NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | position | program | type | subtype | subsubtype |
636403 | 6j2y | cing | 1-original | 2 | XPLOR/CNS | distance | NOE | ambi |
# Restraints file 2: all.tbl assign (resid 84 and name HA) (resid 85 and name HN) 3.65 1.85 1.85 ! 0.9944 0:10 Seq 2.15, 2.22 A assign (resid 85 and name HA) (resid 85 and name HN) 4.15 2.35 2.35 ! 0.0000 1:10 Intra 2.84, 2.88 A assign (resid 85 and name HB*) (resid 85 and name HN) 2.30 0.50 0.50 ! 0.0000 2:10 Intra 2.40, 2.92 A assign (resid 34 and name HN) (resid 172 and name HN) 4.15 2.35 2.35 ! 0.8948 3:10 Ambig 2.86, 3.16 A or (resid 171 and name HN) (resid 172 and name HN) ! 0.1052 3:10 ----- 4.08, 4.35 A assign (resid 132 and name HD1) (resid 132 and name HE1) 2.30 0.50 0.50 ! 0.0000 4:10 Intra 2.49, 2.56 A assign (resid 97 and name HD1) (resid 97 and name HE1) 2.30 0.50 0.50 ! 0.0000 5:10 Intra 2.54, 2.55 A assign (resid 132 and name HZ2) (resid 132 and name HE1) 2.65 0.85 0.85 ! 0.0000 7:10 Intra 2.77, 2.84 A assign (resid 132 and name HH2) (resid 132 and name HE1) 3.65 1.85 1.85 ! 0.0000 8:10 Intra 4.92, 4.98 A assign (resid 33 and name HA) (resid 172 and name HN) 3.15 1.35 1.35 ! 0.0000 9:10 Long 1.79, 1.89 A assign (resid 151 and name HA) (resid 97 and name HE1) 3.15 1.35 1.35 ! 0.0000 10:10 Long 2.83, 3.61 A assign (resid 132 and name HA) (resid 132 and name HE1) 3.65 1.85 1.85 ! 0.6925 11:10 Ambig 4.82, 4.98 A or (resid 136 and name HA) (resid 132 and name HE1) ! 0.3075 11:10 ----- 5.52, 6.37 A assign (resid 153 and name HA2) (resid 97 and name HE1) 4.15 2.35 2.35 ! 0.4058 12:10 Ambig 4.92, 5.55 A or (resid 97 and name HA) (resid 97 and name HE1) ! 0.3880 12:10 ----- 4.96, 5.11 A or (resid 8 and name HA) (resid 97 and name HE1) ! 0.2062 12:10 ----- 5.51, 6.40 A assign (resid 171 and name HA) (resid 172 and name HN) 2.65 0.85 0.85 ! 0.0000 13:10 Seq 2.10, 2.16 A assign (resid 19 and name HA) (resid 20 and name HN) 2.30 0.50 0.50 ! 0.0000 14:10 Seq 2.01, 2.10 A assign (resid 132 and name HB1) (resid 132 and name HE1) 3.65 1.85 1.85 ! 0.0000 15:10 Intra 5.23, 5.27 A assign (resid 97 and name HB*) (resid 97 and name HE1) 3.65 1.85 1.85 ! 0.8698 16:10 Ambig 4.77, 5.02 A or (resid 98 and name HA) (resid 97 and name HE1) ! 0.1302 16:10 ----- 6.54, 6.80 A assign (resid 25 and name HG*) (resid 132 and name HE1) 3.15 1.35 1.35 ! 0.9949 17:10 Long 1.86, 3.07 A assign (resid 136 and name HE1) (resid 132 and name HE1) 2.30 0.50 0.50 ! 0.9771 18:10 Mid 1.98, 2.39 A assign (resid 8 and name HG12) (resid 97 and name HE1) 4.90 3.10 3.10 ! 0.0000 19:10 Long 4.40, 5.44 A assign (resid 172 and name HB2) (resid 172 and name HN) 3.15 1.35 1.35 ! 0.9825 20:10 Intra 2.36, 2.50 A assign (resid 172 and name HB1) (resid 172 and name HN) 2.65 0.85 0.85 ! 0.0000 21:10 Intra 2.35, 2.54 A assign (resid 19 and name HB1) (resid 20 and name HN) 3.15 1.35 1.35 ! 0.8435 22:10 Ambig 3.15, 3.90 A or (resid 19 and name HB2) (resid 20 and name HN) ! 0.1565 22:10 ----- 4.17, 4.40 A assign (resid 136 and name HB2) (resid 132 and name HE1) 4.15 2.35 2.35 ! 0.5875 23:10 Ambig 3.72, 5.42 A or (resid 30 and name HB) (resid 132 and name HE1) ! 0.1936 23:10 ----- 4.48, 5.11 A or (resid 23 and name HB) (resid 132 and name HE1) ! 0.1305 23:10 ----- 4.79, 5.34 A or (resid 169 and name HG2*) (resid 132 and name HE1) ! 0.0589 23:10 ----- 5.47, 6.99 A assign (resid 171 and name HG1*) (resid 172 and name HN) 3.15 1.35 1.35 ! 0.0000 24:10 Seq 2.94, 3.77 A assign (resid 171 and name HG2*) (resid 172 and name HN) 3.15 1.35 1.35 ! 0.9144 25:10 Ambig 4.48, 5.12 A or (resid 169 and name HG1*) (resid 172 and name HN) ! 0.0856 25:10 ----- 6.65, 7.96 A assign (resid 36 and name HG1*) (resid 20 and name HN) 3.65 1.85 1.85 ! 0.6422 26:10 Ambig 4.34, 6.01 A or (resid 36 and name HG2*) (resid 20 and name HN) ! 0.2082 26:10 ----- 5.24, 6.71 A or (resid 75 and name HG2*) (resid 20 and name HN) ! 0.1496 26:10 ----- 5.54, 6.87 A assign (resid 20 and name HB) (resid 20 and name HN) 2.30 0.50 0.50 ! 0.5582 27:10 Ambig 2.43, 2.57 A or (resid 20 and name HG11) (resid 20 and name HN) ! 0.4418 27:10 ----- 2.53, 2.82 A assign (resid 30 and name HG2*) (resid 132 and name HE1) 3.15 1.35 1.35 ! 0.4563 28:10 Ambig 2.99, 4.66 A or (resid 136 and name HD*) (resid 132 and name HE1) ! 0.3787 28:10 ----- 3.09, 4.62 A or (resid 136 and name HG1) (resid 132 and name HE1) ! 0.1650 28:10 ----- 3.54, 4.48 A assign (resid 30 and name HG1*) (resid 132 and name HE1) 3.15 1.35 1.35 ! 0.7491 29:10 Ambig 4.25, 5.83 A or (resid 33 and name HD1*) (resid 132 and name HE1) ! 0.2509 29:10 ----- 5.10, 6.20 A assign (resid 23 and name HG1*) (resid 132 and name HE1) 3.15 1.35 1.35 ! 0.0000 30:10 Long 2.48, 3.38 A assign (resid 154 and name HD1*) (resid 97 and name HE1) 3.65 1.85 1.85 ! 0.0000 31:10 Long 2.68, 6.48 A assign (resid 154 and name HD2*) (resid 97 and name HE1) 3.15 1.35 1.35 ! 