2.35, 3.32 A or (resid 142 and name HG12) (resid 142 and name HA) ! 0.2910 2432:20 ----- 2.57, 2.62 A or (resid 78 and name HG1*) (resid 78 and name HA) ! 0.2136 2432:20 ----- 2.70, 2.99 A assign (resid 142 and name HG2*) (resid 142 and name HA) 3.65 1.85 1.85 ! 0.0000 2433:20 Intra 2.48, 3.11 A assign (resid 142 and name HD1*) (resid 142 and name HG12) 2.65 0.85 0.85 ! 0.0000 2434:20 Intra 2.40, 2.62 A assign (resid 142 and name HD1*) (resid 142 and name HG11) 2.65 0.85 0.85 ! 0.0000 2435:20 Intra 2.42, 2.63 A assign (resid 142 and name HA) (resid 142 and name HG12) 3.65 1.85 1.85 ! 0.9758 2438:20 Intra 2.57, 2.62 A assign (resid 142 and name HA) (resid 142 and name HG11) 3.65 1.85 1.85 ! 0.9516 2439:20 Intra 3.02, 3.08 A assign (resid 142 and name HG12) (resid 142 and name HD1*) 2.30 0.50 0.50 ! 0.9446 2440:20 Intra 2.40, 2.62 A assign (resid 143 and name HA) (resid 143 and name HB) 3.65 1.85 1.85 ! 0.9868 2441:20 Intra 3.02, 3.03 A assign (resid 142 and name HA) (resid 143 and name HB) 3.65 1.85 1.85 ! 0.0000 2442:20 Seq 4.51, 4.61 A assign (resid 14 and name HN) (resid 143 and name HB) 3.65 1.85 1.85 ! 0.6433 2443:20 Ambig 4.61, 4.82 A or (resid 13 and name HN) (resid 143 and name HB) ! 0.3159 2443:20 ----- 5.20, 5.46 A assign (resid 144 and name HA) (resid 144 and name HB) 2.65 0.85 0.85 ! 0.0000 2444:20 Intra 3.01, 3.03 A assign (resid 146 and name HN) (resid 144 and name HG1*) 3.15 1.35 1.35 ! 0.9397 2445:20 Mid 2.57, 5.32 A assign (resid 144 and name HB) (resid 144 and name HG1*) 2.30 0.50 0.50 ! 0.9919 2446:20 Intra 2.42, 2.64 A assign (resid 144 and name HN) (resid 144 and name HG2*) 2.30 0.50 0.50 ! 0.8219 2447:20 Ambig 2.07, 3.11 A or (resid 118 and name HN) (resid 117 and name HG2*) ! 0.1461 2447:20 ----- 2.76, 3.92 A assign (resid 144 and name HB) (resid 144 and name HG2*) 2.30 0.50 0.50 ! 0.9933 2448:20 Intra 2.40, 2.63 A assign (resid 15 and name HA1) (resid 144 and name HG2*) 3.65 1.85 1.85 ! 0.4708 2449:20 Ambig 4.15, 5.79 A or (resid 114 and name HB1) (resid 144 and name HG2*) ! 0.4667 2449:20 ----- 4.16, 5.41 A assign (resid 142 and name HG2*) (resid 144 and name HG2*) 2.30 0.50 0.50 ! 0.0000 2450:20 Mid 2.53, 4.35 A assign (resid 145 and name HB) (resid 146 and name HA2) 3.15 1.35 1.35 ! 0.5232 2451:20 Ambig 4.17, 4.85 A or (resid 145 and name HA) (resid 146 and name HA2) ! 0.4768 2451:20 ----- 4.24, 4.58 A assign (resid 145 and name HB) (resid 146 and name HA1) 3.15 1.35 1.35 ! 0.3738 2452:20 Ambig 4.12, 4.67 A or (resid 75 and name HA) (resid 76 and name HA2) ! 0.3208 2452:20 ----- 4.23, 4.31 A or (resid 145 and name HA) (resid 146 and name HA1) ! 0.3054 2452:20 ----- 4.26, 4.45 A assign (resid 75 and name HB2) (resid 45 and name HB*) 3.65 1.85 1.85 ! 0.9964 2453:20 Long 2.11, 3.48 A assign (resid 151 and name HN) (resid 150 and name HA) 3.65 1.85 1.85 ! 0.0000 2455:20 Seq 2.08, 2.57 A assign (resid 127 and name HN) (resid 34 and name HG2*) 3.15 1.35 1.35 ! 0.6402 2456:20 Ambig 3.98, 5.32 A or (resid 34 and name HN) (resid 34 and name HG2*) ! 0.3598 2456:20 ----- 4.39, 4.58 A assign (resid 36 and name HN) (resid 34 and name HG1*) 3.65 1.85 1.85 ! 0.0000 2458:20 Mid 4.34, 5.38 A assign (resid 109 and name HB*) (resid 105 and name HG2*) 2.30 0.50 0.50 ! 0.9833 2460:20 Mid 2.15, 3.45 A assign (resid 133 and name HB) (resid 133 and name HG2*) 2.30 0.50 0.50 ! 0.9680 2461:20 Intra 2.34, 2.62 A assign (resid 105 and name HD1*) (resid 105 and name HG2*) 2.30 0.50 0.50 ! 0.0000 2462:20 Intra 2.01, 3.62 A assign (resid 142 and name HG2*) (resid 105 and name HG2*) 3.15 1.35 1.35 ! 0.0000 2463:20 Long 4.61, 6.02 A assign (resid 47 and name HB*) (resid 105 and name HG2*) 3.65 1.85 1.85 ! 0.0000 2464:20 Long 3.76, 6.49 A assign (resid 96 and name HA2) (resid 97 and name HD1*) 3.65 1.85 1.85 ! 0.9709 2465:20 Seq 2.89, 4.18 A assign (resid 97 and name HB) (resid 97 and name HD1*) 2.65 0.85 0.85 ! 0.9956 2466:20 Intra 2.56, 3.23 A assign (resid 97 and name HG11) (resid 97 and name HD1*) 2.30 0.50 0.50 ! 0.0000 2467:20 Intra 2.39, 2.62 A assign (resid 97 and name HG2*) (resid 97 and name HD1*) 2.65 0.85 0.85 ! 0.0000 2468:20 Intra 2.17, 4.67 A assign (resid 56 and name HD22) (resid 97 and name HD1*) 4.15 2.35 2.35 ! 0.0000 2469:20 Long 5.20, 6.43 A assign (resid 139 and name HD21) (resid 117 and name HG2*) 2.65 0.85 0.85 ! 0.9971 2470:20 Long 2.15, 4.20 A assign (resid 14 and name HB*) (resid 143 and name HG2*) 3.15 1.35 1.35 ! 0.0000 2471:20 Long 3.88, 5.30 A assign (resid 29 and name HB1) (resid 5 and name HG2*) 3.15 1.35 1.35 ! 0.6995 2472:20 Ambig 3.40, 6.30 A or (resid 29 and name HB1) (resid 6 and name HG2*) ! 0.1608 2472:20 ----- 4.34, 5.84 A or (resid 127 and name HB1) (resid 6 and name HG2*) ! 0.1397 2472:20 ----- 4.45, 6.31 A assign (resid 6 and name HA) (resid 6 and name HB) 2.65 0.85 0.85 ! 0.0000 2474:20 Intra 2.38, 2.94 A assign (resid 6 and name HG1*) (resid 6 and name HB) 2.30 0.50 0.50 ! 0.0000 2476:20 Intra 2.39, 2.63 A assign (resid 134 and name HB2) (resid 134 and name HG*) 2.30 0.50 0.50 ! 0.0000 2477:20 Intra 2.29, 2.74 A assign (resid 134 and name HD*) (resid 134 and name HG*) 2.30 0.50 0.50 ! 0.5073 2478:20 Ambig 2.28, 2.66 A or (resid 134 and name HB1) (resid 134 and name HG*) ! 0.4913 2478:20 ----- 2.29, 2.58 A assign (resid 8 and name HN) (resid 134 and name HB2) 4.15 2.35 2.35 ! 0.9140 2480:20 Ambig 3.52, 4.39 A or (resid 137 and name HN) (resid 134 and name HB2) ! 0.0860 2480:20 ----- 5.22, 6.85 A assign (resid 8 and name HN) (resid 134 and name HB1) 4.15 2.35 2.35 ! 0.0000 2481:20 Long 4.83, 5.76 A assign (resid 103 and name HN) (resid 22 and name HB*) 3.65 1.85 1.85 ! 0.9571 2482:20 Long 3.92, 5.33 A assign (resid 6 and name HA) (resid 134 and name HB2) 4.15 2.35 2.35 ! 0.0000 2485:20 Long 5.10, 5.85 A assign (resid 136 and name HA) (resid 134 and name HB2) 4.15 2.35 2.35 ! 0.9388 2487:20 Mid 3.41, 4.89 A assign (resid 24 and name HD1) (resid 22 and name HB*) 3.65 1.85 1.85 ! 0.0000 2488:20 Mid 3.81, 5.34 A assign (resid 134 and name HE2) (resid 134 and name HB2) 3.65 1.85 1.85 ! 0.9870 2490:20 Intra 3.03, 4.36 A assign (resid 114 and name HB1) (resid 47 and name HD2) 3.15 1.35 1.35 ! 0.9934 2492:20 Long 2.70, 3.30 A assign (resid 134 and name HA) (resid 134 and name HE2) 4.15 2.35 2.35 ! 0.6194 2494:20 Ambig 4.83, 6.05 A or (resid 37 and name HA) (resid 134 and name HE2) ! 0.2469 2494:20 ----- 5.63, 7.45 A or (resid 37 and name HA) (resid 82 and name HB1) ! 0.1338 2494:20 ----- 6.24, 6.55 A assign (resid 42 and name HB*) (resid 119 and name HB1) 4.15 2.35 2.35 ! 0.5326 2495:20 Ambig 5.58, 6.98 A or (resid 138 and name HB2) (resid 134 and name HE2) ! 0.3450 2495:20 ----- 6.00, 7.48 A or (resid 138 and name HB2) (resid 119 and name HB1) ! 0.1223 2495:20 ----- 7.13, 7.70 A assign (resid 136 and name HB*) (resid 134 and name HE2) 2.30 0.50 0.50 ! 0.6136 2497:20 Ambig 2.18, 3.90 A or (resid 77 and name HG2) (resid 77 and name HE*) ! 0.3760 2497:20 ----- 2.37, 3.22 A assign (resid 122 and name HB) (resid 119 and name HB1) 3.15 1.35 1.35 ! 0.8459 2500:20 Ambig 2.16, 3.39 A or (resid 124 and name HA) (resid 134 and name HE2) ! 0.1263 2500:20 ----- 2.97, 4.38 A assign (resid 33 and name HB2) (resid 32 and name HG2*) 3.65 1.85 1.85 ! 0.6749 2501:20 Ambig 3.96, 5.44 A or (resid 33 and name HG1) (resid 32 and name HG2*) ! 0.3251 2501:20 ----- 4.47, 5.67 A assign (resid 32 and name HA) (resid 32 and name HB) 2.65 0.85 0.85 ! 0.0000 2505:20 Intra 3.01, 3.04 A assign (resid 32 and name HN) (resid 32 and name HB) 2.65 0.85 0.85 ! 0.9887 2506:20 Intra 2.36, 2.55 A assign (resid 32 and name HN) (resid 133 and name HD1*) 4.15 2.35 2.35 ! 0.9011 2509:20 Ambig 4.27, 5.32 A or (resid 132 and name HN) (resid 133 and name HD1*) ! 0.0989 2509:20 ----- 6.18, 7.30 A assign (resid 133 and name HG11) (resid 133 and name HD1*) 2.30 0.50 0.50 ! 0.7881 2511:20 Ambig 2.38, 2.63 A or (resid 6 and name HG1*) (resid 133 and name HD1*) ! 0.1470 2511:20 ----- 3.15, 6.15 A assign (resid 131 and name HB1) (resid 133 and name HD1*) 3.65 1.85 1.85 ! 0.0000 2513:20 Mid 4.58, 6.30 A assign (resid 3 and name HA) (resid 133 and name HD1*) 3.65 1.85 1.85 ! 0.9530 2515:20 Long 2.41, 5.24 A assign (resid 127 and name HN) (resid 133 and name HD1*) 2.65 0.85 0.85 ! 0.9753 2517:20 Long 2.76, 4.40 A assign (resid 133 and name HD1*) (resid 133 and name HA) 3.15 1.35 1.35 ! 0.0000 2518:20 Intra 3.97, 5.09 A assign (resid 133 and name HB) (resid 133 and name HA) 3.65 1.85 1.85 ! 0.9676 2519:20 Intra 2.50, 2.54 A assign (resid 133 and name HG12) (resid 133 and name HA) 3.65 1.85 1.85 ! 0.9675 2520:20 Intra 3.63, 3.70 A assign (resid 131 and name HB1) (resid 133 and name HA) 3.65 1.85 1.85 ! 0.7143 2521:20 Ambig 4.63, 5.12 A or (resid 6 and name HB) (resid 133 and name HA) ! 0.2857 2521:20 ----- 5.40, 5.87 A assign (resid 133 and name HN) (resid 133 and name HA) 3.65 1.85 1.85 ! 0.0000 2522:20 Intra 2.92, 2.95 A assign (resid 133 and name HG2*) (resid 133 and name HB) 2.65 0.85 0.85 ! 0.8150 2523:20 Ambig 2.34, 2.62 A or (resid 6 and name HG1*) (resid 133 and name HB) ! 0.1795 2523:20 ----- 3.01, 6.43 A assign (resid 133 and name HD1*) (resid 133 and name HB) 3.15 1.35 1.35 ! 0.0000 2524:20 Intra 2.60, 3.22 A assign (resid 133 and name HG12) (resid 133 and name HB) 3.15 1.35 1.35 ! 0.9877 2525:20 Intra 2.51, 3.01 A assign (resid 133 and name HA) (resid 133 and name HB) 3.65 1.85 1.85 ! 0.9896 2526:20 Intra 2.50, 2.54 A assign (resid 133 and name HD1*) (resid 133 and name HG12) 2.65 0.85 0.85 ! 0.9907 2531:20 Intra 2.38, 2.61 A assign (resid 133 and name HA) (resid 133 and name HG11) 3.65 1.85 1.85 ! 0.8735 2532:20 Ambig 3.59, 3.77 A or (resid 6 and name HA) (resid 133 and name HG11) ! 0.1041 2532:20 ----- 5.11, 5.45 A assign (resid 133 and name HN) (resid 133 and name HG11) 3.65 1.85 1.85 ! 0.0000 2533:20 Intra 2.38, 2.75 A assign (resid 133 and name HN) (resid 133 and name HG12) 3.65 1.85 1.85 ! 0.9732 2534:20 Intra 1.85, 2.13 A assign (resid 133 and name HN) (resid 133 and name HD1*) 3.15 1.35 1.35 ! 0.0000 2536:20 Intra 2.21, 4.43 A assign (resid 134 and name HA) (resid 133 and name HD1*) 4.15 2.35 2.35 ! 0.0000 2537:20 Seq 4.22, 6.20 A assign (resid 27 and name HA) (resid 27 and name HD1*) 3.15 1.35 1.35 ! 0.0000 2538:20 Intra 4.37, 4.67 A assign (resid 10 and name HA) (resid 10 and name HG1*) 2.30 0.50 0.50 ! 0.5217 2540:20 Ambig 2.44, 3.10 A or (resid 6 and name HA) (resid 6 and name HG1*) ! 0.4765 2540:20 ----- 2.47, 3.25 A assign (resid 6 and name HB) (resid 6 and name HG1*) 2.30 0.50 0.50 ! 0.5121 2542:20 Ambig 2.39, 2.63 A or (resid 10 and name HB) (resid 10 and name HG1*) ! 0.4657 2542:20 ----- 2.43, 2.64 A assign (resid 34 and name HB) (resid 6 and name HG1*) 3.65 1.85 1.85 ! 0.5456 2543:20 Ambig 3.57, 5.32 A or (resid 29 and name HB2) (resid 6 and name HG1*) ! 0.3574 2543:20 ----- 3.83, 5.44 A or (resid 4 and name HG1) (resid 6 and name HG1*) ! 0.0676 2543:20 ----- 5.06, 7.15 A assign (resid 29 and name HB1) (resid 6 and name HG1*) 4.15 2.35 2.35 ! 0.0000 2544:20 Long 4.97, 6.51 A assign (resid 28 and name HN) (resid 6 and name HG1*) 3.65 1.85 1.85 ! 0.0000 2546:20 Long 3.23, 4.47 A assign (resid 26 and name HN) (resid 10 and name HG1*) 3.65 1.85 1.85 ! 0.9201 2547:20 Long 3.13, 4.46 A assign (resid 6 and name HB) (resid 6 and name HG2*) 2.30 0.50 0.50 ! 0.7544 2552:20 Ambig 2.39, 2.63 A or (resid 4 and name HB1) (resid 6 and name HG2*) ! 0.2082 2552:20 ----- 2.96, 6.31 A assign (resid 7 and name HD*) (resid 7 and name HA) 3.15 1.35 1.35 ! 0.5304 2553:20 Ambig 3.88, 4.55 A or (resid 8 and name HB2) (resid 7 and name HA) ! 0.4026 2553:20 ----- 4.06, 4.36 A assign (resid 135 and name HB*) (resid 7 and name HA) 4.15 2.35 2.35 ! 0.0000 2554:20 Long 1.90, 3.20 A assign (resid 8 and name HD2*) (resid 7 and name HA) 3.65 1.85 1.85 ! 0.6038 2555:20 Ambig 3.18, 5.26 A or (resid 5 and name HG2*) (resid 7 and name HA) ! 0.1944 2555:20 ----- 3.84, 5.38 A or (resid 6 and name HG2*) (resid 7 and name HA) ! 0.1436 2555:20 ----- 4.04, 6.49 A assign (resid 6 and name HG1*) (resid 7 and name HA) 4.15 2.35 2.35 ! 0.8665 2556:20 Ambig 4.08, 5.26 A or (resid 125 and name HG1*) (resid 7 and name HA) ! 0.0682 2556:20 ----- 6.23, 7.88 A assign (resid 7 and name HG1) (resid 7 and name HB*) 2.30 0.50 0.50 ! 0.8388 2557:20 Ambig 2.26, 2.71 A or (resid 131 and name HG2) (resid 131 and name HB1) ! 0.1520 2557:20 ----- 3.00, 3.02 A assign (resid 7 and name HE*) (resid 7 and name HG2) 3.15 1.35 1.35 ! 0.0000 2559:20 Intra 2.38, 3.32 A assign (resid 7 and name HE*) (resid 7 and name HG1) 2.65 0.85 0.85 ! 0.0000 2560:20 Intra 2.45, 3.28 A assign (resid 7 and name HA) (resid 7 and name HG2) 3.65 1.85 1.85 ! 0.9939 2561:20 Intra 2.38, 2.50 A assign (resid 6 and name HN) (resid 7 and name HG1) 4.15 2.35 2.35 ! 0.0000 2562:20 Seq 4.92, 5.39 A assign (resid 6 and name HN) (resid 7 and name HG2) 4.15 2.35 2.35 ! 0.0000 2563:20 Seq 5.32, 5.93 A assign (resid 7 and name HA) (resid 7 and name HG1) 3.15 1.35 1.35 ! 0.9769 2564:20 Intra 2.80, 3.08 A assign (resid 7 and name HB*) (resid 7 and name HG2) 2.65 0.85 0.85 ! 0.9967 2565:20 Intra 2.40, 2.74 A assign (resid 7 and name HB*) (resid 7 and name HG1) 2.65 0.85 0.85 ! 0.9968 2566:20 Intra 2.26, 2.71 A assign (resid 64 and name HN) (resid 63 and name HA) 3.65 1.85 1.85 ! 0.0000 2577:20 Seq 3.27, 3.38 A assign (resid 69 and name HD1*) (resid 63 and name HA) 4.15 2.35 2.35 ! 0.0000 2580:20 Long 6.08, 7.42 A assign (resid 65 and name HN) (resid 63 and name HA) 3.65 1.85 1.85 ! 0.8150 2581:20 Ambig 3.45, 3.76 A or (resid 65 and name HD21) (resid 63 and name HA) ! 0.1850 2581:20 ----- 4.42, 5.82 A assign (resid 63 and name HA) (resid 63 and name HB) 3.15 1.35 1.35 ! 