0.0000 32:10 Long 4.22, 5.39 A assign (resid 33 and name HD2*) (resid 172 and name HN) 3.15 1.35 1.35 ! 0.0000 33:10 Long 2.52, 3.98 A assign (resid 20 and name HG12) (resid 20 and name HN) 3.65 1.85 1.85 ! 0.0000 34:10 Intra 3.73, 3.92 A assign (resid 20 and name HD1*) (resid 20 and name HN) 3.15 1.35 1.35 ! 0.9115 35:10 Ambig 2.89, 4.82 A or (resid 20 and name HG2*) (resid 20 and name HN) ! 0.0885 35:10 ----- 4.26, 4.62 A assign (resid 75 and name HN) (resid 74 and name HN) 4.15 2.35 2.35 ! 0.0000 36:10 Seq 2.63, 2.84 A assign (resid 21 and name HN) (resid 37 and name HN) 3.65 1.85 1.85 ! 0.7599 37:10 Ambig 3.41, 3.71 A or (resid 36 and name HN) (resid 37 and name HN) ! 0.2401 37:10 ----- 4.13, 4.18 A assign (resid 11 and name HN) (resid 6 and name HN) 3.65 1.85 1.85 ! 0.7273 38:10 Ambig 3.21, 3.52 A or (resid 10 and name HN) (resid 6 and name HN) ! 0.2727 38:10 ----- 3.78, 4.00 A assign (resid 177 and name HN) (resid 178 and name HN) 3.15 1.35 1.35 ! 0.5004 39:10 Ambig 4.19, 4.27 A or (resid 179 and name HN) (resid 178 and name HN) ! 0.4996 39:10 ----- 4.19, 4.33 A assign (resid 118 and name HN) (resid 115 and name HN) 4.15 2.35 2.35 ! 0.5542 40:10 Ambig 4.39, 4.75 A or (resid 114 and name HN) (resid 115 and name HN) ! 0.4458 40:10 ----- 4.55, 4.61 A assign (resid 175 and name HD*) (resid 6 and name HN) 3.65 1.85 1.85 ! 0.0000 43:10 Long 3.38, 5.64 A assign (resid 5 and name HA) (resid 6 and name HN) 2.65 0.85 0.85 ! 0.0000 44:10 Seq 2.04, 2.13 A assign (resid 24 and name HA) (resid 30 and name HN) 3.65 1.85 1.85 ! 0.0000 45:10 Long 3.22, 3.57 A assign (resid 74 and name HA) (resid 74 and name HN) 3.15 1.35 1.35 ! 0.9410 46:10 Intra 2.70, 2.77 A assign (resid 177 and name HA) (resid 178 and name HN) 2.30 0.50 0.50 ! 0.0000 48:10 Seq 2.10, 2.14 A assign (resid 115 and name HA) (resid 115 and name HN) 3.15 1.35 1.35 ! 0.0000 49:10 Intra 2.73, 2.78 A assign (resid 6 and name HB1) (resid 6 and name HN) 3.15 1.35 1.35 ! 0.0000 50:10 Intra 2.29, 2.37 A assign (resid 74 and name HB2) (resid 74 and name HN) 3.65 1.85 1.85 ! 0.0000 51:10 Intra 3.62, 3.65 A assign (resid 114 and name HA) (resid 115 and name HN) 2.30 0.50 0.50 ! 0.9976 52:10 Seq 2.22, 2.36 A assign (resid 5 and name HE*) (resid 6 and name HN) 4.15 2.35 2.35 ! 0.6807 53:10 Ambig 4.08, 6.42 A or (resid 176 and name HE*) (resid 6 and name HN) ! 0.3193 53:10 ----- 4.63, 6.66 A assign (resid 6 and name HB2) (resid 6 and name HN) 3.15 1.35 1.35 ! 0.0000 54:10 Intra 2.69, 2.79 A assign (resid 74 and name HB1) (resid 74 and name HN) 3.15 1.35 1.35 ! 0.9809 55:10 Intra 2.42, 2.50 A assign (resid 28 and name HG1) (resid 30 and name HN) 3.65 1.85 1.85 ! 0.4216 56:10 Ambig 4.27, 5.02 A or (resid 24 and name HG1) (resid 30 and name HN) ! 0.2749 56:10 ----- 4.58, 5.22 A or (resid 29 and name HG2) (resid 30 and name HN) ! 0.2428 56:10 ----- 4.68, 4.82 A assign (resid 37 and name HB2) (resid 37 and name HN) 2.65 0.85 0.85 ! 0.0000 57:10 Intra 2.42, 2.61 A assign (resid 5 and name HB2) (resid 6 and name HN) 3.65 1.85 1.85 ! 0.0000 58:10 Seq 3.75, 4.08 A assign (resid 29 and name HB*) (resid 30 and name HN) 2.65 0.85 0.85 ! 0.9893 59:10 Seq 2.60, 3.38 A assign (resid 36 and name HB) (resid 37 and name HN) 3.65 1.85 1.85 ! 0.0000 60:10 Seq 4.03, 4.23 A assign (resid 178 and name HB) (resid 178 and name HN) 2.65 0.85 0.85 ! 0.9982 61:10 Intra 2.52, 2.63 A assign (resid 5 and name HD*) (resid 178 and name HN) 3.15 1.35 1.35 ! 0.5976 62:10 Ambig 3.47, 5.72 A or (resid 177 and name HB) (resid 178 and name HN) ! 0.2126 62:10 ----- 4.12, 4.28 A or (resid 176 and name HB*) (resid 178 and name HN) ! 0.1025 62:10 ----- 4.66, 5.41 A or (resid 179 and name HB1) (resid 178 and name HN) ! 0.0584 62:10 ----- 5.12, 6.15 A assign (resid 115 and name HB*) (resid 115 and name HN) 2.30 0.50 0.50 ! 0.0000 63:10 Intra 2.36, 2.87 A assign (resid 13 and name HG1*) (resid 6 and name HN) 3.65 1.85 1.85 ! 0.9551 64:10 Long 2.42, 3.98 A assign (resid 13 and name HG2*) (resid 6 and name HN) 3.15 1.35 1.35 ! 0.9107 65:10 Ambig 3.50, 4.75 A or (resid 7 and name HG2*) (resid 6 and name HN) ! 0.0525 65:10 ----- 5.63, 6.64 A assign (resid 41 and name HG2*) (resid 74 and name HN) 3.15 1.35 1.35 ! 0.7988 66:10 Ambig 2.94, 4.19 A or (resid 75 and name HG2*) (resid 74 and name HN) ! 0.1779 66:10 ----- 3.77, 5.13 A assign (resid 23 and name HB) (resid 30 and name HN) 2.65 0.85 0.85 ! 0.6937 67:10 Ambig 2.19, 2.64 A or (resid 30 and name HB) (resid 30 and name HN) ! 0.3037 67:10 ----- 2.51, 2.60 A assign (resid 19 and name HG*) (resid 37 and name HN) 3.65 1.85 1.85 ! 0.6013 68:10 Ambig 2.92, 5.04 A or (resid 21 and name HG2*) (resid 37 and name HN) ! 0.3386 68:10 ----- 3.21, 4.51 A assign (resid 36 and name HG1*) (resid 37 and name HN) 2.65 0.85 0.85 ! 0.7890 69:10 Ambig 3.00, 3.78 A or (resid 36 and name HG2*) (resid 37 and name HN) ! 0.1162 69:10 ----- 4.13, 4.99 A or (resid 75 and name HG2*) (resid 37 and name HN) ! 