0.0000 2582:20 Intra 2.52, 2.56 A assign (resid 63 and name HN) (resid 63 and name HB) 3.65 1.85 1.85 ! 0.0000 2585:20 Intra 3.43, 3.51 A assign (resid 45 and name HB*) (resid 76 and name HA2) 2.65 0.85 0.85 ! 0.9893 2586:20 Long 1.99, 3.57 A assign (resid 77 and name HN) (resid 76 and name HA2) 3.65 1.85 1.85 ! 0.0000 2587:20 Seq 3.19, 3.39 A assign (resid 27 and name HG12) (resid 6 and name HG2*) 2.65 0.85 0.85 ! 0.3783 2588:20 Ambig 2.68, 5.39 A or (resid 7 and name HG1) (resid 5 and name HG2*) ! 0.3399 2588:20 ----- 2.73, 4.59 A or (resid 133 and name HB) (resid 6 and name HG2*) ! 0.2103 2588:20 ----- 2.95, 4.82 A assign (resid 23 and name HA) (resid 24 and name HD1) 2.65 0.85 0.85 ! 0.0000 2589:20 Seq 1.87, 2.13 A assign (resid 86 and name HN) (resid 85 and name HD*) 3.65 1.85 1.85 ! 0.0000 2592:20 Seq 2.38, 3.21 A assign (resid 85 and name HB2) (resid 85 and name HD*) 3.65 1.85 1.85 ! 0.0000 2593:20 Intra 3.89, 3.98 A assign (resid 86 and name HG2*) (resid 85 and name HD*) 3.65 1.85 1.85 ! 0.9847 2594:20 Seq 2.87, 6.38 A assign (resid 120 and name HB2) (resid 120 and name HD1) 3.65 1.85 1.85 ! 0.0000 2595:20 Intra 3.84, 3.90 A assign (resid 16 and name HB1) (resid 17 and name HD1) 3.15 1.35 1.35 ! 0.8723 2596:20 Ambig 2.75, 3.49 A or (resid 17 and name HB2) (resid 17 and name HD1) ! 0.1277 2596:20 ----- 3.78, 3.89 A assign (resid 121 and name HN) (resid 120 and name HD1) 3.65 1.85 1.85 ! 0.0000 2597:20 Seq 3.65, 3.81 A assign (resid 91 and name HD*) (resid 91 and name HB2) 3.65 1.85 1.85 ! 0.0000 2599:20 Intra 3.29, 3.89 A assign (resid 33 and name HA) (resid 33 and name HB1) 3.65 1.85 1.85 ! 0.0000 2600:20 Intra 2.26, 2.29 A assign (resid 91 and name HD*) (resid 91 and name HB1) 3.15 1.35 1.35 ! 0.0000 2601:20 Intra 3.25, 3.74 A assign (resid 92 and name HN) (resid 91 and name HB2) 3.65 1.85 1.85 ! 0.0000 2602:20 Seq 3.02, 3.74 A assign (resid 33 and name HG2) (resid 33 and name HB1) 3.15 1.35 1.35 ! 0.4929 2603:20 Ambig 2.64, 2.79 A or (resid 91 and name HG1) (resid 91 and name HB2) ! 0.4292 2603:20 ----- 2.70, 2.80 A assign (resid 91 and name HA) (resid 91 and name HB2) 3.65 1.85 1.85 ! 0.0000 2604:20 Intra 2.65, 2.71 A assign (resid 92 and name HN) (resid 91 and name HB1) 3.15 1.35 1.35 ! 0.0000 2605:20 Seq 3.79, 4.16 A assign (resid 91 and name HB1) (resid 91 and name HG2) 3.15 1.35 1.35 ! 0.0000 2606:20 Intra 2.82, 2.92 A assign (resid 91 and name HD*) (resid 91 and name HG1) 3.15 1.35 1.35 ! 0.9977 2607:20 Intra 2.25, 2.58 A assign (resid 91 and name HB1) (resid 91 and name HG1) 3.65 1.85 1.85 ! 0.0000 2608:20 Intra 2.26, 2.28 A assign (resid 91 and name HD*) (resid 91 and name HG2) 2.65 0.85 0.85 ! 0.9974 2609:20 Intra 2.26, 2.56 A assign (resid 134 and name HB1) (resid 6 and name HA) 4.15 2.35 2.35 ! 0.4758 2610:20 Ambig 5.30, 6.12 A or (resid 133 and name HB) (resid 6 and name HA) ! 0.4537 2610:20 ----- 5.34, 5.84 A assign (resid 6 and name HG2*) (resid 6 and name HA) 2.65 0.85 0.85 ! 0.9286 2611:20 Intra 2.49, 3.15 A assign (resid 61 and name HG2) (resid 90 and name HB1) 3.65 1.85 1.85 ! 0.8649 2612:20 Ambig 2.41, 4.41 A or (resid 133 and name HB) (resid 3 and name HB2) ! 0.1106 2612:20 ----- 3.39, 4.36 A assign (resid 141 and name HB2) (resid 141 and name HD1) 3.15 1.35 1.35 ! 0.0000 2613:20 Intra 2.27, 2.63 A assign (resid 141 and name HB2) (resid 141 and name HD2) 3.15 1.35 1.35 ! 0.0000 2614:20 Intra 2.44, 3.45 A assign (resid 113 and name HB1) (resid 141 and name HD2) 4.15 2.35 2.35 ! 0.9972 2617:20 Long 1.89, 3.92 A assign (resid 47 and name HE*) (resid 47 and name HD1) 2.65 0.85 0.85 ! 0.9977 2618:20 Intra 2.30, 2.68 A assign (resid 12 and name HG2*) (resid 141 and name HB1) 2.30 0.50 0.50 ! 0.6940 2620:20 Ambig 1.94, 3.16 A or (resid 134 and name HG*) (resid 134 and name HB1) ! 0.2519 2620:20 ----- 2.29, 2.58 A assign (resid 17 and name HA) (resid 105 and name HB) 3.65 1.85 1.85 ! 0.9983 2622:20 Long 2.27, 2.78 A assign (resid 105 and name HD1*) (resid 105 and name HB) 2.65 0.85 0.85 ! 0.9401 2623:20 Intra 2.57, 3.18 A assign (resid 105 and name HG2*) (resid 105 and name HB) 2.65 0.85 0.85 ! 0.9935 2624:20 Intra 2.45, 2.65 A assign (resid 34 and name HB) (resid 34 and name HG2*) 2.30 0.50 0.50 ! 0.9964 2625:20 Intra 2.38, 2.62 A assign (resid 132 and name HB2) (resid 126 and name HB*) 3.15 1.35 1.35 ! 0.8826 2626:20 Ambig 3.18, 4.50 A or (resid 127 and name HB1) (resid 126 and name HB*) ! 0.1174 2626:20 ----- 4.45, 5.98 A assign (resid 140 and name HA1) (resid 12 and name HA) 4.15 2.35 2.35 ! 0.0000 2627:20 Long 4.86, 5.40 A assign (resid 23 and name HG1*) (resid 12 and name HA) 3.15 1.35 1.35 ! 0.5391 2628:20 Ambig 4.37, 5.85 A or (resid 23 and name HG2*) (resid 12 and name HA) ! 0.3377 2628:20 ----- 4.72, 6.49 A or (resid 10 and name HG2*) (resid 12 and name HA) ! 0.0967 2628:20 ----- 5.82, 6.97 A assign (resid 141 and name HB2) (resid 12 and name HA) 3.65 1.85 1.85 ! 0.8975 2629:20 Ambig 3.91, 4.34 A or (resid 10 and name HB) (resid 12 and name HA) ! 0.1025 2629:20 ----- 5.62, 5.88 A assign (resid 13 and name HB) (resid 12 and name HA) 3.65 1.85 1.85 ! 0.4676 2630:20 Ambig 5.62, 5.68 A or (resid 23 and name HB) (resid 12 and name HA) ! 0.4001 2630:20 ----- 5.77, 7.53 A or (resid 24 and name HG2) (resid 12 and name HA) ! 0.1323 2630:20 ----- 6.93, 7.74 A assign (resid 10 and name HN) (resid 10 and name HA) 3.65 1.85 1.85 ! 0.0000 2632:20 Intra 2.88, 2.90 A assign (resid 11 and name HN) (resid 10 and name HA) 2.65 0.85 0.85 ! 0.0000 2634:20 Seq 2.42, 2.45 A assign (resid 25 and name HA) (resid 10 and name HA) 3.15 1.35 1.35 ! 0.9608 2635:20 Long 2.87, 3.25 A assign (resid 53 and name HA) (resid 53 and name HG1*) 2.65 0.85 0.85 ! 0.8901 2637:20 Ambig 2.52, 3.15 A or (resid 53 and name HA) (resid 53 and name HG2*) ! 0.0887 2637:20 ----- 3.70, 3.93 A assign (resid 10 and name HA) (resid 25 and name HG1*) 3.15 1.35 1.35 ! 0.7232 2640:20 Ambig 3.80, 5.35 A or (resid 80 and name HA) (resid 53 and name HG2*) ! 0.2070 2640:20 ----- 4.68, 5.85 A assign (resid 97 and name HD1*) (resid 24 and name HB2) 3.15 1.35 1.35 ! 0.6214 2641:20 Ambig 2.02, 4.25 A or (resid 97 and name HG12) (resid 24 and name HB2) ! 0.2792 2641:20 ----- 2.31, 2.79 A or (resid 87 and name HD1*) (resid 33 and name HB2) ! 0.0911 2641:20 ----- 2.78, 5.25 A assign (resid 26 and name HG2*) (resid 24 and name HB2) 3.65 1.85 1.85 ! 0.5688 2642:20 Ambig 5.22, 6.21 A or (resid 34 and name HG1*) (resid 33 and name HB2) ! 0.4312 2642:20 ----- 5.47, 6.47 A assign (resid 26 and name HG2*) (resid 24 and name HB1) 4.15 2.35 2.35 ! 0.0000 2643:20 Mid 6.66, 7.86 A assign (resid 33 and name HD2) (resid 33 and name HB2) 3.65 1.85 1.85 ! 0.0000 2645:20 Intra 2.90, 3.37 A assign (resid 24 and name HD1) (resid 24 and name HB1) 3.65 1.85 1.85 ! 0.0000 2647:20 Intra 3.17, 3.37 A assign (resid 24 and name HD1) (resid 24 and name HB2) 3.65 1.85 1.85 ! 0.0000 2648:20 Intra 4.02, 4.06 A assign (resid 72 and name HA) (resid 72 and name HG2*) 2.30 0.50 0.50 ! 0.6153 2649:20 Ambig 2.34, 2.95 A or (resid 144 and name HA) (resid 144 and name HG2*) ! 0.3817 2649:20 ----- 2.54, 3.21 A assign (resid 140 and name HA1) (resid 10 and name HG2*) 3.15 1.35 1.35 ! 0.5175 2650:20 Ambig 3.27, 4.66 A or (resid 138 and name HB2) (resid 10 and name HG2*) ! 0.4757 2650:20 ----- 3.32, 5.50 A assign (resid 61 and name HA) (resid 63 and name HG2*) 2.65 0.85 0.85 ! 0.4798 2651:20 Ambig 3.23, 5.14 A or (resid 140 and name HA2) (resid 10 and name HG1*) ! 0.3074 2651:20 ----- 3.48, 4.71 A or (resid 57 and name HA) (resid 63 and name HG2*) ! 0.1569 2651:20 ----- 3.90, 5.45 A assign (resid 100 and name HB*) (resid 99 and name HB*) 3.65 1.85 1.85 ! 0.8927 2652:20 Ambig 4.83, 6.28 A or (resid 64 and name HB1) (resid 63 and name HG2*) ! 0.1073 2652:20 ----- 6.87, 7.53 A assign (resid 13 and name HN) (resid 13 and name HB) 3.15 1.35 1.35 ! 0.0000 2653:20 Intra 3.75, 3.78 A assign (resid 23 and name HA) (resid 13 and name HB) 3.65 1.85 1.85 ! 0.5954 2654:20 Ambig 4.29, 4.64 A or (resid 142 and name HA) (resid 13 and name HB) ! 0.4046 2654:20 ----- 4.57, 4.75 A assign (resid 14 and name HA) (resid 13 and name HB) 3.65 1.85 1.85 ! 0.0000 2655:20 Seq 4.41, 4.52 A assign (resid 24 and name HD1) (resid 13 and name HB) 3.15 1.35 1.35 ! 0.5917 2656:20 Ambig 4.66, 5.08 A or (resid 14 and name HB*) (resid 13 and name HB) ! 0.4083 2656:20 ----- 4.96, 5.58 A assign (resid 12 and name HA) (resid 13 and name HB) 4.15 2.35 2.35 ! 0.0000 2657:20 Seq 5.62, 5.68 A assign (resid 22 and name HN) (resid 13 and name HB) 3.65 1.85 1.85 ! 0.9528 2658:20 Long 4.15, 4.75 A assign (resid 21 and name HB) (resid 13 and name HG2*) 3.65 1.85 1.85 ! 0.4495 2659:20 Ambig 4.76, 5.54 A or (resid 24 and name HB2) (resid 26 and name HG2*) ! 0.2573 2659:20 ----- 5.22, 6.21 A or (resid 33 and name HB2) (resid 34 and name HG1*) ! 0.1950 2659:20 ----- 5.47, 6.47 A or (resid 125 and name HB) (resid 34 and name HG1*) ! 0.0982 2659:20 ----- 6.13, 7.62 A assign (resid 1 and name HB) (resid 1 and name HG1*) 2.30 0.50 0.50 ! 0.0000 2660:20 Intra 2.37, 2.63 A assign (resid 23 and name HB) (resid 21 and name HG1*) 3.15 1.35 1.35 ! 0.4782 2661:20 Ambig 4.41, 6.58 A or (resid 105 and name HB) (resid 21 and name HG1*) ! 0.3045 2661:20 ----- 4.76, 5.63 A or (resid 13 and name HB) (resid 21 and name HG1*) ! 0.2174 2661:20 ----- 5.03, 6.29 A assign (resid 39 and name HG*) (resid 118 and name HG1*) 2.65 0.85 0.85 ! 0.8010 2662:20 Ambig 3.95, 5.17 A or (resid 39 and name HG*) (resid 118 and name HG2*) ! 0.1546 2662:20 ----- 5.20, 6.86 A assign (resid 21 and name HB) (resid 21 and name HG2*) 2.30 0.50 0.50 ! 0.9791 2663:20 Intra 2.40, 2.63 A assign (resid 117 and name HB) (resid 118 and name HG2*) 3.15 1.35 1.35 ! 0.2419 2664:20 Ambig 5.81, 6.64 A or (resid 120 and name HD2) (resid 118 and name HG1*) ! 0.2187 2664:20 ----- 5.91, 7.20 A or (resid 26 and name HB) (resid 10 and name HG2*) ! 0.1416 2664:20 ----- 6.35, 7.19 A or (resid 55 and name HA) (resid 70 and name HG2*) ! 0.1410 2664:20 ----- 6.36, 7.16 A or (resid 79 and name HB2) (resid 70 and name HG2*) ! 0.1054 2664:20 ----- 6.68, 7.84 A or (resid 20 and name HB) (resid 21 and name HG2*) ! 0.0844 2664:20 ----- 6.93, 7.63 A assign (resid 22 and name HA) (resid 23 and name HB) 3.65 1.85 1.85 ! 0.9542 2665:20 Seq 4.54, 4.71 A assign (resid 103 and name HE*) (resid 23 and name HB) 3.65 1.85 1.85 ! 0.0000 2667:20 Long 2.98, 5.56 A assign (resid 93 and name HA) (resid 30 and name HG2*) 3.15 1.35 1.35 ! 0.0000 2669:20 Long 2.11, 3.40 A assign (resid 138 and name HB1) (resid 39 and name HE*) 3.15 1.35 1.35 ! 0.6553 2670:20 Ambig 3.68, 5.34 A or (resid 15 and name HA1) (resid 144 and name HG1*) ! 0.1619 2670:20 ----- 4.64, 6.03 A or (resid 11 and name HA1) (resid 23 and name HG1*) ! 0.1265 2670:20 ----- 4.84, 6.25 A assign (resid 59 and name HG) (resid 94 and name HG2*) 2.65 0.85 0.85 ! 0.2069 2671:20 Ambig 4.14, 5.16 A or (resid 80 and name HB) (resid 39 and name HE*) ! 0.1920 2671:20 ----- 4.19, 5.26 A or (resid 116 and name HB2) (resid 23 and name HG1*) ! 0.1784 2671:20 ----- 4.24, 5.93 A or (resid 98 and name HG) (resid 39 and name HE*) ! 0.1288 2671:20 ----- 4.48, 6.53 A or (resid 116 and name HB2) (resid 23 and name HG2*) ! 0.0761 2671:20 ----- 4.89, 6.47 A or (resid 123 and name HB2) (resid 39 and name HE*) ! 0.0645 2671:20 ----- 5.02, 6.63 A or (resid 47 and name HD2) (resid 144 and name HG1*) ! 0.0514 2671:20 ----- 5.22, 7.09 A or (resid 27 and name HB) (resid 39 and name HE*) ! 0.0392 2671:20 ----- 5.46, 7.78 A assign (resid 101 and name HG) (resid 25 and name HG2*) 2.30 0.50 0.50 ! 0.5780 2675:20 Ambig 2.31, 3.11 A or (resid 25 and name HB) (resid 25 and name HG2*) ! 0.4220 2675:20 ----- 2.43, 2.64 A assign (resid 25 and name HA) (resid 25 and name HG2*) 2.65 0.85 0.85 ! 0.8212 2676:20 Ambig 2.57, 3.18 A or (resid 100 and name HA) (resid 25 and name HG2*) ! 0.0935 2676:20 ----- 3.70, 5.04 A or (resid 24 and name HA) (resid 25 and name HG2*) ! 0.0822 2676:20 ----- 3.78, 4.83 A assign (resid 95 and name HN) (resid 94 and name HG2*) 2.65 0.85 0.85 ! 0.5789 2677:20 Ambig 3.49, 4.56 A or (resid 99 and name HN) (resid 25 and name HG2*) ! 0.4211 2677:20 ----- 3.68, 4.45 A assign (resid 101 and name HN) (resid 23 and name HG1*) 2.65 0.85 0.85 ! 0.5230 2678:20 Ambig 3.22, 5.09 A or (resid 101 and name HN) (resid 25 and name HG2*) ! 0.2987 2678:20 ----- 3.54, 4.71 A or (resid 101 and name HN) (resid 23 and name HG2*) ! 0.0683 2678:20 ----- 4.53, 5.42 A or (resid 26 and name HN) (resid 25 and name HG2*) ! 0.0677 2678:20 ----- 4.53, 5.11 A assign (resid 116 and name HD1*) (resid 116 and name HB1) 3.15 1.35 1.35 ! 0.9588 2679:20 Intra 2.45, 3.08 A assign (resid 41 and name HG2*) (resid 116 and name HB1) 3.15 1.35 1.35 ! 0.8644 2680:20 Ambig 2.56, 3.13 A or (resid 118 and name HG2*) (resid 116 and name HB1) ! 0.0687 2680:20 ----- 3.90, 5.03 A assign (resid 116 and name HD2*) (resid 116 and name HG) 3.15 1.35 1.35 ! 0.0000 2681:20 Intra 2.42, 2.64 A assign (resid 116 and name HD1*) (resid 116 and name HG) 2.65 0.85 0.85 ! 0.9911 2682:20 Intra 2.38, 2.62 A assign (resid 116 and name HN) (resid 116 and name HD1*) 3.65 1.85 1.85 ! 0.7981 2684:20 Ambig 4.10, 4.66 A or (resid 117 and name HN) (resid 116 and name HD1*) ! 0.2019 2684:20 ----- 5.16, 6.31 A assign (resid 140 and name HN) (resid 116 and name HD1*) 3.65 1.85 1.85 ! 0.6483 2685:20 Ambig 3.61, 5.33 A or (resid 141 and name HN) (resid 116 and name HD1*) ! 0.3319 2685:20 ----- 4.03, 5.67 A assign (resid 116 and name HA) (resid 116 and name HD1*) 3.65 1.85 1.85 ! 0.9280 2686:20 Intra 4.40, 4.77 A assign (resid 91 and name HA) (resid 92 and name HG11) 3.65 1.85 1.85 ! 0.5061 2687:20 Ambig 3.67, 3.96 A or (resid 43 and name HA) (resid 116 and name HD1*) ! 