0.0948 69:10 ----- 4.27, 5.78 A assign (resid 178 and name HG2*) (resid 178 and name HN) 2.30 0.50 0.50 ! 0.9635 70:10 Intra 2.51, 3.53 A assign (resid 114 and name HG1*) (resid 115 and name HN) 2.65 0.85 0.85 ! 0.9985 71:10 Seq 2.09, 2.95 A assign (resid 119 and name HG11) (resid 115 and name HN) 3.65 1.85 1.85 ! 0.7396 72:10 Ambig 4.17, 5.64 A or (resid 119 and name HD1*) (resid 115 and name HN) ! 0.2604 72:10 ----- 4.96, 5.85 A assign (resid 23 and name HG1*) (resid 30 and name HN) 3.65 1.85 1.85 ! 0.0000 73:10 Long 3.05, 4.27 A assign (resid 30 and name HG2*) (resid 30 and name HN) 3.15 1.35 1.35 ! 0.0000 74:10 Intra 2.31, 3.31 A assign (resid 30 and name HG1*) (resid 30 and name HN) 3.15 1.35 1.35 ! 0.7357 75:10 Ambig 4.33, 4.58 A or (resid 33 and name HD1*) (resid 30 and name HN) ! 0.2643 75:10 ----- 5.13, 6.60 A assign (resid 177 and name HG1*) (resid 178 and name HN) 2.65 0.85 0.85 ! 0.7712 76:10 Ambig 3.05, 4.01 A or (resid 2 and name HG2*) (resid 178 and name HN) ! 0.2288 76:10 ----- 3.73, 5.01 A assign (resid 36 and name HN) (resid 168 and name HN) 3.65 1.85 1.85 ! 0.9219 77:10 Long 2.89, 3.31 A assign (resid 129 and name HN) (resid 130 and name HN) 3.15 1.35 1.35 ! 0.9965 78:10 Seq 2.57, 2.68 A assign (resid 129 and name HD*) (resid 130 and name HN) 3.15 1.35 1.35 ! 0.5891 79:10 Ambig 3.92, 4.54 A or (resid 128 and name HN) (resid 130 and name HN) ! 0.4109 79:10 ----- 4.16, 4.23 A assign (resid 97 and name HZ2) (resid 156 and name HN) 4.15 2.35 2.35 ! 0.0000 80:10 Long 6.17, 6.51 A assign (resid 156 and name HD*) (resid 156 and name HN) 3.15 1.35 1.35 ! 0.9743 81:10 Intra 2.30, 3.58 A assign (resid 131 and name HN) (resid 130 and name HN) 2.65 0.85 0.85 ! 0.0000 83:10 Seq 2.63, 2.78 A assign (resid 97 and name HH2) (resid 154 and name HN) 3.15 1.35 1.35 ! 0.0000 84:10 Long 3.77, 4.23 A assign (resid 35 and name HA) (resid 168 and name HN) 4.15 2.35 2.35 ! 0.0000 85:10 Long 4.96, 5.30 A assign (resid 168 and name HA) (resid 168 and name HN) 3.65 1.85 1.85 ! 0.0000 86:10 Intra 2.86, 2.88 A assign (resid 179 and name HA) (resid 180 and name HN) 4.15 2.35 2.35 ! 0.7777 88:10 Ambig 2.00, 2.12 A or (resid 2 and name HA) (resid 180 and name HN) ! 0.1345 88:10 ----- 2.68, 3.32 A or (resid 180 and name HA) (resid 180 and name HN) ! 0.0878 88:10 ----- 2.88, 2.91 A assign (resid 156 and name HA) (resid 156 and name HN) 3.65 1.85 1.85 ! 0.9706 89:10 Intra 2.90, 2.92 A assign (resid 1 and name HA) (resid 2 and name HN) 2.65 0.85 0.85 ! 0.9987 90:10 Seq 2.04, 2.16 A assign (resid 127 and name HA) (resid 130 and name HN) 3.15 1.35 1.35 ! 0.9265 91:10 Mid 3.43, 3.52 A assign (resid 41 and name HA) (resid 42 and name HN) 3.15 1.35 1.35 ! 0.8078 92:10 Ambig 2.16, 2.32 A or (resid 42 and name HA) (resid 42 and name HN) ! 0.1917 92:10 ----- 2.75, 2.85 A assign (resid 178 and name HA) (resid 179 and name HN) 3.15 1.35 1.35 ! 0.0000 93:10 Seq 2.09, 2.17 A assign (resid 130 and name HA) (resid 130 and name HN) 2.65 0.85 0.85 ! 0.9971 95:10 Intra 2.75, 2.79 A assign (resid 155 and name HA) (resid 156 and name HN) 2.65 0.85 0.85 ! 0.0000 96:10 Seq 2.10, 2.14 A assign (resid 156 and name HB2) (resid 156 and name HN) 4.15 2.35 2.35 ! 0.0000 97:10 Intra 2.38, 2.48 A assign (resid 153 and name HA1) (resid 154 and name HN) 3.65 1.85 1.85 ! 0.8432 98:10 Ambig 3.51, 3.54 A or (resid 155 and name HA) (resid 154 and name HN) ! 0.1372 98:10 ----- 4.75, 4.91 A assign (resid 16 and name HB1) (resid 2 and name HN) 2.65 0.85 0.85 ! 0.8760 99:10 Ambig 1.99, 3.00 A or (resid 1 and name HG2) (resid 2 and name HN) ! 0.0641 99:10 ----- 3.08, 3.76 A assign (resid 168 and name HB1) (resid 168 and name HN) 3.15 1.35 1.35 ! 0.9508 100:10 Intra 3.61, 3.65 A assign (resid 180 and name HB2) (resid 180 and name HN) 3.15 1.35 1.35 ! 0.0000 101:10 Intra 2.33, 2.47 A assign (resid 180 and name HB1) (resid 180 and name HN) 3.15 1.35 1.35 ! 0.8867 102:10 Ambig 3.57, 3.65 A or (resid 179 and name HE*) (resid 180 and name HN) ! 0.1133 102:10 ----- 5.04, 7.01 A assign (resid 159 and name HB2) (resid 160 and name HN) 4.15 2.35 2.35 ! 0.0000 103:10 Seq 4.34, 4.43 A assign (resid 156 and name HB1) (resid 156 and name HN) 3.15 1.35 1.35 ! 0.9813 104:10 Intra 3.59, 3.62 A assign (resid 1 and name HB2) (resid 2 and name HN) 3.15 1.35 1.35 ! 0.9243 105:10 Seq 2.52, 3.96 A assign (resid 36 and name HB) (resid 168 and name HN) 3.65 1.85 1.85 ! 0.0000 106:10 Long 2.03, 2.51 A assign (resid 179 and name HB2) (resid 180 and name HN) 3.15 1.35 1.35 ! 0.9601 107:10 Seq 3.00, 3.89 A assign (resid 161 and name HB*) (resid 160 and name HN) 4.15 2.35 2.35 ! 0.0000 108:10 Seq 6.51, 7.08 A assign (resid 163 and name HB*) (resid 160 and name HN) 2.65 0.85 0.85 ! 0.0000 109:10 Mid 2.46, 3.56 A assign (resid 130 and name HB) (resid 130 and name HN) 2.30 0.50 0.50 ! 0.9725 110:10 Intra 2.58, 2.64 A assign (resid 41 and name HB) (resid 42 and name HN) 3.15 1.35 1.35 ! 0.0000 111:10 Seq 2.17, 2.61 A assign (resid 131 and name HG*) (resid 130 and name HN) 4.15 2.35 2.35 ! 