0.3079 2687:20 ----- 3.98, 6.21 A or (resid 141 and name HA) (resid 116 and name HD1*) ! 0.1605 2687:20 ----- 4.44, 5.43 A assign (resid 35 and name HA2) (resid 92 and name HG11) 3.65 1.85 1.85 ! 0.6084 2688:20 Ambig 3.70, 5.15 A or (resid 140 and name HA2) (resid 116 and name HD1*) ! 0.2659 2688:20 ----- 4.24, 5.71 A or (resid 142 and name HA) (resid 116 and name HD1*) ! 0.0578 2688:20 ----- 5.47, 6.69 A assign (resid 103 and name HE*) (resid 116 and name HD1*) 3.65 1.85 1.85 ! 0.9642 2689:20 Long 2.40, 4.44 A assign (resid 140 and name HA1) (resid 116 and name HD1*) 3.65 1.85 1.85 ! 0.9945 2690:20 Long 2.57, 4.08 A assign (resid 116 and name HN) (resid 116 and name HG) 3.65 1.85 1.85 ! 0.9925 2691:20 Intra 2.28, 2.48 A assign (resid 142 and name HD1*) (resid 116 and name HD1*) 2.65 0.85 0.85 ! 0.0000 2692:20 Long 2.08, 4.09 A assign (resid 114 and name HN) (resid 113 and name HB2) 3.65 1.85 1.85 ! 0.9903 2693:20 Seq 2.98, 3.78 A assign (resid 114 and name HN) (resid 113 and name HB1) 3.65 1.85 1.85 ! 0.0000 2694:20 Seq 2.77, 3.99 A assign (resid 116 and name HD1*) (resid 140 and name HA1) 3.65 1.85 1.85 ! 0.9575 2695:20 Long 2.57, 4.08 A assign (resid 116 and name HG) (resid 140 and name HA1) 3.65 1.85 1.85 ! 0.9172 2696:20 Ambig 3.44, 3.80 A or (resid 115 and name HB*) (resid 140 and name HA1) ! 0.0528 2696:20 ----- 5.54, 6.87 A assign (resid 116 and name HB2) (resid 140 and name HA1) 3.65 1.85 1.85 ! 0.9884 2697:20 Long 2.64, 3.06 A assign (resid 22 and name HG1) (resid 102 and name HB2) 3.65 1.85 1.85 ! 0.8283 2698:20 Ambig 3.05, 3.69 A or (resid 117 and name HG2*) (resid 139 and name HB1) ! 0.1038 2698:20 ----- 4.31, 6.89 A assign (resid 117 and name HG2*) (resid 139 and name HB2) 4.15 2.35 2.35 ! 0.9814 2699:20 Long 2.92, 5.89 A assign (resid 115 and name HB*) (resid 139 and name HB2) 3.65 1.85 1.85 ! 0.9061 2701:20 Ambig 3.60, 5.64 A or (resid 116 and name HB2) (resid 139 and name HB2) ! 0.0644 2701:20 ----- 5.60, 6.50 A assign (resid 139 and name HD22) (resid 139 and name HB1) 3.65 1.85 1.85 ! 0.0000 2702:20 Intra 3.43, 3.92 A assign (resid 139 and name HD22) (resid 139 and name HB2) 3.65 1.85 1.85 ! 0.0000 2703:20 Intra 3.45, 3.69 A assign (resid 116 and name HN) (resid 139 and name HB1) 4.15 2.35 2.35 ! 0.9519 2704:20 Long 3.22, 5.20 A assign (resid 116 and name HN) (resid 139 and name HB2) 4.15 2.35 2.35 ! 0.7178 2705:20 Ambig 4.55, 5.75 A or (resid 117 and name HN) (resid 139 and name HB2) ! 0.1560 2705:20 ----- 5.87, 6.77 A or (resid 10 and name HN) (resid 139 and name HB2) ! 0.1262 2705:20 ----- 6.08, 7.65 A assign (resid 14 and name HB*) (resid 143 and name HB) 2.65 0.85 0.85 ! 0.0000 2706:20 Long 2.35, 3.39 A assign (resid 142 and name HG2*) (resid 143 and name HB) 3.65 1.85 1.85 ! 0.0000 2707:20 Seq 5.00, 5.74 A assign (resid 141 and name HN) (resid 141 and name HB1) 3.15 1.35 1.35 ! 0.8873 2708:20 Ambig 2.56, 2.80 A or (resid 6 and name HN) (resid 134 and name HB1) ! 0.0977 2708:20 ----- 3.69, 4.65 A assign (resid 141 and name HN) (resid 141 and name HB2) 3.65 1.85 1.85 ! 0.9082 2709:20 Ambig 2.59, 3.11 A or (resid 140 and name HN) (resid 141 and name HB2) ! 0.0918 2709:20 ----- 3.80, 5.20 A assign (resid 116 and name HN) (resid 141 and name HB1) 4.15 2.35 2.35 ! 0.0000 2710:20 Long 5.06, 5.47 A assign (resid 140 and name HA2) (resid 141 and name HB1) 3.65 1.85 1.85 ! 0.6330 2713:20 Ambig 4.30, 4.53 A or (resid 142 and name HA) (resid 141 and name HB1) ! 0.3670 2713:20 ----- 4.71, 4.83 A assign (resid 140 and name HA2) (resid 141 and name HB2) 3.65 1.85 1.85 ! 0.8968 2714:20 Ambig 3.98, 4.19 A or (resid 142 and name HA) (resid 141 and name HB2) ! 0.1032 2714:20 ----- 5.70, 5.82 A assign (resid 141 and name HA) (resid 141 and name HG2) 3.15 1.35 1.35 ! 0.6930 2719:20 Ambig 2.91, 3.19 A or (resid 113 and name HA) (resid 141 and name HG2) ! 0.2727 2719:20 ----- 3.40, 4.01 A assign (resid 141 and name HB2) (resid 141 and name HG2) 2.65 0.85 0.85 ! 0.9503 2720:20 Intra 2.97, 2.99 A assign (resid 141 and name HB2) (resid 141 and name HG1) 2.65 0.85 0.85 ! 0.0000 2722:20 Intra 2.33, 2.49 A assign (resid 141 and name HE*) (resid 141 and name HG1) 2.65 0.85 0.85 ! 0.0000 2723:20 Intra 2.42, 3.72 A assign (resid 141 and name HB1) (resid 141 and name HE*) 2.30 0.50 0.50 ! 0.5343 2725:20 Ambig 2.00, 3.02 A or (resid 141 and name HD2) (resid 141 and name HE*) ! 0.2452 2725:20 ----- 2.28, 2.69 A or (resid 47 and name HD2) (resid 47 and name HE*) ! 0.2191 2725:20 ----- 2.33, 2.73 A assign (resid 144 and name HG2*) (resid 47 and name HE*) 2.30 0.50 0.50 ! 0.2666 2726:20 Ambig 2.40, 5.42 A or (resid 12 and name HG2*) (resid 141 and name HE*) ! 0.2639 2726:20 ----- 2.41, 4.22 A or (resid 141 and name HG1) (resid 141 and name HE*) ! 0.2568 2726:20 ----- 2.42, 3.72 A or (resid 47 and name HG2) (resid 47 and name HE*) ! 0.1878 2726:20 ----- 2.55, 3.54 A assign (resid 141 and name HB2) (resid 141 and name HE*) 3.65 1.85 1.85 ! 0.0000 2727:20 Intra 1.93, 3.28 A assign (resid 113 and name HA) (resid 141 and name HE*) 4.15 2.35 2.35 ! 0.4528 2729:20 Ambig 4.20, 6.34 A or (resid 141 and name HA) (resid 141 and name HE*) ! 0.4211 2729:20 ----- 4.25, 5.18 A or (resid 113 and name HA) (resid 47 and name HE*) ! 0.0815 2729:20 ----- 5.59, 7.61 A assign (resid 141 and name HD1) (resid 113 and name HB2) 3.65 1.85 1.85 ! 0.8188 2731:20 Ambig 1.85, 4.65 A or (resid 141 and name HG2) (resid 113 and name HB2) ! 0.1792 2731:20 ----- 2.38, 3.86 A assign (resid 117 and name HA) (resid 139 and name HB1) 3.65 1.85 1.85 ! 0.0000 2732:20 Long 4.00, 4.94 A assign (resid 10 and name HG2*) (resid 139 and name HB2) 3.65 1.85 1.85 ! 0.9816 2734:20 Long 2.33, 5.22 A assign (resid 10 and name HG2*) (resid 139 and name HB1) 3.65 1.85 1.85 ! 0.5456 2735:20 Ambig 3.21, 4.83 A or (resid 54 and name HD1*) (resid 102 and name HB2) ! 0.4374 2735:20 ----- 3.33, 4.73 A assign (resid 111 and name HA) (resid 144 and name HG2*) 2.65 0.85 0.85 ! 0.8374 2737:20 Ambig 3.48, 4.32 A or (resid 17 and name HA) (resid 144 and name HG2*) ! 0.0878 2737:20 ----- 5.07, 6.24 A assign (resid 117 and name HB) (resid 117 and name HG2*) 2.30 0.50 0.50 ! 0.0000 2738:20 Intra 2.45, 2.66 A assign (resid 144 and name HN) (resid 144 and name HG2*) 2.30 0.50 0.50 ! 0.7978 2739:20 Ambig 2.07, 3.11 A or (resid 118 and name HN) (resid 117 and name HG2*) ! 0.1418 2739:20 ----- 2.76, 3.92 A assign (resid 70 and name HB) (resid 72 and name HG2*) 3.15 1.35 1.35 ! 0.3498 2741:20 Ambig 4.52, 6.54 A or (resid 50 and name HB) (resid 72 and name HG2*) ! 0.2656 2741:20 ----- 4.73, 6.54 A or (resid 118 and name HB) (resid 117 and name HG2*) ! 0.2375 2741:20 ----- 4.82, 5.99 A or (resid 17 and name HB1) (resid 144 and name HG2*) ! 0.0819 2741:20 ----- 5.76, 7.09 A assign (resid 70 and name HG1*) (resid 72 and name HG2*) 2.65 0.85 0.85 ! 0.6653 2742:20 Ambig 2.79, 5.30 A or (resid 78 and name HG2*) (resid 72 and name HG2*) ! 0.3216 2742:20 ----- 3.15, 5.74 A assign (resid 138 and name HB2) (resid 10 and name HG1*) 2.65 0.85 0.85 ! 0.7097 2743:20 Ambig 2.97, 4.91 A or (resid 140 and name HA1) (resid 10 and name HG1*) ! 0.1718 2743:20 ----- 3.77, 4.84 A or (resid 55 and name HD2) (resid 63 and name HG2*) ! 0.0973 2743:20 ----- 4.14, 5.71 A assign (resid 39 and name HN) (resid 80 and name HG2*) 3.65 1.85 1.85 ! 0.5540 2745:20 Ambig 4.25, 5.28 A or (resid 114 and name HN) (resid 142 and name HG2*) ! 0.4101 2745:20 ----- 4.47, 5.48 A assign (resid 115 and name HN) (resid 115 and name HA) 3.65 1.85 1.85 ! 0.0000 2747:20 Intra 2.88, 2.90 A assign (resid 141 and name HB2) (resid 115 and name HA) 3.65 1.85 1.85 ! 0.0000 2748:20 Long 2.74, 3.17 A assign (resid 119 and name HN) (resid 118 and name HG1*) 2.65 0.85 0.85 ! 0.9625 2749:20 Seq 2.56, 3.58 A assign (resid 118 and name HN) (resid 118 and name HG2*) 2.65 0.85 0.85 ! 0.7942 2750:20 Ambig 2.18, 3.22 A or (resid 140 and name HN) (resid 118 and name HG2*) ! 0.1917 2750:20 ----- 2.77, 4.19 A assign (resid 53 and name HB) (resid 70 and name HG1*) 3.65 1.85 1.85 ! 0.0000 2752:20 Long 4.77, 5.99 A assign (resid 83 and name HA) (resid 67 and name HB*) 4.15 2.35 2.35 ! 0.2110 2756:20 Ambig 4.76, 6.27 A or (resid 86 and name HB) (resid 67 and name HB*) ! 0.1885 2756:20 ----- 4.85, 6.95 A or (resid 136 and name HA) (resid 9 and name HB2) ! 0.1750 2756:20 ----- 4.92, 6.27 A or (resid 136 and name HA) (resid 138 and name HB1) ! 0.1614 2756:20 ----- 4.98, 6.36 A or (resid 122 and name HB) (resid 79 and name HB1) ! 0.0934 2756:20 ----- 5.46, 6.81 A or (resid 117 and name HA) (resid 138 and name HB1) ! 0.0831 2756:20 ----- 5.57, 6.34 A or (resid 120 and name HD1) (resid 138 and name HB1) ! 0.0446 2756:20 ----- 6.17, 7.07 A assign (resid 31 and name HA) (resid 31 and name HB2) 2.30 0.50 0.50 ! 0.9585 2757:20 Intra 2.44, 2.77 A assign (resid 31 and name HA) (resid 31 and name HB1) 2.30 0.50 0.50 ! 0.3790 2758:20 Ambig 2.28, 2.58 A or (resid 147 and name HA) (resid 147 and name HB*) ! 0.3399 2758:20 ----- 2.32, 2.70 A or (resid 0 and name HA) (resid 0 and name HB*) ! 0.2738 2758:20 ----- 2.41, 2.72 A assign (resid 125 and name HN) (resid 125 and name HG1*) 3.15 1.35 1.35 ! 0.8001 2761:20 Ambig 2.31, 4.60 A or (resid 125 and name HN) (resid 125 and name HG2*) ! 0.1593 2761:20 ----- 3.02, 4.02 A assign (resid 142 and name HG2*) (resid 114 and name HB2) 3.65 1.85 1.85 ! 0.0000 2763:20 Long 4.02, 5.20 A assign (resid 142 and name HB) (resid 114 and name HB2) 3.65 1.85 1.85 ! 0.7033 2764:20 Ambig 2.43, 3.08 A or (resid 144 and name HG2*) (resid 114 and name HB2) ! 0.2632 2764:20 ----- 2.86, 4.25 A assign (resid 81 and name HN) (resid 80 and name HG2*) 2.65 0.85 0.85 ! 0.9810 2766:20 Seq 2.59, 3.36 A assign (resid 142 and name HG2*) (resid 105 and name HD1*) 2.65 0.85 0.85 ! 0.0000 2767:20 Long 2.31, 3.81 A assign (resid 52 and name HB1) (resid 72 and name HG2*) 3.65 1.85 1.85 ! 0.5643 2768:20 Ambig 5.11, 6.34 A or (resid 82 and name HB2) (resid 34 and name HG2*) ! 0.2882 2768:20 ----- 5.72, 6.68 A or (resid 71 and name HB2) (resid 72 and name HG2*) ! 0.1475 2768:20 ----- 6.40, 7.77 A assign (resid 13 and name HN) (resid 12 and name HG2*) 2.65 0.85 0.85 ! 0.0000 2770:20 Seq 2.76, 3.50 A assign (resid 12 and name HN) (resid 12 and name HG2*) 3.65 1.85 1.85 ! 0.6880 2771:20 Ambig 4.32, 4.58 A or (resid 16 and name HD21) (resid 145 and name HG2*) ! 0.3120 2771:20 ----- 4.92, 6.55 A assign (resid 75 and name HD1) (resid 75 and name HG2) 2.65 0.85 0.85 ! 0.0000 2773:20 Intra 2.91, 2.97 A assign (resid 75 and name HG2) (resid 75 and name HD2) 3.15 1.35 1.35 ! 0.0000 2774:20 Intra 2.24, 2.28 A assign (resid 91 and name HA) (resid 91 and name HB1) 3.65 1.85 1.85 ! 0.0000 2775:20 Intra 2.26, 2.29 A assign (resid 33 and name HD2) (resid 33 and name HG2) 3.15 1.35 1.35 ! 0.9411 2776:20 Intra 2.29, 2.31 A assign (resid 32 and name HA) (resid 33 and name HG2) 3.65 1.85 1.85 ! 0.9630 2778:20 Seq 4.25, 4.46 A assign (resid 33 and name HD2) (resid 33 and name HG1) 2.65 0.85 0.85 ! 0.9925 2779:20 Intra 2.67, 2.87 A assign (resid 33 and name HD1) (resid 33 and name HG2) 3.65 1.85 1.85 ! 0.9918 2780:20 Intra 2.67, 2.81 A assign (resid 33 and name HD2) (resid 33 and name HB1) 3.65 1.85 1.85 ! 0.0000 2782:20 Intra 3.87, 3.90 A assign (resid 24 and name HD2) (resid 24 and name HB1) 3.15 1.35 1.35 ! 0.0000 2783:20 Intra 3.90, 3.93 A assign (resid 91 and name HA) (resid 91 and name HD*) 3.65 1.85 1.85 ! 0.0000 2784:20 Intra 3.80, 3.95 A assign (resid 74 and name HN) (resid 74 and name HG2*) 3.15 1.35 1.35 ! 0.0000 2789:20 Intra 3.98, 4.36 A assign (resid 75 and name HD1) (resid 74 and name HB) 3.65 1.85 1.85 ! 0.0000 2790:20 Seq 5.03, 5.14 A assign (resid 82 and name HN) (resid 82 and name HA) 3.65 1.85 1.85 ! 0.0000 2791:20 Intra 2.92, 2.94 A assign (resid 37 and name HB) (resid 82 and name HA) 3.65 1.85 1.85 ! 0.0000 2792:20 Long 4.24, 4.63 A assign (resid 68 and name HN) (resid 66 and name HA) 3.65 1.85 1.85 ! 0.0000 2794:20 Mid 2.46, 2.91 A assign (resid 59 and name HA) (resid 92 and name HD1*) 3.65 1.85 1.85 ! 0.0000 2795:20 Long 3.93, 5.01 A assign (resid 43 and name HD*) (resid 142 and name HD1*) 4.15 2.35 2.35 ! 0.0000 2796:20 Long 5.12, 7.73 A assign (resid 23 and name HG2*) (resid 142 and name HD1*) 2.30 0.50 0.50 ! 0.8190 2797:20 Ambig 2.18, 4.07 A or (resid 21 and name HG2*) (resid 142 and name HD1*) ! 0.1155 2797:20 ----- 3.03, 5.11 A assign (resid 87 and name HA) (resid 86 and name HG2*) 4.15 2.35 2.35 ! 0.0000 2798:20 Seq 4.22, 6.09 A assign (resid 9 and name HN) (resid 8 and name HD2*) 3.65 1.85 1.85 ! 0.0000 2799:20 Seq 3.16, 5.32 A assign (resid 94 and name HN) (resid 30 and name HG1*) 4.15 2.35 2.35 ! 0.0000 2800:20 Long 3.11, 4.23 A assign (resid 30 and name HN) (resid 29 and name HG*) 3.65 1.85 1.85 ! 0.7009 2801:20 Ambig 4.77, 5.12 A or (resid 30 and name HN) (resid 4 and name HG2) ! 0.2991 2801:20 ----- 5.49, 6.64 A assign (resid 68 and name HB2) (resid 60 and name HG1*) 2.65 0.85 0.85 ! 0.9715 2805:20 Long 2.42, 3.97 A assign (resid 128 and name HB2) (resid 128 and name HA) 3.65 1.85 1.85 ! 0.9823 2808:20 Intra 2.42, 2.48 A assign (resid 128 and name HG1) (resid 128 and name HA) 3.65 1.85 1.85 ! 0.0000 2809:20 Intra 3.66, 3.73 A assign (resid 128 and name HB1) (resid 128 and name HA) 3.65 1.85 1.85 ! 0.0000 2810:20 Intra 2.36, 2.41 A assign (resid 94 and name HN) (resid 93 and name HA) 3.65 1.85 1.85 ! 0.0000 2812:20 Seq 2.89, 3.05 A assign (resid 34 and name HN) (resid 93 and name HA) 3.65 1.85 1.85 ! 0.9017 2813:20 Ambig 3.53, 3.96 A or (resid 127 and name HN) (resid 128 and name HA) ! 0.0721 2813:20 ----- 5.38, 5.57 A assign (resid 93 and name HB1) (resid 93 and name HA) 3.65 1.85 1.85 ! 0.9899 2814:20 Intra 2.34, 2.38 A assign (resid 93 and name HB2) (resid 93 and name HA) 3.65 1.85 1.85 ! 0.9539 2815:20 Intra 2.52, 2.57 A assign (resid 30 and name HG1*) (resid 94 and name HA) 3.65 1.85 1.85 ! 0.9420 2816:20 Long 2.98, 4.20 A assign (resid 87 and name HD2*) (resid 128 and name HA) 3.65 1.85 1.85 ! 0.8837 2817:20 Ambig 2.33, 3.52 A or (resid 87 and name HD1*) (resid 128 and name HA) ! 0.0609 2817:20 ----- 3.64, 4.85 A assign (resid 30 and name HG2*) (resid 93 and name HA) 3.65 1.85 1.85 ! 0.9132 2818:20 Ambig 2.11, 3.40 A or (resid 30 and name HG1*) (resid 93 and name HA) ! 0.0856 2818:20 ----- 3.12, 4.49 A assign (resid 33 and name HA) (resid 93 and name HA) 3.65 1.85 1.85 ! 0.9457 2819:20 Long 2.39, 2.95 A assign (resid 93 and name HN) (resid 93 and name HA) 3.65 1.85 1.85 ! 0.0000 2820:20 Intra 2.91, 2.93 A assign (resid 31 and name HN) (resid 31 and name HA) 3.65 1.85 1.85 ! 0.0000 2821:20 Intra 2.89, 2.91 A assign (resid 147 and name HN) (resid 147 and name HA) 3.65 1.85 1.85 ! 0.9814 2825:20 Intra 2.18, 2.83 A assign (resid 115 and name HN) (resid 114 and name HA) 3.65 1.85 1.85 ! 0.0000 2826:20 Seq 2.12, 2.15 A assign (resid 113 and name HA) (resid 114 and name HB1) 4.15 2.35 2.35 ! 0.4736 2827:20 Ambig 4.63, 5.48 A or (resid 141 and name HA) (resid 114 and name HB1) ! 0.2816 2827:20 ----- 5.05, 5.84 A or (resid 43 and name HA) (resid 114 and name HB1) ! 0.1298 2827:20 ----- 5.74, 6.43 A or (resid 41 and name HA) (resid 138 and name HB1) ! 0.0768 2827:20 ----- 6.27, 6.80 A assign (resid 77 and name HG1) (resid 73 and name HB*) 3.65 1.85 1.85 ! 0.7056 2828:20 Ambig 4.49, 5.55 A or (resid 72 and name HG2*) (resid 73 and name HB*) ! 0.1774 2828:20 ----- 5.65, 7.21 A or (resid 74 and name HG2*) (resid 73 and name HB*) ! 0.1170 2828:20 ----- 6.05, 7.25 A assign (resid 113 and name HA) (resid 114 and name HB2) 3.65 1.85 1.85 ! 0.7017 2830:20 Ambig 4.06, 4.47 A or (resid 141 and name HA) (resid 114 and name HB2) ! 0.2983 2830:20 ----- 4.68, 5.18 A assign (resid 92 and name HN) (resid 92 and name HG11) 3.65 1.85 1.85 ! 0.0000 2831:20 Intra 2.03, 2.23 A assign (resid 82 and name HA) (resid 81 and name HG2*) 3.65 1.85 1.85 ! 0.0000 2832:20 Seq 3.76, 4.83 A assign (resid 93 and name HA) (resid 30 and name HG1*) 3.65 1.85 1.85 ! 0.0000 2836:20 Long 3.12, 4.49 A assign (resid 144 and name HG1*) (resid 17 and name HA) 3.15 1.35 1.35 ! 0.9522 2837:20 Long 3.77, 4.62 A assign (resid 100 and name HE*) (resid 24 and name HB1) 3.65 1.85 1.85 ! 0.5569 2838:20 Ambig 2.17, 4.62 A or (resid 100 and name HD*) (resid 24 and name HB1) ! 0.4431 2838:20 ----- 2.25, 4.33 A assign (resid 100 and name HE*) (resid 24 and name HB2) 3.15 1.35 1.35 ! 0.5564 2839:20 Ambig 3.64, 5.71 A or (resid 100 and name HD*) (resid 24 and name HB2) ! 0.4436 2839:20 ----- 3.77, 5.70 A assign (resid 98 and name HB2) (resid 97 and name HG2*) 3.15 1.35 1.35 ! 0.5135 2841:20 Ambig 5.01, 5.79 A or (resid 22 and name HD2) (resid 97 and name HG2*) ! 0.3277 2841:20 ----- 5.40, 7.08 A or (resid 59 and name HB2) (resid 97 and name HG2*) ! 0.1588 2841:20 ----- 6.10, 7.59 A assign (resid 98 and name HB1) (resid 97 and name HG2*) 3.65 1.85 1.85 ! 0.8896 2842:20 Ambig 4.17, 5.07 A or (resid 22 and name HG1) (resid 97 and name HG2*) ! 0.1104 2842:20 ----- 5.90, 7.67 A assign (resid 98 and name HD2*) (resid 97 and name HG2*) 4.15 2.35 2.35 ! 0.0000 2843:20 Seq 6.37, 7.93 A assign (resid 123 and name HD2*) (resid 123 and name HB1) 3.15 1.35 1.35 ! 0.9669 2844:20 Intra 2.49, 3.22 A assign (resid 32 and name HN) (resid 30 and name HG2*) 4.15 2.35 2.35 ! 0.0000 2845:20 Mid 2.75, 4.12 A assign (resid 1 and name HG2*) (resid 2 and name HA) 4.15 2.35 2.35 ! 0.0000 2848:20 Seq 3.63, 5.93 A assign (resid 2 and name HA) (resid 2 and name HE*) 3.65 1.85 1.85 ! 0.5967 2851:20 Ambig 4.18, 5.13 A or (resid 51 and name HA) (resid 52 and name HB1) ! 0.4033 2851:20 ----- 4.46, 4.75 A assign (resid 92 and name HA) (resid 59 and name HA) 3.15 1.35 1.35 ! 0.0000 2858:20 Long 3.05, 3.68 A assign (resid 92 and name HG2*) (resid 59 and name HA) 3.65 1.85 1.85 ! 0.9129 2859:20 Ambig 2.29, 3.95 A or (resid 94 and name HG2*) (resid 59 and name HA) ! 0.0871 2859:20 ----- 3.38, 4.32 A assign (resid 6 and name HG2*) (resid 4 and name HB1) 3.65 1.85 1.85 ! 0.8335 2861:20 Ambig 2.96, 6.31 A or (resid 87 and name HD1*) (resid 128 and name HG1) ! 0.0837 2861:20 ----- 4.35, 5.96 A or (resid 87 and name HD2*) (resid 128 and name HG1) ! 0.0493 2861:20 ----- 4.75, 6.21 A assign (resid 5 and name HN) (resid 4 and name HG2) 3.15 1.35 1.35 ! 0.0000 2866:20 Seq 2.81, 3.78 A assign (resid 4 and name HB1) (resid 4 and name HG1) 2.30 0.50 0.50 ! 0.0000 2867:20 Intra 2.45, 2.58 A assign (resid 4 and name HB2) (resid 4 and name HG1) 2.30 0.50 0.50 ! 0.0000 2868:20 Intra 2.19, 2.32 A assign (resid 4 and name HB2) (resid 4 and name HG2) 2.30 0.50 0.50 ! 0.0000 2869:20 Intra 2.33, 2.56 A assign (resid 4 and name HB1) (resid 4 and name HG2) 2.65 0.85 0.85 ! 0.0000 2870:20 Intra 2.36, 2.92 A assign (resid 4 and name HG2) (resid 5 and name HA) 4.15 2.35 2.35 ! 0.7553 2873:20 Ambig 3.77, 4.92 A or (resid 4 and name HG1) (resid 5 and name HA) ! 0.2447 2873:20 ----- 4.55, 5.78 A assign (resid 4 and name HB1) (resid 5 and name HB) 4.15 2.35 2.35 ! 0.7440 2876:20 Ambig 4.45, 5.77 A or (resid 7 and name HB*) (resid 5 and name HB) ! 0.1565 2876:20 ----- 5.77, 7.14 A or (resid 6 and name HB) (resid 5 and name HB) ! 0.0995 2876:20 ----- 6.22, 6.57 A assign (resid 29 and name HG*) (resid 5 and name HB) 4.15 2.35 2.35 ! 0.6167 2877:20 Ambig 4.43, 6.61 A or (resid 4 and name HG2) (resid 5 and name HB) ! 0.3833 2877:20 ----- 4.80, 6.02 A assign (resid 7 and name HN) (resid 6 and name HA) 3.65 1.85 1.85 ! 0.9887 2882:20 Seq 2.04, 2.12 A assign (resid 139 and name HN) (resid 10 and name HG1*) 3.15 1.35 1.35 ! 0.9885 2884:20 Long 1.82, 4.19 A assign (resid 30 and name HB) (resid 6 and name HG2*) 3.15 1.35 1.35 ! 0.9816 2885:20 Long 1.96, 3.39 A assign (resid 7 and name HE*) (resid 7 and name HA) 3.65 1.85 1.85 ! 0.0000 2887:20 Intra 4.17, 5.06 A assign (resid 131 and name HD*) (resid 131 and name HB1) 2.30 0.50 0.50 ! 0.5032 2889:20 Ambig 2.31, 2.89 A or (resid 7 and name HD*) (resid 7 and name HB*) ! 0.4968 2889:20 ----- 2.32, 3.07 A assign (resid 5 and name HG2*) (resid 7 and name HG1) 3.65 1.85 1.85 ! 0.9811 2890:20 Mid 2.73, 4.59 A assign (resid 7 and name HN) (resid 7 and name HG2) 3.65 1.85 1.85 ! 0.0000 2893:20 Intra 3.15, 3.77 A assign (resid 7 and name HN) (resid 7 and name HG1) 3.65 1.85 1.85 ! 0.0000 2894:20 Intra 2.45, 2.75 A assign (resid 8 and name HA) (resid 8 and name HB2) 3.65 1.85 1.85 ! 0.9035 2896:20 Ambig 2.42, 2.84 A or (resid 81 and name HA) (resid 37 and name HB) ! 0.0410 2896:20 ----- 4.05, 4.31 A assign (resid 8 and name HA) (resid 8 and name HB1) 3.65 1.85 1.85 ! 0.9557 2897:20 Intra 2.54, 2.77 A assign (resid 9 and name HN) (resid 26 and name HG2*) 4.15 2.35 2.35 ! 0.0000 2898:20 Long 4.33, 5.20 A assign (resid 98 and name HN) (resid 97 and name HB) 3.65 1.85 1.85 ! 0.9031 2900:20 Ambig 3.89, 4.13 A or (resid 27 and name HN) (resid 97 and name HB) ! 0.0740 2900:20 ----- 5.91, 6.09 A assign (resid 56 and name HB1) (resid 97 and name HB) 3.65 1.85 1.85 ! 0.9553 2901:20 Long 3.77, 4.28 A assign (resid 136 and name HN) (resid 136 and name HA) 3.65 1.85 1.85 ! 0.0000 2903:20 Intra 2.91, 2.92 A assign (resid 85 and name HB2) (resid 85 and name HG2) 2.65 0.85 0.85 ! 0.0000 2906:20 Intra 2.29, 2.32 A assign (resid 91 and name HA) (resid 92 and name HG2*) 4.15 2.35 2.35 ! 0.0000 2907:20 Seq 6.39, 6.65 A assign (resid 34 and name HB) (resid 34 and name HA) 3.15 1.35 1.35 ! 0.0000 2909:20 Intra 2.42, 2.46 A assign (resid 11 and name HN) (resid 10 and name HG2*) 2.65 0.85 0.85 ! 0.6061 2910:20 Ambig 3.49, 4.31 A or (resid 14 and name HN) (resid 21 and name HG2*) ! 0.3939 2910:20 ----- 3.75, 4.67 A assign (resid 10 and name HG1*) (resid 140 and name HA2) 3.65 1.85 1.85 ! 0.9657 2911:20 Long 3.48, 4.71 A assign (resid 10 and name HB) (resid 140 and name HA2) 3.65 1.85 1.85 ! 0.9804 2912:20 Long 2.07, 2.66 A assign (resid 142 and name HB) (resid 116 and name HD2*) 3.15 1.35 1.35 ! 0.4750 2915:20 Ambig 3.77, 5.01 A or (resid 92 and name HG12) (resid 59 and name HD1*) ! 0.2361 2915:20 ----- 4.23, 5.93 A or (resid 98 and name HB1) (resid 59 and name HD1*) ! 0.2281 2915:20 ----- 4.26, 5.43 A assign (resid 116 and name HG) (resid 116 and name HD2*) 2.30 0.50 0.50 ! 0.4610 2916:20 Ambig 2.42, 2.64 A or (resid 59 and name HB2) (resid 59 and name HD1*) ! 0.3942 2916:20 ----- 2.49, 3.14 A or (resid 98 and name HB2) (resid 59 and name HD1*) ! 0.1404 2916:20 ----- 2.95, 4.11 A assign (resid 92 and name HD1*) (resid 98 and name HD1*) 3.15 1.35 1.35 ! 0.0000 2917:20 Long 2.75, 5.21 A assign (resid 37 and name HG12) (resid 98 and name HD1*) 3.65 1.85 1.85 ! 0.9920 2918:20 Long 2.65, 4.65 A assign (resid 67 and name HA) (resid 66 and name HA) 3.65 1.85 1.85 ! 0.6020 2919:20 Ambig 4.33, 4.56 A or (resid 65 and name HA) (resid 66 and name HA) ! 0.3980 2919:20 ----- 4.64, 4.92 A assign (resid 67 and name HA) (resid 63 and name HA) 3.65 1.85 1.85 ! 0.8454 2920:20 Ambig 4.57, 4.98 A or (resid 65 and name HA) (resid 63 and name HA) ! 0.1546 2920:20 ----- 6.07, 6.28 A assign (resid 69 and name HD1*) (resid 63 and name HB) 4.15 2.35 2.35 ! 0.0000 2923:20 Long 6.64, 7.98 A assign (resid 63 and name HB) (resid 63 and name HG2*) 2.30 0.50 0.50 ! 0.8530 2925:20 Ambig 2.43, 2.65 A or (resid 124 and name HA) (resid 125 and name HG1*) ! 0.0733 2925:20 ----- 3.66, 6.47 A assign (resid 138 and name HB2) (resid 10 and name HG1*) 3.65 1.85 1.85 ! 0.7251 2926:20 Ambig 2.97, 4.91 A or (resid 140 and name HA1) (resid 10 and name HG1*) ! 0.1755 2926:20 ----- 3.77, 4.84 A or (resid 55 and name HD2) (resid 63 and name HG2*) ! 0.0994 2926:20 ----- 4.14, 5.71 A assign (resid 139 and name HN) (resid 10 and name HG1*) 3.15 1.35 1.35 ! 0.9845 2927:20 Long 1.82, 4.19 A assign (resid 134 and name HB1) (resid 125 and name HG1*) 2.30 0.50 0.50 ! 0.5326 2928:20 Ambig 1.87, 3.65 A or (resid 134 and name HD*) (resid 125 and name HG1*) ! 0.2872 2928:20 ----- 2.08, 6.23 A or (resid 134 and name HD*) (resid 125 and name HG2*) ! 0.1020 2928:20 ----- 2.47, 5.01 A assign (resid 55 and name HG1) (resid 63 and name HG2*) 2.65 0.85 0.85 ! 0.3347 2929:20 Ambig 2.39, 3.51 A or (resid 8 and name HG) (resid 125 and name HG2*) ! 0.2584 2929:20 ----- 2.49, 4.30 A or (resid 8 and name HG) (resid 125 and name HG1*) ! 0.1524 2929:20 ----- 2.72, 6.10 A or (resid 8 and name HB2) (resid 125 and name HG2*) ! 0.1383 2929:20 ----- 2.77, 5.32 A or (resid 133 and name HG12) (resid 125 and name HG1*) ! 0.0356 2929:20 ----- 3.47, 5.21 A or (resid 133 and name HG12) (resid 125 and name HG2*) ! 0.0304 2929:20 ----- 3.56, 7.21 A assign (resid 89 and name HB2) (resid 89 and name HA) 3.15 1.35 1.35 ! 0.9889 2930:20 Intra 3.01, 3.03 A assign (resid 88 and name HB*) (resid 89 and name HA) 3.65 1.85 1.85 ! 0.0000 2931:20 Seq 4.32, 4.92 A assign (resid 86 and name HG2*) (resid 89 and name HA) 3.65 1.85 1.85 ! 0.8922 2932:20 Ambig 4.75, 6.23 A or (resid 91 and name HB2) (resid 89 and name HA) ! 0.1078 2932:20 ----- 6.76, 7.55 A assign (resid 64 and name HB2) (resid 64 and name HA) 2.65 0.85 0.85 ! 0.9495 2933:20 Intra 2.40, 2.44 A assign (resid 91 and name HD*) (resid 89 and name HA) 3.65 1.85 1.85 ! 0.8975 2934:20 Ambig 4.05, 5.14 A or (resid 90 and name HB2) (resid 89 and name HA) ! 0.1025 2934:20 ----- 5.82, 5.94 A assign (resid 91 and name HG1) (resid 89 and name HA) 4.15 2.35 2.35 ! 0.9684 2935:20 Mid 4.28, 5.33 A assign (resid 63 and name HN) (resid 64 and name HA) 3.65 1.85 1.85 ! 0.0000 2937:20 Seq 4.93, 5.18 A assign (resid 66 and name HN) (resid 64 and name HA) 3.65 1.85 1.85 ! 0.9260 2938:20 Mid 3.13, 3.34 A assign (resid 90 and name HN) (resid 89 and name HA) 3.65 1.85 1.85 ! 0.0000 2940:20 Seq 3.49, 3.54 A assign (resid 65 and name HD22) (resid 64 and name HB1) 3.65 1.85 1.85 ! 0.0000 2941:20 Seq 3.82, 4.76 A assign (resid 69 and name HB) (resid 68 and name HA) 3.65 1.85 1.85 ! 0.0000 2944:20 Seq 4.76, 4.89 A assign (resid 67 and name HB*) (resid 68 and name HB2) 3.65 1.85 1.85 ! 0.8928 2950:20 Ambig 3.35, 4.56 A or (resid 55 and name HD1) (resid 68 and name HB2) ! 0.0718 2950:20 ----- 5.09, 5.64 A assign (resid 69 and name HB) (resid 69 and name HA) 3.65 1.85 1.85 ! 0.0000 2951:20 Intra 3.02, 3.04 A assign (resid 81 and name HA) (resid 80 and name HA) 3.15 1.35 1.35 ! 0.7459 2952:20 Ambig 4.37, 4.40 A or (resid 38 and name HA) (resid 80 and name HA) ! 0.1922 2952:20 ----- 5.48, 5.61 A assign (resid 47 and name HE*) (resid 144 and name HG2*) 3.15 1.35 1.35 ! 0.9517 2956:20 Long 2.40, 5.42 A assign (resid 109 and name HN) (resid 47 and name HA) 3.65 1.85 1.85 ! 0.7151 2961:20 Ambig 3.96, 4.64 A or (resid 108 and name HD21) (resid 47 and name HA) ! 0.2849 2961:20 ----- 4.62, 6.69 A assign (resid 47 and name HD2) (resid 47 and name HA) 3.65 1.85 1.85 ! 0.0000 2962:20 Intra 4.26, 4.59 A assign (resid 44 and name HB2) (resid 47 and name HB*) 3.65 1.85 1.85 ! 0.0000 2965:20 Mid 1.94, 3.96 A assign (resid 44 and name HB1) (resid 47 and name HB*) 3.65 1.85 1.85 ! 0.9919 2966:20 Mid 2.02, 2.88 A assign (resid 109 and name HA) (resid 47 and name HB*) 3.65 1.85 1.85 ! 0.7382 2967:20 Ambig 3.74, 4.67 A or (resid 114 and name HB2) (resid 47 and name HB*) ! 0.2287 2967:20 ----- 4.54, 5.88 A assign (resid 47 and name HB*) (resid 47 and name HG1) 2.65 0.85 0.85 ! 0.0000 2968:20 Intra 2.34, 2.70 A assign (resid 47 and name HA) (resid 47 and name HD1) 3.65 1.85 1.85 ! 0.9104 2969:20 Ambig 4.40, 4.77 A or (resid 17 and name HA) (resid 47 and name HD1) ! 0.0896 2969:20 ----- 6.47, 7.76 A assign (resid 141 and name HG1) (resid 141 and name HD1) 2.30 0.50 0.50 ! 