0.0000 112:10 Seq 4.57, 6.66 A assign (resid 169 and name HB) (resid 156 and name HN) 3.65 1.85 1.85 ! 0.9733 113:10 Long 3.44, 3.88 A assign (resid 178 and name HB) (resid 179 and name HN) 3.65 1.85 1.85 ! 0.0000 114:10 Seq 3.88, 4.10 A assign (resid 179 and name HD*) (resid 179 and name HN) 2.65 0.85 0.85 ! 0.8838 115:10 Ambig 1.77, 4.16 A or (resid 179 and name HB2) (resid 179 and name HN) ! 0.1162 115:10 ----- 2.48, 3.15 A assign (resid 2 and name HG11) (resid 2 and name HN) 2.65 0.85 0.85 ! 0.5849 116:10 Ambig 2.24, 3.35 A or (resid 2 and name HB) (resid 2 and name HN) ! 0.4123 116:10 ----- 2.37, 2.53 A assign (resid 2 and name HG12) (resid 2 and name HN) 2.65 0.85 0.85 ! 0.9957 117:10 Intra 2.07, 2.70 A assign (resid 2 and name HD1*) (resid 2 and name HN) 3.15 1.35 1.35 ! 0.0000 118:10 Intra 3.24, 4.34 A assign (resid 36 and name HG1*) (resid 168 and name HN) 3.15 1.35 1.35 ! 0.3968 119:10 Ambig 3.56, 4.58 A or (resid 75 and name HG2*) (resid 168 and name HN) ! 0.2971 119:10 ----- 3.74, 6.23 A or (resid 36 and name HG2*) (resid 168 and name HN) ! 0.2232 119:10 ----- 3.92, 4.81 A or (resid 166 and name HB2) (resid 168 and name HN) ! 0.0829 119:10 ----- 4.62, 5.01 A assign (resid 179 and name HG2) (resid 180 and name HN) 3.15 1.35 1.35 ! 0.5657 120:10 Ambig 4.12, 5.01 A or (resid 179 and name HG1) (resid 180 and name HN) ! 0.4343 120:10 ----- 4.30, 4.92 A assign (resid 3 and name HG1*) (resid 180 and name HN) 3.65 1.85 1.85 ! 0.7533 121:10 Ambig 3.17, 4.68 A or (resid 2 and name HG12) (resid 180 and name HN) ! 0.2397 121:10 ----- 3.84, 5.40 A assign (resid 169 and name HG2*) (resid 160 and name HN) 4.15 2.35 2.35 ! 0.0000 122:10 Long 7.15, 7.80 A assign (resid 128 and name HG2*) (resid 130 and name HN) 4.15 2.35 2.35 ! 0.4657 123:10 Ambig 5.77, 6.52 A or (resid 33 and name HG) (resid 130 and name HN) ! 0.3194 123:10 ----- 6.14, 6.47 A or (resid 133 and name HB1) (resid 130 and name HN) ! 0.2148 123:10 ----- 6.56, 6.85 A assign (resid 102 and name HG2*) (resid 130 and name HN) 4.90 3.10 3.10 ! 0.6689 124:10 Ambig 4.99, 6.35 A or (resid 171 and name HG2*) (resid 130 and name HN) ! 0.3311 124:10 ----- 5.61, 7.10 A assign (resid 130 and name HG21) (resid 130 and name HN) 2.30 0.50 0.50 ! 0.9933 125:10 Ambig 1.91, 2.85 A or (resid 130 and name HG11) (resid 130 and name HN) ! 0.0000 125:10 ----- 0.00, 0.00 A assign (resid 42 and name HB*) (resid 42 and name HN) 2.65 0.85 0.85 ! 0.0000 126:10 Intra 2.38, 2.91 A assign (resid 41 and name HG2*) (resid 42 and name HN) 2.65 0.85 0.85 ! 0.6269 127:10 Ambig 3.39, 4.47 A or (resid 41 and name HG1*) (resid 42 and name HN) ! 0.2875 127:10 ----- 3.86, 4.61 A or (resid 43 and name HG2*) (resid 42 and name HN) ! 0.0856 127:10 ----- 4.72, 6.13 A assign (resid 155 and name HB) (resid 156 and name HN) 3.65 1.85 1.85 ! 0.5053 128:10 Ambig 4.06, 4.16 A or (resid 155 and name HG1*) (resid 156 and name HN) ! 0.4947 128:10 ----- 4.07, 4.62 A assign (resid 179 and name HG2) (resid 179 and name HN) 3.65 1.85 1.85 ! 0.0000 129:10 Intra 2.03, 3.14 A assign (resid 178 and name HG1*) (resid 179 and name HN) 2.65 0.85 0.85 ! 0.9627 130:10 Seq 2.52, 3.47 A assign (resid 154 and name HB1) (resid 154 and name HN) 3.65 1.85 1.85 ! 0.0000 131:10 Intra 2.49, 2.63 A assign (resid 154 and name HG) (resid 154 and name HN) 3.65 1.85 1.85 ! 0.0000 132:10 Intra 4.27, 4.46 A assign (resid 154 and name HB2) (resid 154 and name HN) 3.15 1.35 1.35 ! 0.9794 133:10 Intra 2.30, 2.67 A assign (resid 2 and name HG2*) (resid 2 and name HN) 3.15 1.35 1.35 ! 0.9294 134:10 Intra 4.30, 4.57 A assign (resid 155 and name HG2*) (resid 156 and name HN) 3.15 1.35 1.35 ! 0.9847 135:10 Seq 2.65, 3.47 A assign (resid 154 and name HD1*) (resid 154 and name HN) 3.65 1.85 1.85 ! 0.0000 136:10 Intra 3.01, 5.01 A assign (resid 154 and name HD2*) (resid 154 and name HN) 3.65 1.85 1.85 ! 0.0000 137:10 Intra 4.42, 5.29 A assign (resid 176 and name HN) (resid 5 and name HN) 3.15 1.35 1.35 ! 0.0000 138:10 Long 3.13, 3.39 A assign (resid 5 and name HN) (resid 176 and name HN) 3.15 1.35 1.35 ! 0.9856 139:10 Long 3.13, 3.39 A assign (resid 25 and name HN) (resid 24 and name HN) 3.65 1.85 1.85 ! 0.0000 140:10 Seq 4.05, 4.13 A assign (resid 109 and name HN) (resid 108 and name HN) 3.15 1.35 1.35 ! 0.0000 141:10 Seq 2.40, 2.53 A assign (resid 98 and name HN) (resid 97 and name HN) 3.15 1.35 1.35 ! 0.0000 142:10 Seq 2.59, 2.71 A assign (resid 178 and name HN) (resid 177 and name HN) 3.65 1.85 1.85 ! 0.9588 143:10 Seq 4.19, 4.27 A assign (resid 104 and name HN) (resid 105 and name HN) 2.65 0.85 0.85 ! 0.0000 144:10 Seq 2.57, 2.65 A assign (resid 106 and name HN) (resid 105 and name HN) 2.65 0.85 0.85 ! 0.9342 145:10 Seq 2.63, 2.72 A assign (resid 24 and name HN) (resid 25 and name HN) 3.65 1.85 1.85 ! 0.7301 146:10 Ambig 4.05, 4.13 A or (resid 29 and name HN) (resid 25 and name HN) ! 