0.6801 2970:20 Ambig 2.30, 2.49 A or (resid 12 and name HG2*) (resid 141 and name HD1) ! 0.3070 2970:20 ----- 2.62, 5.12 A assign (resid 47 and name HA) (resid 47 and name HD2) 3.65 1.85 1.85 ! 0.8902 2971:20 Ambig 4.26, 4.59 A or (resid 111 and name HA) (resid 47 and name HD2) ! 0.1098 2971:20 ----- 6.04, 6.97 A assign (resid 82 and name HD*) (resid 82 and name HB1) 3.65 1.85 1.85 ! 0.9869 2972:20 Intra 2.45, 3.06 A assign (resid 141 and name HD2) (resid 113 and name HB1) 3.65 1.85 1.85 ! 0.9894 2974:20 Long 1.89, 3.92 A assign (resid 80 and name HG2*) (resid 82 and name HB1) 3.65 1.85 1.85 ! 0.0000 2975:20 Mid 5.58, 6.47 A assign (resid 143 and name HG2*) (resid 113 and name HB1) 3.65 1.85 1.85 ! 0.8179 2976:20 Ambig 2.06, 4.73 A or (resid 141 and name HG1) (resid 113 and name HB1) ! 0.1747 2976:20 ----- 2.67, 4.53 A assign (resid 101 and name HN) (resid 24 and name HB1) 3.65 1.85 1.85 ! 0.5647 2977:20 Ambig 5.15, 5.42 A or (resid 98 and name HN) (resid 24 and name HB1) ! 0.3026 2977:20 ----- 5.72, 6.26 A or (resid 26 and name HN) (resid 24 and name HB1) ! 0.1327 2977:20 ----- 6.56, 6.72 A assign (resid 62 and name HN) (resid 61 and name HD2) 4.15 2.35 2.35 ! 0.0000 2978:20 Seq 2.72, 4.70 A assign (resid 61 and name HN) (resid 61 and name HD2) 3.65 1.85 1.85 ! 0.0000 2979:20 Intra 2.77, 4.52 A assign (resid 94 and name HB) (resid 95 and name HA) 3.65 1.85 1.85 ! 0.9335 2980:20 Seq 4.51, 4.66 A assign (resid 30 and name HG1*) (resid 95 and name HA) 3.15 1.35 1.35 ! 0.9838 2981:20 Long 2.40, 3.12 A assign (resid 96 and name HA1) (resid 95 and name HA) 3.65 1.85 1.85 ! 0.0000 2982:20 Seq 4.26, 4.33 A assign (resid 74 and name HB) (resid 77 and name HE*) 3.65 1.85 1.85 ! 0.8117 2983:20 Ambig 3.63, 6.01 A or (resid 120 and name HD2) (resid 119 and name HB1) ! 0.1679 2983:20 ----- 4.73, 4.87 A assign (resid 96 and name HA2) (resid 95 and name HB1) 3.65 1.85 1.85 ! 0.0000 2984:20 Seq 4.86, 5.47 A assign (resid 29 and name HA) (resid 95 and name HB2) 4.15 2.35 2.35 ! 0.6759 2985:20 Ambig 3.57, 5.63 A or (resid 28 and name HB2) (resid 95 and name HB2) ! 0.3241 2985:20 ----- 4.04, 4.95 A assign (resid 29 and name HN) (resid 95 and name HB1) 3.65 1.85 1.85 ! 0.0000 2988:20 Long 2.71, 3.14 A assign (resid 30 and name HN) (resid 95 and name HB1) 3.15 1.35 1.35 ! 0.9636 2989:20 Long 2.36, 3.06 A assign (resid 47 and name HG2) (resid 110 and name HB) 4.15 2.35 2.35 ! 0.7139 2991:20 Ambig 4.48, 6.37 A or (resid 144 and name HG2*) (resid 110 and name HB) ! 0.2861 2991:20 ----- 5.22, 7.09 A assign (resid 146 and name HA2) (resid 111 and name HA) 3.65 1.85 1.85 ! 0.8242 2995:20 Ambig 3.29, 4.76 A or (resid 110 and name HA) (resid 111 and name HA) ! 0.1758 2995:20 ----- 4.26, 4.32 A assign (resid 112 and name HA2) (resid 111 and name HA) 3.15 1.35 1.35 ! 0.8644 2996:20 Ambig 4.41, 4.54 A or (resid 143 and name HA) (resid 111 and name HA) ! 0.1356 2996:20 ----- 6.00, 6.52 A assign (resid 144 and name HA) (resid 111 and name HA) 3.65 1.85 1.85 ! 0.0000 2997:20 Long 4.33, 4.59 A assign (resid 105 and name HD1*) (resid 111 and name HA) 4.15 2.35 2.35 ! 0.0000 2998:20 Long 5.80, 7.39 A assign (resid 17 and name HG2) (resid 111 and name HB*) 3.15 1.35 1.35 ! 0.4330 3002:20 Ambig 3.82, 5.72 A or (resid 17 and name HG2) (resid 109 and name HB*) ! 0.4164 3002:20 ----- 3.85, 5.98 A or (resid 105 and name HB) (resid 109 and name HB*) ! 0.1505 3002:20 ----- 4.56, 5.31 A assign (resid 17 and name HD2) (resid 111 and name HB*) 3.65 1.85 1.85 ! 0.6649 3005:20 Ambig 4.72, 6.38 A or (resid 17 and name HD2) (resid 109 and name HB*) ! 0.3351 3005:20 ----- 5.29, 7.01 A assign (resid 144 and name HA) (resid 111 and name HB*) 3.65 1.85 1.85 ! 0.8051 3006:20 Ambig 4.87, 6.15 A or (resid 144 and name HA) (resid 109 and name HB*) ! 0.1949 3006:20 ----- 6.17, 7.30 A assign (resid 144 and name HB) (resid 112 and name HA1) 3.65 1.85 1.85 ! 0.5994 3007:20 Ambig 4.16, 4.36 A or (resid 113 and name HB1) (resid 112 and name HA1) ! 0.4006 3007:20 ----- 4.45, 5.29 A assign (resid 113 and name HB2) (resid 112 and name HA1) 4.15 2.35 2.35 ! 0.0000 3009:20 Seq 4.72, 5.49 A assign (resid 111 and name HB*) (resid 112 and name HA1) 3.65 1.85 1.85 ! 0.5358 3010:20 Ambig 4.51, 5.13 A or (resid 110 and name HG2*) (resid 112 and name HA1) ! 0.3349 3010:20 ----- 4.88, 6.98 A or (resid 47 and name HD1) (resid 112 and name HA1) ! 0.1292 3010:20 ----- 5.72, 6.43 A assign (resid 143 and name HG2*) (resid 112 and name HA1) 3.65 1.85 1.85 ! 0.5924 3011:20 Ambig 4.91, 6.45 A or (resid 144 and name HG2*) (resid 112 and name HA1) ! 0.4076 3011:20 ----- 5.23, 6.18 A assign (resid 143 and name HA) (resid 113 and name HB1) 3.65 1.85 1.85 ! 0.9609 3014:20 Long 2.15, 3.90 A assign (resid 141 and name HN) (resid 140 and name HA2) 3.65 1.85 1.85 ! 0.6319 3016:20 Ambig 2.14, 2.34 A or (resid 140 and name HN) (resid 140 and name HA2) ! 0.3674 3016:20 ----- 2.34, 2.83 A assign (resid 30 and name HN) (resid 95 and name HB2) 3.15 1.35 1.35 ! 0.9053 3017:20 Ambig 2.84, 4.15 A or (resid 133 and name HN) (resid 132 and name HB2) ! 0.0947 3017:20 ----- 4.14, 4.28 A assign (resid 126 and name HA) (resid 133 and name HG11) 4.15 2.35 2.35 ! 0.0000 3019:20 Long 3.48, 4.78 A assign (resid 126 and name HA) (resid 133 and name HG12) 4.15 2.35 2.35 ! 0.0000 3020:20 Long 2.96, 3.50 A assign (resid 129 and name HD21) (resid 133 and name HD1*) 4.15 2.35 2.35 ! 0.0000 3023:20 Mid 5.50, 7.58 A assign (resid 30 and name HN) (resid 27 and name HG2*) 4.15 2.35 2.35 ! 0.7433 3024:20 Ambig 4.95, 6.34 A or (resid 56 and name HD22) (resid 27 and name HG2*) ! 0.2567 3024:20 ----- 5.91, 6.90 A assign (resid 28 and name HN) (resid 27 and name HG2*) 3.15 1.35 1.35 ! 0.0000 3025:20 Seq 4.08, 4.93 A assign (resid 3 and name HB2) (resid 133 and name HD1*) 3.65 1.85 1.85 ! 0.9920 3026:20 Long 2.20, 4.30 A assign (resid 126 and name HB*) (resid 133 and name HD1*) 3.65 1.85 1.85 ! 0.0000 3028:20 Long 5.69, 7.63 A assign (resid 127 and name HB2) (resid 133 and name HG2*) 4.15 2.35 2.35 ! 0.0000 3029:20 Long 3.28, 6.15 A assign (resid 132 and name HA) (resid 133 and name HG2*) 3.65 1.85 1.85 ! 0.9594 3033:20 Seq 3.77, 5.02 A assign (resid 106 and name HD21) (resid 105 and name HG2*) 4.15 2.35 2.35 ! 0.0000 3034:20 Seq 5.29, 7.37 A assign (resid 10 and name HB) (resid 10 and name HA) 3.65 1.85 1.85 ! 0.0000 3041:20 Intra 2.48, 2.51 A assign (resid 87 and name HB1) (resid 86 and name HA) 3.65 1.85 1.85 ! 0.3534 3043:20 Ambig 5.38, 5.67 A or (resid 85 and name HG1) (resid 86 and name HA) ! 0.2923 3043:20 ----- 5.55, 5.95 A or (resid 25 and name HB) (resid 10 and name HA) ! 0.2267 3043:20 ----- 5.79, 6.22 A or (resid 24 and name HB1) (resid 10 and name HA) ! 0.0643 3043:20 ----- 7.15, 7.53 A assign (resid 10 and name HG1*) (resid 10 and name HA) 3.15 1.35 1.35 ! 0.9948 3044:20 Intra 2.44, 3.10 A assign (resid 9 and name HA) (resid 10 and name HA) 3.65 1.85 1.85 ! 0.9296 3047:20 Seq 4.38, 4.44 A assign (resid 131 and name HG1) (resid 131 and name HB2) 2.65 0.85 0.85 ! 0.9834 3049:20 Intra 2.37, 2.42 A assign (resid 131 and name HG2) (resid 131 and name HB2) 2.65 0.85 0.85 ! 0.9885 3050:20 Intra 2.35, 2.45 A assign (resid 55 and name HB1) (resid 70 and name HG2*) 3.65 1.85 1.85 ! 0.0000 3053:20 Long 5.32, 5.97 A assign (resid 98 and name HG) (resid 60 and name HG2*) 3.15 1.35 1.35 ! 0.6247 3054:20 Ambig 3.77, 4.59 A or (resid 59 and name HG) (resid 60 and name HG2*) ! 0.3377 3054:20 ----- 4.18, 5.88 A assign (resid 41 and name HG12) (resid 118 and name HG2*) 2.65 0.85 0.85 ! 0.7496 3055:20 Ambig 1.98, 3.35 A or (resid 41 and name HG12) (resid 118 and name HG1*) ! 0.2504 3055:20 ----- 2.38, 4.11 A assign (resid 141 and name HB2) (resid 12 and name HB) 4.15 2.35 2.35 ! 0.7044 3060:20 Ambig 5.52, 5.89 A or (resid 105 and name HG1*) (resid 49 and name HB) ! 0.1719 3060:20 ----- 6.98, 7.52 A or (resid 10 and name HB) (resid 12 and name HB) ! 0.1237 3060:20 ----- 7.38, 7.98 A assign (resid 104 and name HA) (resid 49 and name HB) 3.65 1.85 1.85 ! 0.0000 3063:20 Long 4.47, 4.76 A assign (resid 11 and name HA2) (resid 12 and name HB) 3.65 1.85 1.85 ! 0.5719 3064:20 Ambig 4.46, 4.73 A or (resid 51 and name HA) (resid 49 and name HB) ! 0.4281 3064:20 ----- 4.68, 5.35 A assign (resid 144 and name HA) (resid 145 and name HG2*) 3.15 1.35 1.35 ! 0.8547 3067:20 Ambig 3.71, 4.96 A or (resid 113 and name HA) (resid 12 and name HG2*) ! 0.1153 3067:20 ----- 5.17, 6.18 A assign (resid 141 and name HN) (resid 12 and name HG2*) 3.15 1.35 1.35 ! 0.8484 3069:20 Ambig 3.57, 4.95 A or (resid 144 and name HN) (resid 145 and name HG2*) ! 0.1311 3069:20 ----- 4.87, 6.16 A assign (resid 75 and name HG2) (resid 74 and name HG2*) 3.15 1.35 1.35 ! 0.0000 3070:20 Seq 2.74, 3.83 A assign (resid 141 and name HB2) (resid 12 and name HG2*) 3.15 1.35 1.35 ! 0.0000 3071:20 Long 3.58, 4.83 A assign (resid 143 and name HN) (resid 13 and name HB) 3.65 1.85 1.85 ! 0.0000 3074:20 Long 5.20, 5.31 A assign (resid 11 and name HA1) (resid 13 and name HG1*) 3.15 1.35 1.35 ! 0.0000 3080:20 Mid 4.21, 5.46 A assign (resid 142 and name HD1*) (resid 13 and name HG2*) 2.65 0.85 0.85 ! 0.0000 3081:20 Long 3.92, 4.90 A assign (resid 142 and name HG2*) (resid 13 and name HG2*) 2.65 0.85 0.85 ! 0.0000 3082:20 Long 2.31, 4.42 A assign (resid 142 and name HG11) (resid 13 and name HG2*) 2.65 0.85 0.85 ! 0.9053 3083:20 Ambig 3.58, 4.12 A or (resid 97 and name HG2*) (resid 26 and name HG2*) ! 0.0947 3083:20 ----- 5.21, 7.27 A assign (resid 142 and name HA) (resid 14 and name HA) 3.15 1.35 1.35 ! 0.0000 3084:20 Long 3.60, 3.75 A assign (resid 144 and name HA) (resid 14 and name HA) 3.65 1.85 1.85 ! 0.9571 3085:20 Long 4.27, 4.45 A assign (resid 143 and name HA) (resid 14 and name HA) 3.65 1.85 1.85 ! 0.5250 3086:20 Ambig 4.25, 4.38 A or (resid 13 and name HA) (resid 14 and name HA) ! 0.4750 3086:20 ----- 4.32, 4.39 A assign (resid 145 and name HN) (resid 14 and name HA) 3.65 1.85 1.85 ! 0.8233 3087:20 Ambig 4.61, 4.98 A or (resid 16 and name HN) (resid 14 and name HA) ! 0.1228 3087:20 ----- 6.34, 6.44 A assign (resid 105 and name HD1*) (resid 14 and name HB*) 4.15 2.35 2.35 ! 0.0000 3088:20 Long 6.50, 7.34 A assign (resid 144 and name HA) (resid 14 and name HB*) 3.65 1.85 1.85 ! 0.0000 3090:20 Long 4.74, 5.60 A assign (resid 142 and name HA) (resid 14 and name HB*) 3.65 1.85 1.85 ! 0.0000 3091:20 Long 5.41, 6.19 A assign (resid 24 and name HG2) (resid 11 and name HA2) 4.15 2.35 2.35 ! 0.4018 3093:20 Ambig 5.41, 6.74 A or (resid 13 and name HB) (resid 15 and name HA2) ! 0.3204 3093:20 ----- 5.62, 6.11 A or (resid 105 and name HB) (resid 15 and name HA2) ! 0.2778 3093:20 ----- 5.75, 6.13 A assign (resid 19 and name HB2) (resid 15 and name HA1) 4.15 2.35 2.35 ! 0.0000 3095:20 Mid 4.66, 5.56 A assign (resid 19 and name HB1) (resid 15 and name HA1) 3.65 1.85 1.85 ! 0.9286 3096:20 Mid 3.36, 4.05 A assign (resid 13 and name HG2*) (resid 15 and name HA1) 3.65 1.85 1.85 ! 0.5761 3097:20 Ambig 4.90, 6.24 A or (resid 142 and name HG12) (resid 15 and name HA1) ! 0.2286 3097:20 ----- 5.72, 6.23 A or (resid 13 and name HG2*) (resid 11 and name HA1) ! 0.1953 3097:20 ----- 5.87, 7.24 A assign (resid 106 and name HB2) (resid 109 and name HA) 3.65 1.85 1.85 ! 0.7473 3098:20 Ambig 3.40, 4.61 A or (resid 108 and name HB1) (resid 109 and name HA) ! 0.2301 3098:20 ----- 4.14, 4.47 A assign (resid 47 and name HA) (resid 109 and name HA) 3.15 1.35 1.35 ! 0.9916 3099:20 Long 2.39, 2.87 A assign (resid 108 and name HA) (resid 109 and name HA) 3.65 1.85 1.85 ! 0.0000 3100:20 Seq 4.64, 4.74 A assign (resid 47 and name HB*) (resid 109 and name HB*) 2.65 0.85 0.85 ! 0.0000 3101:20 Long 2.58, 4.94 A assign (resid 105 and name HG2*) (resid 109 and name HB*) 2.30 0.50 0.50 ! 0.5560 3103:20 Ambig 2.15, 3.45 A or (resid 47 and name HG2) (resid 109 and name HB*) ! 0.3611 3103:20 ----- 2.31, 3.30 A or (resid 144 and name HG2*) (resid 109 and name HB*) ! 0.0741 3103:20 ----- 3.01, 5.38 A assign (resid 9 and name HN) (resid 137 and name HB*) 4.15 2.35 2.35 ! 0.3501 3109:20 Ambig 5.47, 7.54 A or (resid 9 and name HN) (resid 136 and name HB*) ! 0.3320 3109:20 ----- 5.52, 7.29 A or (resid 112 and name HN) (resid 110 and name HG2*) ! 0.3178 3109:20 ----- 5.56, 7.41 A assign (resid 17 and name HG2) (resid 111 and name HA) 4.15 2.35 2.35 ! 0.0000 3113:20 Long 4.60, 5.58 A assign (resid 111 and name HN) (resid 109 and name HA) 4.15 2.35 2.35 ! 0.0000 3114:20 Mid 5.91, 6.13 A assign (resid 108 and name HN) (resid 109 and name HA) 3.65 1.85 1.85 ! 0.0000 3115:20 Seq 4.46, 4.66 A assign (resid 108 and name HN) (resid 109 and name HB*) 3.15 1.35 1.35 ! 0.0000 3117:20 Seq 3.95, 4.93 A assign (resid 111 and name HA) (resid 110 and name HA) 3.65 1.85 1.85 ! 0.8544 3118:20 Ambig 4.26, 4.32 A or (resid 17 and name HA) (resid 110 and name HA) ! 0.0817 3118:20 ----- 6.30, 7.42 A assign (resid 47 and name HE*) (resid 110 and name HG2*) 3.65 1.85 1.85 ! 0.0000 3124:20 Long 4.43, 5.97 A assign (resid 9 and name HA) (resid 137 and name HB*) 4.15 2.35 2.35 ! 0.8745 3129:20 Ambig 3.05, 5.09 A or (resid 8 and name HA) (resid 136 and name HB*) ! 0.0592 3129:20 ----- 4.77, 6.24 A assign (resid 103 and name HA) (resid 103 and name HB2) 3.15 1.35 1.35 ! 0.9360 3132:20 Intra 3.01, 3.02 A assign (resid 116 and name HG) (resid 114 and name HB2) 3.65 1.85 1.85 ! 0.4585 3133:20 Ambig 4.67, 5.44 A or (resid 141 and name HG2) (resid 114 and name HB2) ! 0.3743 3133:20 ----- 4.83, 5.69 A or (resid 141 and name HD1) (resid 114 and name HB2) ! 0.0840 3133:20 ----- 6.19, 7.33 A or (resid 109 and name HB*) (resid 114 and name HB2) ! 0.0832 3133:20 ----- 6.20, 7.80 A assign (resid 136 and name HN) (resid 134 and name HD*) 3.65 1.85 1.85 ! 