0.2699 146:10 ----- 4.78, 5.11 A assign (resid 107 and name HN) (resid 105 and name HN) 4.15 2.35 2.35 ! 0.0000 147:10 Mid 3.92, 4.14 A assign (resid 28 and name HN) (resid 25 and name HN) 3.15 1.35 1.35 ! 0.0000 148:10 Mid 3.03, 3.62 A assign (resid 107 and name HN) (resid 108 and name HN) 2.65 0.85 0.85 ! 0.0000 149:10 Seq 2.43, 2.56 A assign (resid 96 and name HN) (resid 97 and name HN) 2.65 0.85 0.85 ! 0.0000 150:10 Seq 2.50, 2.59 A assign (resid 97 and name HE3) (resid 97 and name HN) 3.65 1.85 1.85 ! 0.0000 151:10 Intra 4.54, 4.66 A assign (resid 99 and name HN) (resid 97 and name HN) 3.65 1.85 1.85 ! 0.6718 152:10 Ambig 3.97, 4.17 A or (resid 100 and name HN) (resid 97 and name HN) ! 0.3052 152:10 ----- 4.53, 4.75 A assign (resid 118 and name HN) (resid 119 and name HN) 2.30 0.50 0.50 ! 0.9771 154:10 Seq 2.34, 2.50 A assign (resid 175 and name HD*) (resid 176 and name HN) 3.65 1.85 1.85 ! 0.0000 156:10 Seq 3.77, 4.58 A assign (resid 175 and name HD*) (resid 5 and name HN) 3.65 1.85 1.85 ! 0.0000 157:10 Long 4.02, 5.74 A assign (resid 103 and name HN) (resid 105 and name HN) 3.65 1.85 1.85 ! 0.8730 158:10 Ambig 3.87, 4.09 A or (resid 101 and name HD*) (resid 105 and name HN) ! 0.1270 158:10 ----- 5.33, 5.91 A assign (resid 4 and name HD*) (resid 4 and name HN) 3.15 1.35 1.35 ! 0.0000 159:10 Intra 2.29, 3.81 A assign (resid 14 and name HN) (resid 4 and name HN) 3.65 1.85 1.85 ! 0.0000 160:10 Long 3.03, 3.28 A assign (resid 15 and name HA) (resid 4 and name HN) 3.65 1.85 1.85 ! 0.0000 162:10 Long 2.79, 3.16 A assign (resid 175 and name HA) (resid 176 and name HN) 2.65 0.85 0.85 ! 0.0000 163:10 Seq 2.22, 2.40 A assign (resid 5 and name HA) (resid 5 and name HN) 3.65 1.85 1.85 ! 0.0000 164:10 Intra 2.91, 2.93 A assign (resid 175 and name HA) (resid 5 and name HN) 4.15 2.35 2.35 ! 0.0000 165:10 Long 4.94, 5.34 A assign (resid 24 and name HA) (resid 25 and name HN) 2.65 0.85 0.85 ! 0.0000 166:10 Seq 1.98, 2.06 A assign (resid 24 and name HA) (resid 24 and name HN) 3.65 1.85 1.85 ! 0.0000 167:10 Intra 2.89, 2.92 A assign (resid 34 and name HA) (resid 23 and name HN) 4.15 2.35 2.35 ! 0.9982 168:10 Long 2.19, 2.62 A assign (resid 177 and name HA) (resid 5 and name HN) 4.15 2.35 2.35 ! 0.0000 169:10 Long 3.02, 3.60 A assign (resid 159 and name HA) (resid 167 and name HN) 3.65 1.85 1.85 ! 0.0000 171:10 Long 2.63, 2.85 A assign (resid 108 and name HA) (resid 108 and name HN) 3.15 1.35 1.35 ! 0.0000 172:10 Intra 2.81, 2.84 A assign (resid 107 and name HA) (resid 108 and name HN) 3.15 1.35 1.35 ! 0.9073 173:10 Ambig 3.39, 3.48 A or (resid 111 and name HA*) (resid 108 and name HN) ! 0.0587 173:10 ----- 5.35, 6.36 A assign (resid 64 and name HA*) (resid 65 and name HN) 2.30 0.50 0.50 ! 0.6979 174:10 Ambig 2.12, 2.89 A or (resid 96 and name HB*) (resid 97 and name HN) ! 0.3014 174:10 ----- 2.44, 3.24 A assign (resid 177 and name HA) (resid 177 and name HN) 2.65 0.85 0.85 ! 0.0000 176:10 Intra 2.85, 2.88 A assign (resid 117 and name HA) (resid 119 and name HN) 3.65 1.85 1.85 ! 0.7925 177:10 Ambig 4.03, 4.32 A or (resid 120 and name HA) (resid 119 and name HN) ! 0.1665 177:10 ----- 5.23, 5.33 A assign (resid 102 and name HA) (resid 105 and name HN) 3.15 1.35 1.35 ! 0.9301 178:10 Mid 3.40, 3.59 A assign (resid 105 and name HA) (resid 105 and name HN) 2.65 0.85 0.85 ! 0.9946 179:10 Intra 2.78, 2.80 A assign (resid 23 and name HA) (resid 24 and name HN) 2.30 0.50 0.50 ! 0.0000 180:10 Seq 2.09, 2.15 A assign (resid 23 and name HA) (resid 23 and name HN) 3.15 1.35 1.35 ! 0.0000 181:10 Intra 2.85, 2.87 A assign (resid 105 and name HA) (resid 108 and name HN) 3.15 1.35 1.35 ! 0.0000 182:10 Mid 3.13, 3.25 A assign (resid 97 and name HB*) (resid 97 and name HN) 2.30 0.50 0.50 ! 0.9900 183:10 Intra 2.43, 2.53 A assign (resid 119 and name HA) (resid 119 and name HN) 3.15 1.35 1.35 ! 0.6781 184:10 Ambig 2.78, 2.80 A or (resid 116 and name HA) (resid 119 and name HN) ! 0.3219 184:10 ----- 3.14, 3.34 A assign (resid 175 and name HB*) (resid 176 and name HN) 2.65 0.85 0.85 ! 0.9772 185:10 Seq 2.07, 3.03 A assign (resid 5 and name HE*) (resid 5 and name HN) 3.65 1.85 1.85 ! 0.5512 186:10 Ambig 4.60, 5.63 A or (resid 176 and name HE*) (resid 5 and name HN) ! 0.4488 186:10 ----- 4.76, 6.53 A assign (resid 4 and name HB1) (resid 5 and name HN) 3.15 1.35 1.35 ! 0.9893 187:10 Seq 3.33, 3.46 A assign (resid 104 and name HB2) (resid 105 and name HN) 3.15 1.35 1.35 ! 0.0000 188:10 Seq 2.77, 2.87 A assign (resid 104 and name HB1) (resid 105 and name HN) 3.15 1.35 1.35 ! 0.8991 189:10 Ambig 3.37, 3.59 A or (resid 107 and name HG2) (resid 105 and name HN) ! 0.0923 189:10 ----- 4.93, 6.97 A assign (resid 25 and name HG*) (resid 25 and name HN) 3.65 1.85 1.85 ! 0.8935 190:10 Ambig 2.85, 3.71 A or (resid 24 and name HG2) (resid 25 and name HN) ! 0.1065 190:10 ----- 4.06, 4.44 A assign (resid 28 and name HG2) (resid 25 and name HN) 3.15 1.35 1.35 ! 0.6891 191:10 Ambig 3.91, 4.54 A or (resid 24 and name HG1) (resid 25 and name HN) ! 