0.9499 3135:20 Mid 2.92, 3.89 A assign (resid 28 and name HN) (resid 27 and name HG12) 3.15 1.35 1.35 ! 0.0000 3137:20 Seq 2.64, 2.93 A assign (resid 59 and name HD2*) (resid 59 and name HG) 2.30 0.50 0.50 ! 0.5009 3138:20 Ambig 2.33, 2.62 A or (resid 123 and name HD1*) (resid 134 and name HD*) ! 0.4817 3138:20 ----- 2.35, 4.98 A assign (resid 51 and name HA) (resid 51 and name HD1) 3.65 1.85 1.85 ! 0.0000 3139:20 Intra 3.07, 4.10 A assign (resid 51 and name HA) (resid 51 and name HD2) 3.65 1.85 1.85 ! 0.9982 3140:20 Intra 1.96, 3.73 A assign (resid 51 and name HG*) (resid 50 and name HG2*) 3.65 1.85 1.85 ! 0.7493 3141:20 Ambig 4.91, 6.47 A or (resid 49 and name HG2*) (resid 50 and name HG2*) ! 0.2507 3141:20 ----- 5.89, 7.66 A assign (resid 41 and name HB) (resid 50 and name HG2*) 4.15 2.35 2.35 ! 0.0000 3142:20 Long 5.83, 7.01 A assign (resid 51 and name HB*) (resid 50 and name HG2*) 3.15 1.35 1.35 ! 0.6397 3143:20 Ambig 4.27, 5.71 A or (resid 51 and name HD1) (resid 50 and name HG2*) ! 0.3603 3143:20 ----- 4.70, 7.15 A assign (resid 53 and name HB) (resid 50 and name HG2*) 3.65 1.85 1.85 ! 0.0000 3144:20 Mid 5.42, 6.35 A assign (resid 52 and name HB1) (resid 50 and name HG2*) 3.65 1.85 1.85 ! 0.8583 3145:20 Ambig 4.90, 6.11 A or (resid 48 and name HB2) (resid 50 and name HG2*) ! 0.1417 3145:20 ----- 6.62, 7.63 A assign (resid 103 and name HE*) (resid 50 and name HG2*) 3.65 1.85 1.85 ! 0.0000 3146:20 Long 3.34, 5.00 A assign (resid 102 and name HN) (resid 50 and name HG2*) 3.65 1.85 1.85 ! 0.0000 3147:20 Long 3.21, 4.44 A assign (resid 93 and name HN) (resid 30 and name HG2*) 3.65 1.85 1.85 ! 0.9056 3148:20 Ambig 4.67, 5.77 A or (resid 29 and name HN) (resid 30 and name HG2*) ! 0.0944 3148:20 ----- 6.81, 7.15 A assign (resid 101 and name HN) (resid 50 and name HG2*) 4.15 2.35 2.35 ! 0.0000 3149:20 Long 6.64, 7.87 A assign (resid 80 and name HG2*) (resid 81 and name HB) 3.65 1.85 1.85 ! 0.0000 3150:20 Seq 5.07, 5.96 A assign (resid 62 and name HB1) (resid 63 and name HA) 3.65 1.85 1.85 ! 0.6131 3154:20 Ambig 4.77, 5.03 A or (resid 57 and name HG2*) (resid 63 and name HA) ! 0.3869 3154:20 ----- 5.15, 7.94 A assign (resid 116 and name HN) (resid 141 and name HG1) 3.65 1.85 1.85 ! 0.0000 3157:20 Long 4.08, 4.58 A assign (resid 11 and name HA1) (resid 12 and name HA) 3.65 1.85 1.85 ! 0.0000 3160:20 Seq 4.34, 4.41 A assign (resid 27 and name HA) (resid 27 and name HG12) 3.15 1.35 1.35 ! 0.0000 3161:20 Intra 3.14, 3.18 A assign (resid 138 and name HN) (resid 138 and name HB1) 3.15 1.35 1.35 ! 0.6505 3162:20 Ambig 3.18, 3.76 A or (resid 137 and name HN) (resid 138 and name HB1) ! 0.1646 3162:20 ----- 3.99, 5.38 A or (resid 8 and name HN) (resid 9 and name HB2) ! 0.1036 3162:20 ----- 4.31, 4.88 A or (resid 137 and name HN) (resid 9 and name HB2) ! 0.0687 3162:20 ----- 4.62, 5.59 A assign (resid 59 and name HB1) (resid 59 and name HD2*) 2.65 0.85 0.85 ! 0.9981 3163:20 Intra 2.58, 3.23 A assign (resid 13 and name HG2*) (resid 14 and name HA) 3.15 1.35 1.35 ! 0.8865 3164:20 Ambig 3.78, 4.97 A or (resid 142 and name HG12) (resid 14 and name HA) ! 0.1135 3164:20 ----- 5.32, 5.53 A assign (resid 105 and name HG2*) (resid 106 and name HB2) 3.15 1.35 1.35 ! 0.4240 3165:20 Ambig 4.42, 5.54 A or (resid 47 and name HG2) (resid 106 and name HB2) ! 0.3003 3165:20 ----- 4.68, 5.16 A or (resid 145 and name HG2*) (resid 16 and name HB2) ! 0.1585 3165:20 ----- 5.20, 7.12 A or (resid 105 and name HG2*) (resid 16 and name HB2) ! 0.1173 3165:20 ----- 5.47, 6.65 A assign (resid 105 and name HG2*) (resid 106 and name HB1) 3.65 1.85 1.85 ! 0.6526 3166:20 Ambig 4.11, 5.29 A or (resid 47 and name HG2) (resid 106 and name HB1) ! 0.3474 3166:20 ----- 4.56, 5.14 A assign (resid 48 and name HZ) (resid 142 and name HD1*) 3.65 1.85 1.85 ! 0.9262 3167:20 Long 3.09, 4.24 A assign (resid 14 and name HA) (resid 142 and name HD1*) 4.15 2.35 2.35 ! 0.0000 3168:20 Long 6.30, 7.30 A assign (resid 82 and name HA) (resid 83 and name HB) 4.15 2.35 2.35 ! 0.0000 3170:20 Seq 4.67, 5.16 A assign (resid 68 and name HB2) (resid 53 and name HG2*) 4.15 2.35 2.35 ! 0.0000 3171:20 Long 6.61, 7.51 A assign (resid 82 and name HN) (resid 37 and name HD1*) 3.65 1.85 1.85 ! 0.5811 3175:20 Ambig 4.25, 5.27 A or (resid 78 and name HN) (resid 41 and name HD1*) ! 0.4189 3175:20 ----- 4.49, 5.64 A assign (resid 126 and name HN) (resid 37 and name HD1*) 3.65 1.85 1.85 ! 0.7459 3176:20 Ambig 4.59, 6.17 A or (resid 38 and name HN) (resid 37 and name HD1*) ! 0.2541 3176:20 ----- 5.49, 6.23 A assign (resid 55 and name HB2) (resid 55 and name HA) 2.65 0.85 0.85 ! 0.9953 3177:20 Intra 2.65, 2.69 A assign (resid 33 and name HD1) (resid 33 and name HG1) 2.65 0.85 0.85 ! 0.9926 3178:20 Intra 2.30, 2.31 A assign (resid 74 and name HA) (resid 73 and name HA) 3.65 1.85 1.85 ! 0.0000 3179:20 Seq 4.30, 4.33 A assign (resid 72 and name HN) (resid 73 and name HA) 3.65 1.85 1.85 ! 0.0000 3183:20 Seq 4.67, 4.95 A assign (resid 71 and name HD22) (resid 73 and name HB*) 3.65 1.85 1.85 ! 0.0000 3185:20 Mid 2.53, 4.74 A assign (resid 72 and name HN) (resid 73 and name HB*) 4.15 2.35 2.35 ! 0.0000 3186:20 Seq 5.15, 6.05 A assign (resid 77 and name HA) (resid 73 and name HB*) 4.15 2.35 2.35 ! 0.8042 3189:20 Ambig 4.06, 5.12 A or (resid 71 and name HA) (resid 73 and name HB*) ! 0.1958 3189:20 ----- 5.13, 6.50 A assign (resid 139 and name HB1) (resid 117 and name HA) 3.65 1.85 1.85 ! 0.6989 3192:20 Ambig 4.00, 4.94 A or (resid 132 and name HB1) (resid 124 and name HA) ! 0.2257 3192:20 ----- 4.83, 5.38 A assign (resid 139 and name HD22) (resid 117 and name HA) 3.65 1.85 1.85 ! 0.0000 3193:20 Long 2.31, 3.27 A assign (resid 139 and name HD21) (resid 117 and name HA) 3.65 1.85 1.85 ! 0.0000 3194:20 Long 1.97, 2.45 A assign (resid 42 and name HN) (resid 117 and name HB) 3.65 1.85 1.85 ! 0.9891 3196:20 Long 3.26, 3.66 A assign (resid 132 and name HA) (resid 124 and name HA) 4.15 2.35 2.35 ! 0.0000 3198:20 Long 4.91, 5.31 A assign (resid 115 and name HB*) (resid 117 and name HB) 4.15 2.35 2.35 ! 0.8680 3199:20 Ambig 5.64, 7.02 A or (resid 116 and name HG) (resid 117 and name HB) ! 0.1320 3199:20 ----- 7.72, 7.82 A assign (resid 139 and name HD21) (resid 117 and name HB) 4.15 2.35 2.35 ! 0.0000 3201:20 Long 3.96, 4.92 A assign (resid 139 and name HB2) (resid 117 and name HG2*) 4.15 2.35 2.35 ! 0.0000 3202:20 Long 2.92, 5.89 A assign (resid 119 and name HB2) (resid 117 and name HG2*) 3.65 1.85 1.85 ! 0.0000 3203:20 Mid 4.27, 5.62 A assign (resid 29 and name HB1) (resid 6 and name HB) 4.15 2.35 2.35 ! 0.4671 3207:20 Ambig 4.66, 6.41 A or (resid 29 and name HB1) (resid 7 and name HB*) ! 0.4133 3207:20 ----- 4.75, 6.15 A or (resid 84 and name HB1) (resid 85 and name HB1) ! 0.0659 3207:20 ----- 6.46, 6.58 A assign (resid 134 and name HE2) (resid 6 and name HB) 4.15 2.35 2.35 ! 0.4001 3208:20 Ambig 5.68, 7.90 A or (resid 139 and name HB1) (resid 118 and name HB) ! 0.3191 3208:20 ----- 5.90, 6.66 A or (resid 119 and name HB1) (resid 118 and name HB) ! 0.2808 3208:20 ----- 6.03, 6.22 A assign (resid 28 and name HN) (resid 7 and name HB*) 4.15 2.35 2.35 ! 0.9261 3209:20 Long 2.79, 3.99 A assign (resid 82 and name HN) (resid 70 and name HG2*) 4.15 2.35 2.35 ! 0.0000 3212:20 Long 6.47, 7.51 A assign (resid 69 and name HA) (resid 70 and name HG2*) 3.15 1.35 1.35 ! 0.4883 3214:20 Ambig 3.97, 5.04 A or (resid 120 and name HA) (resid 118 and name HG1*) ! 0.4672 3214:20 ----- 4.00, 5.27 A assign (resid 39 and name HB*) (resid 39 and name HE*) 2.30 0.50 0.50 ! 0.8812 3218:20 Ambig 2.08, 3.37 A or (resid 101 and name HG) (resid 23 and name HG1*) ! 0.0925 3218:20 ----- 3.03, 4.64 A assign (resid 116 and name HD2*) (resid 116 and name HA) 3.65 1.85 1.85 ! 0.0000 3221:20 Intra 2.30, 3.12 A assign (resid 116 and name HG) (resid 116 and name HA) 3.65 1.85 1.85 ! 0.8800 3222:20 Ambig 3.33, 3.38 A or (resid 115 and name HB*) (resid 116 and name HA) ! 0.1200 3222:20 ----- 4.63, 5.16 A assign (resid 41 and name HG2*) (resid 116 and name HB2) 2.65 0.85 0.85 ! 0.4101 3223:20 Ambig 3.44, 4.23 A or (resid 118 and name HG2*) (resid 116 and name HB2) ! 0.3036 3223:20 ----- 3.62, 4.67 A or (resid 23 and name HG1*) (resid 116 and name HB2) ! 0.1178 3223:20 ----- 4.24, 5.93 A or (resid 23 and name HG2*) (resid 116 and name HB2) ! 0.0502 3223:20 ----- 4.89, 6.47 A or (resid 10 and name HG2*) (resid 116 and name HB2) ! 0.0387 3223:20 ----- 5.10, 6.86 A assign (resid 116 and name HA) (resid 116 and name HB1) 3.65 1.85 1.85 ! 0.9988 3224:20 Intra 2.38, 2.41 A assign (resid 140 and name HN) (resid 116 and name HB2) 3.65 1.85 1.85 ! 0.9550 3225:20 Long 2.43, 2.92 A assign (resid 140 and name HN) (resid 116 and name HB1) 4.15 2.35 2.35 ! 0.7445 3226:20 Ambig 3.97, 4.50 A or (resid 118 and name HN) (resid 116 and name HB1) ! 0.2060 3226:20 ----- 4.91, 5.47 A assign (resid 141 and name HA) (resid 116 and name HG) 3.65 1.85 1.85 ! 0.9646 3227:20 Long 2.89, 3.31 A assign (resid 142 and name HN) (resid 116 and name HG) 3.65 1.85 1.85 ! 0.8467 3229:20 Ambig 3.56, 3.81 A or (resid 121 and name HN) (resid 123 and name HG) ! 0.0711 3229:20 ----- 5.38, 6.76 A or (resid 81 and name HN) (resid 69 and name HG12) ! 0.0677 3229:20 ----- 5.43, 5.70 A assign (resid 103 and name HZ) (resid 116 and name HD1*) 3.65 1.85 1.85 ! 0.9722 3230:20 Long 2.65, 3.93 A assign (resid 103 and name HD*) (resid 116 and name HD1*) 3.65 1.85 1.85 ! 0.7251 3231:20 Ambig 3.66, 5.56 A or (resid 48 and name HD*) (resid 116 and name HD1*) ! 0.2749 3231:20 ----- 4.30, 6.84 A assign (resid 142 and name HN) (resid 116 and name HD1*) 3.65 1.85 1.85 ! 0.0000 3233:20 Long 4.67, 5.71 A assign (resid 23 and name HB) (resid 116 and name HD1*) 3.65 1.85 1.85 ! 0.0000 3236:20 Long 3.47, 4.60 A assign (resid 41 and name HG2*) (resid 116 and name HD1*) 2.65 0.85 0.85 ! 0.9122 3237:20 Ambig 2.87, 4.83 A or (resid 41 and name HD1*) (resid 116 and name HD1*) ! 0.0878 3237:20 ----- 4.25, 7.17 A assign (resid 116 and name HG) (resid 116 and name HD1*) 2.30 0.50 0.50 ! 0.5272 3238:20 Ambig 2.38, 2.62 A or (resid 116 and name HB2) (resid 116 and name HD1*) ! 0.4549 3238:20 ----- 2.44, 3.06 A assign (resid 34 and name HG1*) (resid 92 and name HG11) 3.15 1.35 1.35 ! 0.8074 3239:20 Ambig 3.95, 4.83 A or (resid 10 and name HG1*) (resid 116 and name HD1*) ! 0.1020 3239:20 ----- 5.58, 7.90 A or (resid 34 and name HG2*) (resid 92 and name HG11) ! 0.0906 3239:20 ----- 5.69, 7.23 A assign (resid 142 and name HG11) (resid 116 and name HD1*) 3.15 1.35 1.35 ! 0.0000 3240:20 Long 2.45, 3.75 A assign (resid 48 and name HD*) (resid 116 and name HD2*) 3.65 1.85 1.85 ! 0.9258 3242:20 Long 3.19, 5.12 A assign (resid 43 and name HE*) (resid 116 and name HD2*) 3.65 1.85 1.85 ! 0.0000 3243:20 Long 5.63, 7.25 A assign (resid 44 and name HN) (resid 116 and name HD2*) 3.15 1.35 1.35 ! 0.9952 3244:20 Long 2.51, 4.12 A assign (resid 98 and name HN) (resid 59 and name HD1*) 3.65 1.85 1.85 ! 0.6990 3245:20 Ambig 3.75, 4.90 A or (resid 27 and name HN) (resid 59 and name HD1*) ! 0.3010 3245:20 ----- 4.31, 5.38 A assign (resid 56 and name HD22) (resid 59 and name HD1*) 3.65 1.85 1.85 ! 0.9390 3246:20 Mid 3.69, 4.77 A assign (resid 140 and name HN) (resid 116 and name HD2*) 3.65 1.85 1.85 ! 0.5504 3247:20 Ambig 5.92, 6.58 A or (resid 141 and name HN) (resid 116 and name HD2*) ! 0.4496 3247:20 ----- 6.13, 7.07 A assign (resid 116 and name HB1) (resid 116 and name HD2*) 2.30 0.50 0.50 ! 0.0000 3248:20 Intra 2.53, 3.15 A assign (resid 78 and name HN) (resid 77 and name HG1) 3.65 1.85 1.85 ! 0.0000 3249:20 Seq 4.31, 4.74 A assign (resid 93 and name HN) (resid 59 and name HD1*) 4.15 2.35 2.35 ! 0.0000 3250:20 Long 5.64, 7.28 A assign (resid 141 and name HG1) (resid 115 and name HA) 3.15 1.35 1.35 ! 0.9910 3251:20 Long 2.13, 2.63 A assign (resid 61 and name HB1) (resid 62 and name HA) 3.65 1.85 1.85 ! 0.5452 3253:20 Ambig 4.28, 4.88 A or (resid 61 and name HB2) (resid 62 and name HA) ! 0.4548 3253:20 ----- 4.41, 5.78 A assign (resid 139 and name HD21) (resid 115 and name HA) 4.15 2.35 2.35 ! 0.0000 3255:20 Long 4.44, 5.50 A assign (resid 64 and name HN) (resid 62 and name HA) 3.65 1.85 1.85 ! 0.0000 3256:20 Mid 2.98, 3.30 A assign (resid 116 and name HD1*) (resid 115 and name HA) 3.65 1.85 1.85 ! 0.0000 3257:20 Seq 5.52, 6.08 A assign (resid 141 and name HG1) (resid 115 and name HB*) 2.65 0.85 0.85 ! 0.9891 3258:20 Long 2.33, 3.91 A assign (resid 139 and name HA) (resid 115 and name HB*) 3.65 1.85 1.85 ! 0.0000 3260:20 Long 3.57, 5.55 A assign (resid 30 and name HB) (resid 94 and name HA) 4.15 2.35 2.35 ! 0.0000 3261:20 Long 5.90, 6.31 A assign (resid 95 and name HB2) (resid 94 and name HA) 4.15 2.35 2.35 ! 0.0000 3262:20 Seq 4.32, 5.56 A assign (resid 95 and name HB1) (resid 94 and name HA) 4.15 2.35 2.35 ! 0.0000 3263:20 Seq 4.24, 4.34 A assign (resid 59 and name HG) (resid 94 and name HB) 4.15 2.35 2.35 ! 0.0000 3268:20 Long 6.14, 6.38 A assign (resid 59 and name HD1*) (resid 94 and name HB) 3.65 1.85 1.85 ! 0.7456 3269:20 Ambig 5.84, 6.79 A or (resid 30 and name HG2*) (resid 94 and name HB) ! 0.2544 3269:20 ----- 6.98, 7.97 A assign (resid 95 and name HB2) (resid 94 and name HB) 4.15 2.35 2.35 ! 0.0000 3271:20 Seq 5.29, 6.01 A assign (resid 95 and name HB1) (resid 94 and name HB) 4.15 2.35 2.35 ! 0.0000 3272:20 Seq 4.57, 5.33 A assign (resid 132 and name HB2) (resid 124 and name HG2*) 3.65 1.85 1.85 ! 0.9970 3273:20 Long 2.20, 3.84 A assign (resid 125 and name HA) (resid 124 and name HG2*) 2.65 0.85 0.85 ! 0.3651 3278:20 Ambig 3.37, 4.56 A or (resid 125 and name HA) (resid 37 and name HG2*) ! 0.3368 3278:20 ----- 3.41, 4.78 A or (resid 70 and name HA) (resid 69 and name HG2*) ! 