0.2696 191:10 ----- 4.57, 5.01 A assign (resid 24 and name HG2) (resid 24 and name HN) 3.15 1.35 1.35 ! 0.0000 192:10 Intra 3.86, 4.05 A assign (resid 24 and name HG1) (resid 24 and name HN) 3.15 1.35 1.35 ! 0.0000 193:10 Intra 2.79, 3.04 A assign (resid 22 and name HB2) (resid 23 and name HN) 2.65 0.85 0.85 ! 0.9945 194:10 Seq 2.61, 2.98 A assign (resid 107 and name HG2) (resid 108 and name HN) 3.65 1.85 1.85 ! 0.5404 195:10 Ambig 4.29, 5.22 A or (resid 107 and name HG1) (resid 108 and name HN) ! 0.4596 195:10 ----- 4.41, 5.16 A assign (resid 4 and name HB2) (resid 4 and name HN) 2.65 0.85 0.85 ! 0.9945 196:10 Intra 2.35, 2.41 A assign (resid 118 and name HB1) (resid 119 and name HN) 3.65 1.85 1.85 ! 0.0000 197:10 Seq 3.36, 3.56 A assign (resid 118 and name HB2) (resid 119 and name HN) 3.65 1.85 1.85 ! 0.0000 198:10 Seq 2.46, 2.72 A assign (resid 7 and name HB) (resid 176 and name HN) 4.15 2.35 2.35 ! 0.0000 199:10 Long 5.14, 5.68 A assign (resid 176 and name HB*) (resid 176 and name HN) 2.30 0.50 0.50 ! 0.9443 200:10 Intra 2.38, 3.14 A assign (resid 5 and name HB2) (resid 5 and name HN) 2.30 0.50 0.50 ! 0.0000 201:10 Intra 2.31, 2.47 A assign (resid 7 and name HB) (resid 105 and name HN) 3.65 1.85 1.85 ! 0.5243 202:10 Ambig 4.53, 4.83 A or (resid 106 and name HB*) (resid 105 and name HN) ! 0.4757 202:10 ----- 4.60, 5.31 A assign (resid 105 and name HB) (resid 105 and name HN) 2.30 0.50 0.50 ! 0.0000 203:10 Intra 2.36, 2.43 A assign (resid 25 and name HB*) (resid 25 and name HN) 2.30 0.50 0.50 ! 0.9558 204:10 Intra 2.46, 3.21 A assign (resid 24 and name HB2) (resid 24 and name HN) 2.30 0.50 0.50 ! 0.9906 205:10 Intra 2.47, 2.55 A assign (resid 22 and name HG2) (resid 23 and name HN) 3.15 1.35 1.35 ! 0.7194 206:10 Ambig 4.36, 4.67 A or (resid 172 and name HB2) (resid 23 and name HN) ! 0.1798 206:10 ----- 5.49, 5.97 A or (resid 24 and name HB2) (resid 23 and name HN) ! 0.1009 206:10 ----- 6.05, 6.29 A assign (resid 22 and name HB1) (resid 23 and name HN) 3.15 1.35 1.35 ! 0.9802 207:10 Seq 3.38, 3.70 A assign (resid 107 and name HB2) (resid 108 and name HN) 2.65 0.85 0.85 ! 0.7612 208:10 Ambig 2.77, 3.02 A or (resid 107 and name HB1) (resid 108 and name HN) ! 0.2275 208:10 ----- 3.39, 3.69 A assign (resid 109 and name HB2) (resid 108 and name HN) 3.15 1.35 1.35 ! 0.9129 209:10 Ambig 4.24, 4.40 A or (resid 109 and name HG) (resid 108 and name HN) ! 0.0871 209:10 ----- 6.28, 6.51 A assign (resid 98 and name HB) (resid 97 and name HN) 3.65 1.85 1.85 ! 0.0000 210:10 Seq 4.78, 4.91 A assign (resid 177 and name HB) (resid 177 and name HN) 2.30 0.50 0.50 ! 0.7649 211:10 Ambig 2.50, 2.57 A or (resid 176 and name HB*) (resid 177 and name HN) ! 0.2278 211:10 ----- 3.06, 3.90 A assign (resid 99 and name HG1) (resid 97 and name HN) 4.15 2.35 2.35 ! 0.5852 212:10 Ambig 5.16, 6.39 A or (resid 95 and name HD*) (resid 97 and name HN) ! 0.3121 212:10 ----- 5.73, 6.58 A or (resid 101 and name HB1) (resid 97 and name HN) ! 0.1027 212:10 ----- 6.89, 7.12 A assign (resid 119 and name HB) (resid 119 and name HN) 2.30 0.50 0.50 ! 0.9824 213:10 Intra 2.39, 2.48 A assign (resid 119 and name HG12) (resid 119 and name HN) 2.65 0.85 0.85 ! 0.9782 214:10 Intra 2.23, 2.39 A assign (resid 176 and name HG*) (resid 176 and name HN) 2.65 0.85 0.85 ! 0.9932 215:10 Intra 2.03, 2.90 A assign (resid 7 and name HG2*) (resid 176 and name HN) 2.65 0.85 0.85 ! 0.9537 216:10 Long 2.70, 3.74 A assign (resid 178 and name HG2*) (resid 5 and name HN) 3.15 1.35 1.35 ! 0.9357 217:10 Long 3.43, 4.72 A assign (resid 5 and name HG1) (resid 5 and name HN) 3.65 1.85 1.85 ! 0.9879 218:10 Intra 2.63, 3.22 A assign (resid 102 and name HG2*) (resid 105 and name HN) 3.65 1.85 1.85 ! 0.5012 219:10 Ambig 5.94, 6.51 A or (resid 8 and name HG11) (resid 105 and name HN) ! 0.4988 219:10 ----- 5.95, 6.47 A assign (resid 8 and name HD1*) (resid 105 and name HN) 3.15 1.35 1.35 ! 0.7343 220:10 Ambig 3.65, 4.78 A or (resid 7 and name HG2*) (resid 105 and name HN) ! 0.1809 220:10 ----- 4.61, 6.13 A or (resid 102 and name HG1*) (resid 105 and name HN) ! 0.0847 220:10 ----- 5.23, 5.99 A assign (resid 23 and name HB) (resid 25 and name HN) 3.65 1.85 1.85 ! 0.5016 221:10 Ambig 4.82, 5.19 A or (resid 30 and name HB) (resid 25 and name HN) ! 0.4984 221:10 ----- 4.82, 5.32 A assign (resid 23 and name HB) (resid 24 and name HN) 3.15 1.35 1.35 ! 0.8643 222:10 Ambig 4.07, 4.28 A or (resid 30 and name HB) (resid 24 and name HN) ! 0.1357 222:10 ----- 5.54, 5.86 A assign (resid 23 and name HG2*) (resid 24 and name HN) 3.15 1.35 1.35 ! 0.0000 223:10 Seq 4.36, 5.12 A assign (resid 23 and name HB) (resid 23 and name HN) 2.30 0.50 0.50 ! 0.9455 224:10 Intra 2.50, 2.56 A assign (resid 23 and name HG2*) (resid 23 and name HN) 2.65 0.85 0.85 ! 0.9992 225:10 Intra 2.14, 3.16 A assign (resid 108 and name HB*) (resid 108 and name HN) 2.30 0.50 0.50 ! 0.9947 226:10 Intra 2.47, 2.91 A assign (resid 7 and name HG1*) (resid 108 and name HN) 3.15 1.35 1.35 ! 0.6094 227:10 Ambig 3.49, 4.87 A or (resid 109 and name HD1*) (resid 108 and name HN) ! 0.2105 227:10 ----- 4.17, 5.03 A or (resid 7 and name HG2*) (resid 108 and name HN) ! 0.1801 227:10 ----- 4.28, 5.67 A assign (resid 177 and name HG2*) (resid 4 and name HN) 4.15 2.35 2.35 ! 0.8508 228:10 Ambig 5.57, 7.11 A or (resid 170 and name HB1) (resid 4 and name HN) ! 0.1492 228:10 ----- 7.44, 7.79 A assign (resid 3 and name HG2*) (resid 4 and name HN) 2.65 0.85 0.85 ! 0.9185 229:10 Ambig 2.24, 3.17 A or (resid 3 and name HG1*) (resid 4 and name HN) ! 0.0514 229:10 ----- 3.63, 4.66 A assign (resid 98 and name HG1*) (resid 97 and name HN) 4.15 2.35 2.35 ! 0.0000 230:10 Seq 6.88, 7.16 A assign (resid 176 and name HG*) (resid 177 and name HN) 3.15 1.35 1.35 ! 0.7416 231:10 Ambig 4.29, 4.86 A or (resid 108 and name HB*) (resid 177 and name HN) ! 0.1965 231:10 ----- 5.35, 7.44 A assign (resid 177 and name HG2*) (resid 177 and name HN) 2.65 0.85 0.85 ! 0.0000 232:10 Intra 1.97, 3.05 A assign (resid 119 and name HG2*) (resid 119 and name HN) 3.15 1.35 1.35 ! 0.6219 233:10 Ambig 4.32, 4.57 A or (resid 116 and name HG1*) (resid 119 and name HN) ! 0.3008 233:10 ----- 4.88, 5.70 A assign (resid 119 and name HG11) (resid 119 and name HN) 2.65 0.85 0.85 ! 0.8868 234:10 Ambig 2.38, 3.68 A or (resid 119 and name HD1*) (resid 119 and name HN) ! 0.1132 234:10 ----- 3.36, 4.27 A assign (resid 105 and name HG2*) (resid 105 and name HN) 2.65 0.85 0.85 ! 0.0000 235:10 Intra 2.23, 3.24 A assign (resid 105 and name HG1*) (resid 105 and name HN) 3.15 1.35 1.35 ! 0.0000 236:10 Intra 4.31, 4.53 A assign (resid 30 and name HG1*) (resid 25 and name HN) 4.15 2.35 2.35 ! 0.0000 237:10 Long 6.18, 6.89 A assign (resid 23 and name HG1*) (resid 24 and name HN) 2.65 0.85 0.85 ! 0.0000 239:10 Seq 2.95, 3.84 A assign (resid 30 and name HG1*) (resid 23 and name HN) 3.65 1.85 1.85 ! 0.5604 240:10 Ambig 5.91, 6.73 A or (resid 33 and name HD1*) (resid 23 and name HN) ! 0.4396 240:10 ----- 6.16, 7.04 A assign (resid 23 and name HG1*) (resid 23 and name HN) 3.15 1.35 1.35 ! 0.0000 241:10 Intra 4.35, 4.56 A assign (resid 105 and name HG1*) (resid 108 and name HN) 4.15 2.35 2.35 ! 0.0000 242:10 Mid 4.93, 5.55 A assign (resid 177 and name HG1*) (resid 177 and name HN) 3.15 1.35 1.35 ! 0.9109 243:10 Ambig 4.40, 4.55 A or (resid 2 and name HG2*) (resid 177 and name HN) ! 0.0891 243:10 ----- 6.48, 7.23 A assign (resid 14 and name HG1*) (resid 4 and name HN) 3.65 1.85 1.85 ! 0.0000 245:10 Long 3.06, 4.20 A assign (resid 35 and name HN) (resid 21 and name HN) 3.15 1.35 1.35 ! 0.0000 246:10 Long 3.37, 3.64 A assign (resid 9 and name HN) (resid 8 and name HN) 2.65 0.85 0.85 ! 0.0000 247:10 Seq 2.27, 2.54 A assign (resid 176 and name HN) (resid 7 and name HN) 4.15 2.35 2.35 ! 0.0000 248:10 Long 4.22, 4.46 A assign (resid 74 and name HN) (resid 75 and name HN) 4.15 2.35 2.35 ! 0.0000 249:10 Seq 2.63, 2.84 A assign (resid 34 and name HN) (resid 170 and name HN) 3.65 1.85 1.85 ! 0.0000 250:10 Long 3.44, 3.67 A assign (resid 144 and name HN) (resid 86 and name HN) 3.65 1.85 1.85 ! 0.0000 251:10 Long 4.41, 4.94 A assign (resid 8 and name HN) (resid 7 and name HN) 3.65 1.85 1.85 ! 0.9968 252:10 Seq 2.22, 2.37 A assign (resid 37 and name HN) (resid 38 and name HN) 3.65 1.85 1.85 ! 0.6051 253:10 Ambig 4.45, 4.56 A or (resid 168 and name HN) (resid 38 and name HN) ! 0.3035 253:10 ----- 4.99, 6.10 A or (resid 167 and name HN) (resid 38 and name HN) ! 0.0914 253:10 ----- 6.10, 6.92 A assign (resid 98 and name HN) (resid 99 and name HN) 2.65 0.85 0.85 ! 0.0000 254:10 Seq 2.64, 2.77 A assign (resid 156 and name HN) (resid 169 and name HN) 3.65 1.85 1.85 ! 0.0000 255:10 Long 3.87, 4.22 A assign (resid 158 and name HN) (resid 167 and name HN) 3.15 1.35 1.35 ! 0.5985 256:10 Ambig 2.90, 3.16 A or (resid 160 and name HN) (resid 167 and name HN) ! 0.4015 256:10 ----- 3.10, 3.65 A assign (resid 10 and name HN) (resid 8 and name HN) 2.65 0.85 0.85 ! 0.7384 257:10 Ambig 3.44, 3.68 A or (resid 11 and name HN) (resid 12 and name HN) ! 0.1833 257:10 ----- 4.34, 4.44 A assign (resid 125 and name HN) (resid 126 and name HN) 2.65 0.85 0.85 ! 0.9009 258:10 Ambig 2.38, 2.49 A or (resid 124 and name HN) (resid 126 and name HN) ! 0.0796 258:10 ----- 3.57, 3.74 A assign (resid 151 and name HN) (resid 152 and name HN) 2.30 0.50 0.50 ! 0.0000 259:10 Seq 2.16, 2.32 A assign (resid 101 and name HN) (resid 99 and name HN) 4.15 2.35 2.35 ! 0.0000 260:10 Mid 3.80, 3.99 A assign (resid 156 and name HD*) (resid 169 and name HN) 3.65 1.85 1.85 ! 0.0000 261:10 Long 4.89, 6.11 A assign (resid 20 and name HN) (resid 21 and name HN) 3.65 1.85 1.85 ! 0.9575 262:10 Seq 3.96, 4.25 A assign (resid 76 and name HN) (resid 75 and name HN) 3.15 1.35 1.35 ! 0.8214 263:10 Ambig 2.32, 2.52 A or (resid 73 and name HD22) (resid 75 and name HN) ! 