0.2715 3278:20 ----- 3.54, 4.65 A assign (resid 93 and name HN) (resid 94 and name HG1*) 3.15 1.35 1.35 ! 0.0000 3281:20 Seq 3.21, 4.50 A assign (resid 94 and name HN) (resid 94 and name HG2*) 2.65 0.85 0.85 ! 0.0000 3282:20 Intra 2.10, 3.02 A assign (resid 116 and name HN) (resid 23 and name HG1*) 3.65 1.85 1.85 ! 0.2820 3283:20 Ambig 5.35, 7.22 A or (resid 116 and name HN) (resid 23 and name HG2*) ! 0.2074 3283:20 ----- 5.63, 7.52 A or (resid 12 and name HN) (resid 23 and name HG1*) ! 0.1971 3283:20 ----- 5.68, 7.10 A or (resid 18 and name HN) (resid 144 and name HG1*) ! 0.1761 3283:20 ----- 5.79, 6.63 A or (resid 16 and name HD21) (resid 144 and name HG1*) ! 0.1374 3283:20 ----- 6.03, 7.44 A assign (resid 93 and name HN) (resid 94 and name HG2*) 3.65 1.85 1.85 ! 0.9933 3284:20 Seq 2.59, 3.94 A assign (resid 110 and name HN) (resid 144 and name HG1*) 3.65 1.85 1.85 ! 0.9243 3285:20 Long 4.48, 6.06 A assign (resid 136 and name HA) (resid 137 and name HA) 3.65 1.85 1.85 ! 0.0000 3289:20 Seq 4.25, 4.31 A assign (resid 118 and name HB) (resid 137 and name HA) 4.15 2.35 2.35 ! 0.0000 3290:20 Long 5.97, 6.34 A assign (resid 120 and name HB1) (resid 136 and name HB*) 4.15 2.35 2.35 ! 0.9876 3295:20 Long 2.24, 4.81 A assign (resid 120 and name HG*) (resid 136 and name HB*) 3.65 1.85 1.85 ! 0.0000 3296:20 Long 4.11, 6.66 A assign (resid 113 and name HA) (resid 114 and name HB1) 4.15 2.35 2.35 ! 0.4614 3301:20 Ambig 4.63, 5.48 A or (resid 141 and name HA) (resid 114 and name HB1) ! 0.2744 3301:20 ----- 5.05, 5.84 A or (resid 43 and name HA) (resid 114 and name HB1) ! 0.1265 3301:20 ----- 5.74, 6.43 A or (resid 39 and name HA) (resid 79 and name HB1) ! 0.0532 3301:20 ----- 6.64, 7.01 A or (resid 72 and name HA) (resid 79 and name HB1) ! 0.0473 3301:20 ----- 6.77, 7.11 A assign (resid 71 and name HA) (resid 79 and name HB1) 4.15 2.35 2.35 ! 0.7489 3302:20 Ambig 6.13, 6.45 A or (resid 77 and name HA) (resid 79 and name HB1) ! 0.2511 3302:20 ----- 7.35, 7.86 A assign (resid 141 and name HA) (resid 140 and name HA1) 3.65 1.85 1.85 ! 0.0000 3306:20 Seq 4.23, 4.30 A assign (resid 72 and name HA) (resid 73 and name HB*) 3.65 1.85 1.85 ! 0.0000 3309:20 Seq 4.11, 4.62 A assign (resid 113 and name HB2) (resid 144 and name HG2*) 4.15 2.35 2.35 ! 0.5110 3320:20 Ambig 5.51, 7.60 A or (resid 52 and name HB2) (resid 72 and name HG2*) ! 0.4890 3320:20 ----- 5.55, 6.96 A assign (resid 103 and name HB1) (resid 50 and name HG1*) 4.15 2.35 2.35 ! 0.0000 3322:20 Long 6.46, 7.37 A assign (resid 76 and name HA2) (resid 50 and name HG1*) 3.65 1.85 1.85 ! 0.5851 3323:20 Ambig 5.65, 7.12 A or (resid 49 and name HB) (resid 50 and name HG1*) ! 0.4149 3323:20 ----- 5.98, 6.90 A assign (resid 49 and name HG2*) (resid 50 and name HG1*) 3.15 1.35 1.35 ! 0.8400 3325:20 Ambig 4.32, 6.18 A or (resid 51 and name HG*) (resid 50 and name HG1*) ! 0.1600 3325:20 ----- 5.70, 7.27 A assign (resid 41 and name HB) (resid 50 and name HG1*) 4.15 2.35 2.35 ! 0.0000 3326:20 Long 6.10, 7.57 A assign (resid 51 and name HB*) (resid 50 and name HG1*) 4.15 2.35 2.35 ! 0.0000 3327:20 Seq 5.94, 7.12 A assign (resid 142 and name HN) (resid 141 and name HB2) 3.15 1.35 1.35 ! 0.0000 3329:20 Seq 3.98, 4.14 A assign (resid 12 and name HA) (resid 141 and name HB2) 3.65 1.85 1.85 ! 0.0000 3332:20 Long 3.91, 4.34 A assign (resid 6 and name HN) (resid 134 and name HB2) 3.15 1.35 1.35 ! 0.5516 3335:20 Ambig 3.84, 4.74 A or (resid 136 and name HN) (resid 134 and name HB2) ! 0.4484 3335:20 ----- 3.98, 5.02 A assign (resid 78 and name HB) (resid 80 and name HD1*) 3.15 1.35 1.35 ! 0.9618 3337:20 Mid 3.58, 4.55 A assign (resid 53 and name HB) (resid 80 and name HD1*) 3.65 1.85 1.85 ! 0.0000 3338:20 Long 3.49, 4.34 A assign (resid 72 and name HG2*) (resid 50 and name HG1*) 2.65 0.85 0.85 ! 0.0000 3339:20 Long 2.35, 4.48 A assign (resid 78 and name HG1*) (resid 50 and name HG1*) 2.65 0.85 0.85 ! 0.0000 3340:20 Long 2.10, 4.10 A assign (resid 100 and name HA) (resid 101 and name HD2*) 3.65 1.85 1.85 ! 0.7437 3341:20 Ambig 4.36, 5.33 A or (resid 100 and name HA) (resid 54 and name HD1*) ! 0.1684 3341:20 ----- 5.58, 7.12 A or (resid 56 and name HA) (resid 54 and name HD1*) ! 0.0879 3341:20 ----- 6.22, 7.76 A assign (resid 103 and name HD*) (resid 101 and name HD2*) 3.65 1.85 1.85 ! 0.0000 3342:20 Mid 5.77, 7.58 A assign (resid 99 and name HB*) (resid 101 and name HD2*) 2.65 0.85 0.85 ! 0.0000 3345:20 Mid 3.50, 4.91 A assign (resid 8 and name HB2) (resid 27 and name HA) 3.65 1.85 1.85 ! 0.6937 3348:20 Ambig 4.07, 5.12 A or (resid 8 and name HG) (resid 27 and name HA) ! 0.1985 3348:20 ----- 5.02, 5.57 A or (resid 30 and name HB) (resid 27 and name HA) ! 0.1077 3348:20 ----- 5.56, 5.93 A assign (resid 39 and name HG*) (resid 98 and name HD2*) 3.65 1.85 1.85 ! 0.0000 3349:20 Long 4.54, 6.13 A assign (resid 120 and name HB2) (resid 136 and name HB*) 4.15 2.35 2.35 ! 0.9736 3351:20 Long 3.28, 6.34 A assign (resid 85 and name HB1) (resid 86 and name HG2*) 4.15 2.35 2.35 ! 0.0000 3352:20 Seq 5.15, 7.32 A assign (resid 54 and name HB1) (resid 55 and name HD1) 3.15 1.35 1.35 ! 0.0000 3353:20 Seq 4.02, 4.21 A assign (resid 71 and name HN) (resid 79 and name HB1) 3.15 1.35 1.35 ! 0.5980 3354:20 Ambig 4.29, 4.55 A or (resid 28 and name HN) (resid 9 and name HB2) ! 0.3463 3354:20 ----- 4.70, 5.28 A assign (resid 6 and name HG2*) (resid 30 and name HA) 3.65 1.85 1.85 ! 0.9974 3355:20 Long 1.90, 3.24 A assign (resid 16 and name HA) (resid 144 and name HG1*) 3.15 1.35 1.35 ! 0.0000 3356:20 Long 2.15, 3.57 A assign (resid 16 and name HB2) (resid 17 and name HD1) 3.15 1.35 1.35 ! 0.9598 3357:20 Seq 2.79, 3.67 A assign (resid 13 and name HG1*) (resid 24 and name HD1) 3.15 1.35 1.35 ! 0.0000 3359:20 Long 2.34, 3.47 A assign (resid 92 and name HG12) (resid 92 and name HB) 2.65 0.85 0.85 ! 0.8736 3360:20 Ambig 3.03, 3.03 A or (resid 34 and name HG2*) (resid 92 and name HB) ! 0.0933 3360:20 ----- 4.40, 5.46 A assign (resid 36 and name HD1*) (resid 130 and name HA) 3.65 1.85 1.85 ! 0.9975 3361:20 Long 2.08, 5.21 A assign (resid 79 and name HB1) (resid 78 and name HG2*) 4.15 2.35 2.35 ! 0.0000 3362:20 Seq 5.73, 6.86 A assign (resid 46 and name HN) (resid 44 and name HB1) 3.65 1.85 1.85 ! 0.7274 3365:20 Ambig 3.03, 3.84 A or (resid 45 and name HN) (resid 44 and name HB1) ! 0.2621 3365:20 ----- 3.60, 4.12 A assign (resid 131 and name HG2) (resid 129 and name HB1) 3.15 1.35 1.35 ! 0.0000 3366:20 Mid 2.45, 3.07 A assign (resid 92 and name HG2*) (resid 59 and name HB1) 2.65 0.85 0.85 ! 0.9864 3367:20 Long 1.94, 2.83 A assign (resid 37 and name HN) (resid 36 and name HD1*) 3.65 1.85 1.85 ! 0.0000 3368:20 Seq 3.24, 5.89 A assign (resid 9 and name HN) (resid 8 and name HD1*) 3.65 1.85 1.85 ! 0.0000 3369:20 Seq 2.18, 3.99 A assign (resid 26 and name HN) (resid 8 and name HD1*) 3.65 1.85 1.85 ! 0.9309 3370:20 Long 3.60, 5.43 A assign (resid 36 and name HN) (resid 36 and name HB2) 3.65 1.85 1.85 ! 0.0000 3371:20 Intra 2.49, 2.88 A assign (resid 81 and name HG2*) (resid 83 and name HB) 3.15 1.35 1.35 ! 0.9933 3372:20 Mid 3.00, 4.54 A assign (resid 75 and name HG1) (resid 75 and name HD1) 2.65 0.85 0.85 ! 0.9692 3373:20 Intra 2.26, 2.31 A assign (resid 39 and name HG*) (resid 41 and name HG12) 3.15 1.35 1.35 ! 0.8399 3376:20 Ambig 3.70, 5.07 A or (resid 34 and name HB) (resid 27 and name HG12) ! 0.0691 3376:20 ----- 5.61, 6.36 A or (resid 29 and name HB2) (resid 27 and name HG12) ! 0.0551 3376:20 ----- 5.83, 6.18 A assign (resid 144 and name HG1*) (resid 17 and name HB2) 3.65 1.85 1.85 ! 0.0000 3378:20 Long 5.18, 5.78 A assign (resid 87 and name HD2*) (resid 35 and name HA1) 3.65 1.85 1.85 ! 0.9939 3380:20 Long 1.99, 2.86 A assign (resid 34 and name HG2*) (resid 35 and name HA1) 3.65 1.85 1.85 ! 0.0000 3381:20 Seq 4.31, 5.31 A assign (resid 104 and name HD1*) (resid 51 and name HD2) 2.65 0.85 0.85 ! 0.9915 3383:20 Long 1.98, 3.40 A assign (resid 51 and name HD2) (resid 20 and name HG2*) 3.65 1.85 1.85 ! 0.9498 3384:20 Long 2.44, 4.73 A assign (resid 104 and name HG12) (resid 20 and name HG2*) 3.15 1.35 1.35 ! 0.6375 3385:20 Ambig 2.25, 3.69 A or (resid 51 and name HD1) (resid 20 and name HG2*) ! 0.3554 3385:20 ----- 2.48, 4.20 A assign (resid 51 and name HE*) (resid 20 and name HG2*) 3.15 1.35 1.35 ! 0.9920 3386:20 Long 2.29, 5.00 A assign (resid 51 and name HE*) (resid 51 and name HA) 4.15 2.35 2.35 ! 0.9548 3387:20 Intra 2.68, 4.72 A assign (resid 104 and name HG12) (resid 20 and name HB) 3.65 1.85 1.85 ! 0.0000 3388:20 Long 4.19, 4.89 A assign (resid 20 and name HG2*) (resid 51 and name HE*) 3.65 1.85 1.85 ! 0.0000 3389:20 Long 2.29, 5.00 A assign (resid 67 and name HN) (resid 85 and name HD*) 3.65 1.85 1.85 ! 0.0000 3390:20 Long 3.71, 4.67 A assign (resid 86 and name HG2*) (resid 85 and name HB2) 3.65 1.85 1.85 ! 0.0000 3391:20 Seq 3.64, 5.97 A assign (resid 62 and name HB2) (resid 86 and name HG2*) 3.65 1.85 1.85 ! 0.0000 3393:20 Long 3.03, 6.14 A assign (resid 94 and name HA) (resid 30 and name HG2*) 3.15 1.35 1.35 ! 0.5616 3394:20 Ambig 4.74, 5.96 A or (resid 95 and name HA) (resid 30 and name HG2*) ! 0.4384 3394:20 ----- 4.94, 5.94 A assign (resid 55 and name HA) (resid 60 and name HG2*) 3.65 1.85 1.85 ! 0.8249 3395:20 Ambig 3.50, 4.86 A or (resid 55 and name HA) (resid 60 and name HG1*) ! 0.1489 3395:20 ----- 4.66, 6.12 A assign (resid 93 and name HB2) (resid 30 and name HG2*) 3.65 1.85 1.85 ! 0.7446 3396:20 Ambig 3.94, 5.62 A or (resid 34 and name HA) (resid 30 and name HG2*) ! 0.2554 3396:20 ----- 4.71, 5.41 A assign (resid 6 and name HN) (resid 5 and name HA) 2.30 0.50 0.50 ! 0.9782 3397:20 Seq 2.01, 2.11 A assign (resid 50 and name HG1*) (resid 78 and name HG1*) 3.65 1.85 1.85 ! 0.0000 3399:20 Long 2.10, 4.10 A assign (resid 86 and name HG2*) (resid 89 and name HB1) 3.65 1.85 1.85 ! 0.0000 3400:20 Mid 3.22, 4.69 A assign (resid 63 and name HA) (resid 67 and name HB*) 2.65 0.85 0.85 ! 0.9828 3401:20 Mid 1.93, 3.13 A assign (resid 49 and name HG2*) (resid 104 and name HD1*) 2.65 0.85 0.85 ! 0.5552 3402:20 Ambig 2.50, 4.94 A or (resid 51 and name HG*) (resid 104 and name HD1*) ! 0.4448 3402:20 ----- 2.60, 3.92 A assign (resid 132 and name HN) (resid 131 and name HD*) 3.65 1.85 1.85 ! 0.9420 3403:20 Seq 3.68, 4.36 A assign (resid 7 and name HN) (resid 7 and name HD*) 3.65 1.85 1.85 ! 0.0000 3404:20 Intra 4.11, 4.76 A assign (resid 37 and name HD1*) (resid 82 and name HB2) 3.15 1.35 1.35 ! 0.8993 3405:20 Ambig 2.05, 3.34 A or (resid 37 and name HG2*) (resid 82 and name HB2) ! 0.0664 3405:20 ----- 3.17, 4.34 A assign (resid 134 and name HB1) (resid 8 and name HD2*) 3.15 1.35 1.35 ! 0.4754 3406:20 Ambig 2.29, 4.79 A or (resid 134 and name HD*) (resid 8 and name HD2*) ! 0.3527 3406:20 ----- 2.40, 4.98 A or (resid 27 and name HB) (resid 8 and name HD2*) ! 0.1720 3406:20 ----- 2.71, 4.96 A assign (resid 136 and name HB*) (resid 8 and name HD2*) 2.65 0.85 0.85 ! 0.7182 3407:20 Ambig 2.09, 5.40 A or (resid 8 and name HB1) (resid 8 and name HD2*) ! 0.2818 3407:20 ----- 2.44, 3.78 A assign (resid 6 and name HB) (resid 8 and name HD2*) 4.15 2.35 2.35 ! 0.8957 3408:20 Ambig 3.46, 5.57 A or (resid 7 and name HB*) (resid 8 and name HD2*) ! 0.1043 3408:20 ----- 4.95, 6.85 A assign (resid 8 and name HB2) (resid 8 and name HD2*) 2.30 0.50 0.50 ! 0.5086 3409:20 Ambig 2.36, 3.09 A or (resid 8 and name HG) (resid 8 and name HD2*) ! 0.4642 3409:20 ----- 2.40, 2.63 A assign (resid 116 and name HD1*) (resid 10 and name HB) 3.65 1.85 1.85 ! 0.5771 3410:20 Ambig 5.07, 7.01 A or (resid 101 and name HD1*) (resid 10 and name HB) ! 0.4229 3410:20 ----- 5.34, 6.70 A assign (resid 80 and name HD1*) (resid 99 and name HB*) 2.65 0.85 0.85 ! 0.3246 3411:20 Ambig 3.91, 5.31 A or (resid 98 and name HD2*) (resid 99 and name HB*) ! 0.2988 3411:20 ----- 3.97, 5.61 A or (resid 101 and name HD1*) (resid 10 and name HG1*) ! 0.1498 3411:20 ----- 4.45, 6.48 A or (resid 98 and name HD1*) (resid 99 and name HB*) ! 0.1244 3411:20 ----- 4.59, 6.13 A or (resid 101 and name HD1*) (resid 99 and name HB*) ! 0.0407 3411:20 ----- 5.53, 7.35 A assign (resid 80 and name HG2*) (resid 99 and name HB*) 3.15 1.35 1.35 ! 0.0000 3412:20 Long 4.14, 5.39 A assign (resid 10 and name HG1*) (resid 116 and name HB2) 4.15 2.35 2.35 ! 0.7399 3413:20 Ambig 5.31, 6.74 A or (resid 142 and name HG12) (resid 116 and name HB2) ! 0.2601 3413:20 ----- 6.32, 6.62 A assign (resid 87 and name HB2) (resid 92 and name HG11) 3.65 1.85 1.85 ! 0.8205 3416:20 Ambig 4.36, 5.21 A or (resid 141 and name HB2) (resid 116 and name HD1*) ! 0.0876 3416:20 ----- 6.33, 7.43 A or (resid 33 and name HG2) (resid 92 and name HG11) ! 0.0515 3416:20 ----- 6.92, 7.75 A assign (resid 56 and name HB1) (resid 59 and name HD1*) 3.65 1.85 1.85 ! 0.0000 3417:20 Mid 2.95, 4.41 A assign (resid 141 and name HB2) (resid 116 and name HD2*) 4.15 2.35 2.35 ! 0.0000 3418:20 Long 6.77, 7.64 A assign (resid 25 and name HB) (resid 59 and name HD1*) 4.15 2.35 2.35 ! 0.0000 3419:20 Long 6.64, 7.67 A assign (resid 52 and name HB2) (resid 54 and name HD2*) 3.15 1.35 1.35 ! 0.0000 3421:20 Mid 4.27, 5.51 A assign (resid 32 and name HB) (resid 30 and name HG1*) 4.15 2.35 2.35 ! 0.0000 3422:20 Mid 7.07, 7.72 A assign (resid 100 and name HD*) (resid 22 and name HE2) 3.65 1.85 1.85 ! 0.7720 3424:20 Ambig 4.09, 6.24 A or (resid 100 and name HE*) (resid 22 and name HE2) ! 0.2280 3424:20 ----- 5.01, 7.31 A assign (resid 90 and name HA) (resid 90 and name HD*) 3.15 1.35 1.35 ! 0.0000 3:25 Intra 2.29, 3.60 A assign (resid 86 and name HA) (resid 90 and name HD*) 3.65 1.85 1.85 ! 0.5616 5:25 Ambig 4.42, 6.58 A or (resid 89 and name HA) (resid 90 and name HD*) ! 0.3547 5:25 ----- 4.77, 6.00 A or (resid 62 and name HA) (resid 90 and name HD*) ! 0.0838 5:25 ----- 6.07, 7.43 A assign (resid 90 and name HB2) (resid 90 and name HD*) 2.65 0.85 0.85 ! 0.9674 6:25 Intra 2.25, 3.02 A assign (resid 61 and name HE2) (resid 90 and name HD*) 3.65 1.85 1.85 ! 0.9529 7:25 Long 2.25, 5.78 A assign (resid 90 and name HB1) (resid 90 and name HD*) 2.65 0.85 0.85 ! 0.0000 8:25 Intra 2.37, 3.07 A assign (resid 89 and name HB2) (resid 90 and name HD*) 3.15 1.35 1.35 ! 0.0000 9:25 Seq 2.56, 4.45 A assign (resid 61 and name HB2) (resid 90 and name HD*) 2.65 0.85 0.85 ! 0.6476 10:25 Ambig 2.49, 4.25 A or (resid 61 and name HB1) (resid 90 and name HD*) ! 0.3454 10:25 ----- 2.76, 4.07 A assign (resid 86 and name HG2*) (resid 90 and name HD*) 2.65 0.85 0.85 ! 0.6752 11:25 Ambig 1.95, 5.23 A or (resid 61 and name HG2) (resid 90 and name HD*) ! 0.3248 11:25 ----- 2.21, 5.11 A assign (resid 62 and name HB1) (resid 90 and name HD*) 4.15 2.35 2.35 ! 0.0000 12:25 Long 3.57, 5.85 A assign (resid 66 and name HA) (resid 66 and name HD*) 3.15 1.35 1.35 ! 0.8532 13:25 Ambig 2.23, 3.47 A or (resid 69 and name HA) (resid 66 and name HD*) ! 0.1342 13:25 ----- 3.04, 6.06 A assign (resid 65 and name HA) (resid 66 and name HD*) 4.15 2.35 2.35 ! 0.8102 14:25 Ambig 3.50, 6.18 A or (resid 67 and name HA) (resid 66 and name HD*) ! 0.0972 14:25 ----- 4.98, 6.21 A or (resid 53 and name HA) (resid 68 and name HZ) ! 0.0927 14:25 ----- 5.02, 5.52 A assign (resid 66 and name HB*) (resid 66 and name HD*) 2.65 0.85 0.85 ! 0.0000 15:25 Intra 2.29, 3.05 A assign (resid 53 and name HG2*) (resid 68 and name HZ) 3.15 1.35 1.35 ! 0.3257 16:25 Ambig 2.49, 3.47 A or (resid 70 and name HG2*) (resid 68 and name HZ) ! 0.3217 16:25 ----- 2.49, 3.63 A or (resid 69 and name HD1*) (resid 66 and name HD*) ! 0.1763 16:25 ----- 2.76, 5.32 A or (resid 41 and name HG2*) (resid 43 and name HD*) ! 0.1353 16:25 ----- 2.88, 5.63 A assign (resid 24 and name HA) (resid 100 and name HD*) 2.65 0.85 0.85 ! 0.6441 17:25 Ambig 2.64, 4.37 A or (resid 100 and name HA) (resid 100 and name HD*) ! 0.3559 17:25 ----- 2.92, 3.63 A assign (resid 100 and name HB*) (resid 100 and name HD*) 2.30 0.50 0.50 ! 0.7689 18:25 Ambig 2.35, 3.04 A or (resid 22 and name HE1) (resid 100 and name HD*) ! 0.2311 18:25 ----- 2.87, 5.27 A assign (resid 24 and name HG1) (resid 100 and name HD*) 3.15 1.35 1.35 ! 0.7450 19:25 Ambig 3.16, 6.18 A or (resid 24 and name HB2) (resid 100 and name HD*) ! 0.2550 19:25 ----- 3.77, 5.70 A assign (resid 54 and name HB2) (resid 100 and name HD*) 2.65 0.85 0.85 ! 0.9560 20:25 Long 2.04, 3.93 A assign (resid 22 and name HG1) (resid 100 and name HD*) 3.15 1.35 1.35 ! 0.9756 21:25 Long 2.51, 4.84 A assign (resid 54 and name HD1*) (resid 100 and name HD*) 3.15 1.35 1.35 ! 0.4968 22:25 Ambig 3.72, 5.78 A or (resid 97 and name HG12) (resid 100 and name HD*) ! 0.3857 22:25 ----- 3.88, 5.46 A or (resid 97 and name HD1*) (resid 100 and name HD*) ! 0.0937 22:25 ----- 4.91, 7.52 A assign (resid 97 and name HG2*) (resid 100 and name HD*) 3.65 1.85 1.85 ! 0.0000 23:25 Mid 2.69, 4.54 A assign (resid 103 and name HB1) (resid 103 and name HD*) 3.65 1.85 1.85 ! 0.7391 25:25 Ambig 2.38, 3.03 A or (resid 103 and name HB1) (resid 48 and name HD*) ! 0.2609 25:25 ----- 2.84, 4.36 A assign (resid 53 and name HG2*) (resid 68 and name HE*) 2.65 0.85 0.85 ! 0.7231 26:25 Ambig 2.06, 4.41 A or (resid 60 and name HG1*) (resid 82 and name HE*) ! 0.1354 26:25 ----- 2.73, 5.94 A or (resid 60 and name HG2*) (resid 82 and name HE*) ! 0.0796 26:25 ----- 2.98, 5.08 A assign (resid 101 and name HB*) (resid 103 and name HD*) 3.15 1.35 1.35 ! 0.9046 27:25 Ambig 2.96, 4.88 A or (resid 21 and name HG2*) (resid 103 and name HD*) ! 0.0566 27:25 ----- 4.69, 7.41 A assign (resid 99 and name HB*) (resid 82 and name HZ) 3.65 1.85 1.85 ! 0.9986 30:25 Long 2.09, 2.91 A assign (resid 53 and name HG2*) (resid 82 and name HZ) 2.65 0.85 0.85 ! 0.6980 31:25 Ambig 3.06, 4.17 A or (resid 60 and name HG2*) (resid 82 and name HZ) ! 0.1321 31:25 ----- 4.04, 5.27 A or (resid 60 and name HG1*) (resid 82 and name HZ) ! 0.0536 31:25 ----- 4.69, 6.41 A or (resid 101 and name HD2*) (resid 82 and name HZ) ! 0.0447 31:25 ----- 4.84, 6.21 A assign (resid 78 and name HD1*) (resid 103 and name HZ) 3.15 1.35 1.35 ! 0.4842 32:25 Ambig 2.37, 2.88 A or (resid 116 and name HD1*) (resid 103 and name HZ) ! 0.2458 32:25 ----- 2.65, 3.93 A or (resid 101 and name HD1*) (resid 103 and name HZ) ! 0.2420 32:25 ----- 2.66, 3.97 A assign (resid 66 and name HB*) (resid 66 and name HE*) 3.15 1.35 1.35 ! 0.0000 34:25 Intra 4.60, 5.05 A assign (resid 69 and name HG2*) (resid 66 and name HE*) 3.15 1.35 1.35 ! 0.5421 35:25 Ambig 3.45, 6.10 A or (resid 69 and name HD1*) (resid 66 and name HE*) ! 0.3835 35:25 ----- 3.66, 5.99 A assign (resid 49 and name HA) (resid 43 and name HE*) 3.65 1.85 1.85 ! 0.8214 37:25 Ambig 2.40, 4.98 A or (resid 69 and name HA) (resid 66 and name HE*) ! 0.1230 37:25 ----- 3.29, 5.92 A assign (resid 62 and name HA) (resid 90 and name HE*) 3.65 1.85 1.85 ! 0.4161 38:25 Ambig 5.12, 6.47 A or (resid 86 and name HA) (resid 90 and name HE*) ! 0.3808 38:25 ----- 5.20, 7.31 A or (resid 89 and name HA) (resid 90 and name HE*) ! 0.2031 38:25 ----- 5.77, 6.91 A assign (resid 90 and name HB1) (resid 90 and name HE*) 3.65 1.85 1.85 ! 0.0000 41:25 Intra 4.64, 5.05 A assign (resid 90 and name HB2) (resid 90 and name HE*) 3.65 1.85 1.85 ! 0.8749 42:25 Ambig 4.54, 5.02 A or (resid 91 and name HD*) (resid 90 and name HE*) ! 0.1251 42:25 ----- 6.28, 7.51 A assign (resid 22 and name HE1) (resid 100 and name HE*) 3.15 1.35 1.35 ! 0.7979 43:25 Ambig 3.67, 6.07 A or (resid 100 and name HB*) (resid 100 and name HE*) ! 0.2021 43:25 ----- 4.61, 5.05 A assign (resid 24 and name HB2) (resid 100 and name HE*) 3.15 1.35 1.35 ! 0.5013 44:25 Ambig 3.64, 5.71 A or (resid 56 and name HB1) (resid 100 and name HE*) ! 0.4987 44:25 ----- 3.64, 5.85 A assign (resid 89 and name HB2) (resid 90 and name HE*) 3.15 1.35 1.35 ! 0.0000 45:25 Seq 3.23, 4.99 A assign (resid 22 and name HD1) (resid 100 and name HE*) 3.65 1.85 1.85 ! 0.5731 46:25 Ambig 4.26, 6.19 A or (resid 22 and name HG2) (resid 100 and name HE*) ! 0.4269 46:25 ----- 4.47, 6.11 A assign (resid 61 and name HB1) (resid 90 and name HE*) 3.15 1.35 1.35 ! 0.7840 47:25 Ambig 3.14, 4.48 A or (resid 61 and name HB2) (resid 90 and name HE*) ! 0.2160 47:25 ----- 3.89, 5.26 A assign (resid 86 and name HG2*) (resid 90 and name HE*) 2.30 0.50 0.50 ! 0.9000 48:25 Ambig 2.17, 5.17 A or (resid 61 and name HG2) (resid 90 and name HE*) ! 0.1000 48:25 ----- 3.13, 5.63 A assign (resid 62 and name HB1) (resid 90 and name HE*) 3.65 1.85 1.85 ! 0.0000 49:25 Long 2.65, 5.00 A assign (resid 97 and name HG11) (resid 100 and name HE*) 3.15 1.35 1.35 ! 0.9779 50:25 Mid 2.16, 5.49 A assign (resid 99 and name HB*) (resid 100 and name HE*) 4.15 2.35 2.35 ! 0.0000 51:25 Seq 6.35, 7.90 A assign (resid 97 and name HG12) (resid 100 and name HE*) 2.65 0.85 0.85 ! 0.8977 52:25 Ambig 2.60, 4.31 A or (resid 97 and name HD1*) (resid 100 and name HE*) ! 0.1023 52:25 ----- 3.74, 6.05 A assign (resid 97 and name HG2*) (resid 100 and name HE*) 2.65 0.85 0.85 ! 0.0000 53:25 Mid 2.54, 4.29 A assign (resid 90 and name HN) (resid 90 and name HD*) 3.65 1.85 1.85 ! 0.0000 54:25 Intra 2.64, 3.90 A assign (resid 101 and name HN) (resid 100 and name HD*) 3.65 1.85 1.85 ! 0.9309 55:25 Seq 4.27, 5.31 A assign (resid 100 and name HN) (resid 100 and name HD*) 2.65 0.85 0.85 ! 0.0000 56:25 Intra 2.39, 3.73 A assign (resid 62 and name HN) (resid 90 and name HE*) 3.65 1.85 1.85 ! 0.0000 58:25 Long 4.25, 5.95 A assign (resid 25 and name HN) (resid 100 and name HD*) 3.65 1.85 1.85 ! 0.6271 59:25 Ambig 4.60, 5.62 A or (resid 57 and name HN) (resid 100 and name HD*) ! 0.3296 59:25 ----- 5.12, 7.60 A assign (resid 48 and name HB2) (resid 48 and name HD*) 3.65 1.85 1.85 ! 0.8512 60:25 Ambig 2.25, 3.00 A or (resid 48 and name HB2) (resid 103 and name HD*) ! 0.1463 60:25 ----- 3.02, 4.81 A assign (resid 103 and name HB2) (resid 103 and name HD*) 3.65 1.85 1.85 ! 0.5089 61:25 Ambig 2.30, 3.01 A or (resid 43 and name HB*) (resid 48 and name HD*) ! 0.4465 61:25 ----- 2.36, 5.53 A assign (resid 47 and name HB*) (resid 48 and name HD*) 3.65 1.85 1.85 ! 0.6723 62:25 Ambig 2.72, 4.83 A or (resid 116 and name HD2*) (resid 48 and name HD*) ! 0.2626 62:25 ----- 3.19, 5.12 A assign (resid 116 and name HD2*) (resid 103 and name HZ) 3.65 1.85 1.85 ! 0.4207 63:25 Ambig 3.46, 4.99 A or (resid 47 and name HB*) (resid 48 and name HZ) ! 0.2810 63:25 ----- 3.70, 5.26 A or (resid 116 and name HD2*) (resid 48 and name HZ) ! 0.2680 63:25 ----- 3.73, 5.14 A assign (resid 41 and name HG2*) (resid 103 and name HZ) 3.15 1.35 1.35 ! 0.5738 64:25 Ambig 2.65, 3.98 A or (resid 101 and name HB*) (resid 103 and name HZ) ! 0.2049 64:25 ----- 3.15, 3.92 A or (resid 41 and name HD1*) (resid 103 and name HZ) ! 0.0918 64:25 ----- 3.60, 5.41 A or (resid 101 and name HD2*) (resid 103 and name HZ) ! 0.0603 64:25 ----- 3.86, 5.27 A assign (resid 48 and name HE*) (resid 48 and name HZ) 2.65 0.85 0.85 ! 0.5103 65:25 Ambig 2.44, 2.46 A or (resid 103 and name HE*) (resid 103 and name HZ) ! 0.4897 65:25 ----- 2.45, 2.46 A assign (resid 50 and name HG2*) (resid 103 and name HE*) 3.15 1.35 1.35 ! 0.5104 66:25 Ambig 3.34, 5.00 A or (resid 47 and name HB*) (resid 48 and name HE*) ! 0.4896 66:25 ----- 3.36, 5.08 A assign (resid 101 and name HB*) (resid 103 and name HE*) 3.15 1.35 1.35 ! 0.6942 67:25 Ambig 2.05, 4.01 A or (resid 23 and name HG1*) (resid 103 and name HE*) ! 0.1293 67:25 ----- 2.71, 6.99 A or (resid 23 and name HG2*) (resid 103 and name HE*) ! 0.1255 67:25 ----- 2.72, 5.88 A assign (resid 48 and name HZ) (resid 48 and name HD*) 3.65 1.85 1.85 ! 0.4625 68:25 Ambig 4.25, 4.26 A or (resid 103 and name HZ) (resid 103 and name HD*) ! 0.4602 68:25 ----- 4.25, 4.26 A assign (resid 48 and name HZ) (resid 48 and name HE*) 3.15 1.35 1.35 ! 0.5103 69:25 Ambig 2.44, 2.46 A or (resid 103 and name HZ) (resid 103 and name HE*) ! 0.4897 69:25 ----- 2.45, 2.46 A assign (resid 48 and name HE*) (resid 48 and name HD*) 2.65 0.85 0.85 ! 0.5025 70:25 Ambig 2.44, 3.69 A or (resid 103 and name HE*) (resid 103 and name HD*) ! 0.4887 70:25 ----- 2.45, 3.68 A assign (resid 48 and name HD*) (resid 48 and name HE*) 2.65 0.85 0.85 ! 0.5025 71:25 Ambig 2.44, 3.69 A or (resid 103 and name HD*) (resid 103 and name HE*) ! 0.4887 71:25 ----- 2.45, 3.68 A assign (resid 43 and name HD*) (resid 43 and name HE*) 2.30 0.50 0.50 ! 0.4948 72:25 Ambig 2.44, 3.68 A or (resid 66 and name HD*) (resid 66 and name HE*) ! 0.4917 72:25 ----- 2.44, 3.69 A assign (resid 23 and name HA) (resid 100 and name HD*) 4.15 2.35 2.35 ! 0.0000 73:25 Long 4.66, 7.32 A assign (resid 65 and name HB1) (resid 66 and name HD*) 4.15 2.35 2.35 ! 0.0000 74:25 Seq 4.56, 7.01 A assign (resid 22 and name HG2) (resid 100 and name HD*) 2.65 0.85 0.85 ! 0.7015 75:25 Ambig 2.46, 4.39 A or (resid 22 and name HD1) (resid 100 and name HD*) ! 0.2985 75:25 ----- 2.84, 4.74 A assign (resid 56 and name HA) (resid 100 and name HE*) 3.15 1.35 1.35 ! 0.9930 77:25 Long 2.18, 4.85 A assign (resid 82 and name HE*) (resid 82 and name HD*) 2.65 0.85 0.85 ! 0.0000 78:25 Intra 2.44, 3.69 A assign (resid 68 and name HA) (resid 82 and name HD*) 3.65 1.85 1.85 ! 0.8268 79:25 Ambig 2.06, 4.30 A or (resid 68 and name HA) (resid 68 and name HD*) ! 0.1535 79:25 ----- 2.72, 3.60 A assign (resid 68 and name HB2) (resid 68 and name HD*) 3.15 1.35 1.35 ! 0.9137 80:25 Ambig 2.36, 3.03 A or (resid 68 and name HB2) (resid 82 and name HD*) ! 0.0863 80:25 ----- 3.49, 5.87 A assign (resid 82 and name HZ) (resid 68 and name HD*) 3.65 1.85 1.85 ! 0.8259 81:25 Ambig 3.28, 5.91 A or (resid 82 and name HZ) (resid 82 and name HD*) ! 0.1741 81:25 ----- 4.25, 4.26 A assign (resid 37 and name HG2*) (resid 82 and name HD*) 2.65 0.85 0.85 ! 0.8017 82:25 Ambig 2.07, 5.39 A or (resid 37 and name HD1*) (resid 82 and name HD*) ! 0.1508 82:25 ----- 2.74, 5.39 A assign (resid 68 and name HB1) (resid 68 and name HD*) 3.15 1.35 1.35 ! 0.9881 83:25 Intra 2.32, 3.03 A assign (resid 68 and name HN) (resid 68 and name HD*) 3.65 1.85 1.85 ! 0.5054 84:25 Ambig 4.37, 4.73 A or (resid 68 and name HN) (resid 82 and name HD*) ! 0.4563 84:25 ----- 4.44, 6.76 A assign (resid 82 and name HZ) (resid 82 and name HE*) 2.65 0.85 0.85 ! 0.8731 85:25 Ambig 2.44, 2.46 A or (resid 82 and name HZ) (resid 68 and name HE*) ! 0.1269 85:25 ----- 3.36, 5.69 A assign (resid 82 and name HD*) (resid 82 and name HE*) 3.15 1.35 1.35 ! 0.0000 86:25 Intra 2.44, 3.69 A assign (resid 98 and name HG) (resid 82 and name HE*) 3.65 1.85 1.85 ! 0.9436 87:25 Long 2.49, 4.20 A assign (resid 80 and name HG2*) (resid 82 and name HE*) 3.65 1.85 1.85 ! 0.9731 88:25 Mid 2.42, 4.01 A assign (resid 82 and name HB2) (resid 82 and name HD*) 3.65 1.85 1.85 ! 0.0000 89:25 Intra 2.25, 3.01 A assign (resid 68 and name HD*) (resid 82 and name HZ) 3.65 1.85 1.85 ! 0.8259 90:25 Ambig 3.28, 5.91 A or (resid 82 and name HD*) (resid 82 and name HZ) ! 0.1741 90:25 ----- 4.25, 4.26 A assign (resid 82 and name HE*) (resid 82 and name HZ) 2.65 0.85 0.85 ! 0.8731 91:25 Ambig 2.44, 2.46 A or (resid 68 and name HE*) (resid 82 and name HZ) ! 0.1269 91:25 ----- 3.36, 5.69 A assign (resid 90 and name HE*) (resid 90 and name HD*) 2.30 0.50 0.50 ! 0.0000 92:25 Intra 2.43, 3.68 A assign (resid 24 and name HB1) (resid 100 and name HE*) 3.65 1.85 1.85 ! 0.0000 93:25 Long 2.17, 4.62 A assign (resid 90 and name HD*) (resid 90 and name HE*) 2.30 0.50 0.50 ! 0.0000 94:25 Intra 2.43, 3.68 A assign (resid 100 and name HN) (resid 100 and name HE*) 3.65 1.85 1.85 ! 0.0000 95:25 Intra 4.51, 5.47 A
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