0.1233 263:10 ----- 3.18, 3.41 A assign (resid 28 and name HN) (resid 29 and name HN) 4.15 2.35 2.35 ! 0.0000 264:10 Seq 4.33, 4.46 A assign (resid 94 and name HN) (resid 93 and name HN) 2.65 0.85 0.85 ! 0.9966 265:10 Seq 2.52, 2.70 A assign (resid 128 and name HN) (resid 126 and name HN) 3.15 1.35 1.35 ! 0.5400 266:10 Ambig 3.94, 4.11 A or (resid 122 and name HD*) (resid 126 and name HN) ! 0.3232 266:10 ----- 4.30, 6.33 A or (resid 129 and name HD*) (resid 126 and name HN) ! 0.1368 266:10 ----- 4.96, 5.65 A assign (resid 93 and name HN) (resid 94 and name HN) 2.65 0.85 0.85 ! 0.9949 267:10 Seq 2.52, 2.70 A assign (resid 143 and name HD*) (resid 169 and name HN) 4.90 3.10 3.10 ! 0.7769 268:10 Ambig 5.72, 7.76 A or (resid 132 and name HZ2) (resid 169 and name HN) ! 0.2231 268:10 ----- 7.04, 7.55 A assign (resid 175 and name HD*) (resid 171 and name HN) 3.65 1.85 1.85 ! 0.0000 269:10 Mid 2.20, 4.47 A assign (resid 132 and name HH2) (resid 170 and name HN) 3.15 1.35 1.35 ! 0.0000 270:10 Long 3.45, 3.94 A assign (resid 143 and name HD*) (resid 86 and name HN) 3.65 1.85 1.85 ! 0.0000 271:10 Long 4.35, 5.00 A assign (resid 100 and name HN) (resid 101 and name HN) 2.30 0.50 0.50 ! 0.9283 272:10 Seq 2.45, 2.60 A assign (resid 175 and name HD*) (resid 7 and name HN) 4.15 2.35 2.35 ! 0.9929 274:10 Long 2.39, 4.68 A assign (resid 157 and name HA) (resid 169 and name HN) 3.65 1.85 1.85 ! 0.0000 276:10 Long 2.27, 2.69 A assign (resid 168 and name HA) (resid 169 and name HN) 2.65 0.85 0.85 ! 0.9941 277:10 Seq 2.04, 2.11 A assign (resid 21 and name HA) (resid 21 and name HN) 3.15 1.35 1.35 ! 0.0000 278:10 Intra 2.91, 2.92 A assign (resid 36 and name HA) (resid 21 and name HN) 3.15 1.35 1.35 ! 0.9850 279:10 Long 2.85, 2.98 A assign (resid 2 and name HA) (resid 3 and name HN) 3.15 1.35 1.35 ! 0.7882 281:10 Ambig 2.18, 2.24 A or (resid 179 and name HA) (resid 3 and name HN) ! 0.2010 281:10 ----- 2.74, 3.16 A assign (resid 71 and name HA) (resid 71 and name HN) 3.65 1.85 1.85 ! 0.0000 282:10 Intra 2.88, 2.92 A assign (resid 175 and name HA) (resid 7 and name HN) 4.15 2.35 2.35 ! 0.0000 283:10 Long 3.51, 3.79 A assign (resid 37 and name HA) (resid 38 and name HN) 3.65 1.85 1.85 ! 0.0000 284:10 Seq 2.05, 2.32 A assign (resid 151 and name HA) (resid 152 and name HN) 2.65 0.85 0.85 ! 0.0000 285:10 Seq 3.23, 3.41 A assign (resid 152 and name HA) (resid 152 and name HN) 3.65 1.85 1.85 ! 0.9749 286:10 Intra 2.85, 2.88 A assign (resid 22 and name HA) (resid 21 and name HN) 3.65 1.85 1.85 ! 0.0000 287:10 Seq 4.91, 5.03 A assign (resid 75 and name HA) (resid 75 and name HN) 3.15 1.35 1.35 ! 0.7116 288:10 Ambig 2.84, 2.87 A or (resid 74 and name HA) (resid 75 and name HN) ! 0.2443 288:10 ----- 3.39, 3.45 A assign (resid 8 and name HA) (resid 8 and name HN) 2.65 0.85 0.85 ! 0.0000 289:10 Intra 2.86, 2.88 A assign (resid 115 and name HA) (resid 116 and name HN) 4.15 2.35 2.35 ! 0.0000 292:10 Seq 2.22, 2.29 A assign (resid 85 and name HA) (resid 86 and name HN) 2.65 0.85 0.85 ! 0.0000 293:10 Seq 2.09, 2.16 A assign (resid 101 and name HA) (resid 101 and name HN) 3.15 1.35 1.35 ! 0.0000 295:10 Intra 2.75, 2.78 A assign (resid 161 and name HA) (resid 163 and name HN) 3.65 1.85 1.85 ! 0.5866 296:10 Ambig 2.95, 3.32 A or (resid 162 and name HA2) (resid 163 and name HN) ! 0.3947 296:10 ----- 3.15, 3.38 A assign (resid 7 and name HA) (resid 7 and name HN) 3.15 1.35 1.35 ! 0.9720 298:10 Intra 2.85, 2.89 A assign (resid 93 and name HA) (resid 93 and name HN) 2.65 0.85 0.85 ! 0.9963 299:10 Intra 2.74, 2.79 A assign (resid 92 and name HA1) (resid 93 and name HN) 3.65 1.85 1.85 ! 0.9740 300:10 Seq 2.68, 2.86 A assign (resid 123 and name HA) (resid 126 and name HN) 3.15 1.35 1.35 ! 0.9866 301:10 Mid 2.64, 2.86 A assign (resid 148 and name HA) (resid 152 and name HN) 4.15 2.35 2.35 ! 0.0000 303:10 Mid 5.70, 5.89 A assign (resid 99 and name HA) (resid 99 and name HN) 2.65 0.85 0.85 ! 0.9749 304:10 Intra 2.76, 2.82 A assign (resid 166 and name HA) (resid 167 and name HN) 2.65 0.85 0.85 ! 0.0000 305:10 Seq 2.06, 2.12 A assign (resid 142 and name HB2) (resid 86 and name HN) 4.15 2.35 2.35 ! 0.9800 306:10 Long 3.39, 3.75 A assign (resid 98 and name HA) (resid 101 and name HN) 3.15 1.35 1.35 ! 0.9562 307:10 Mid 3.25, 3.50 A assign (resid 92 and name HA2) (resid 93 and name HN) 3.65 1.85 1.85 ! 0.9262 308:10 Seq 3.38, 3.48 A assign (resid 127 and name HD2) (resid 126 and name HN) 2.65 0.85 0.85 ! 0.8981 309:10 Ambig 2.48, 2.62 A or (resid 127 and name HD1) (resid 126 and name HN) ! 0.0988 309:10 ----- 3.58, 3.70 A assign (resid 149 and name HB2) (resid 152 and name HN) 3.65 1.85 1.85 ! 0.0000 310:10 Mid 2.18, 2.72 A assign (resid 98 and name HA) (resid 99 and name HN) 3.15 1.35 1.35 ! 0.0000 311:10 Seq 3.47, 3.52 A assign (resid 168 and name HB2) (resid 169 and name HN) 3.15 1.35 1.35 ! 0.6448 312:10 Ambig 3.80, 3.98 A or (resid 156 and name HB1) (resid 169 and name HN) ! 0.3552 312:10 ----- 4.19, 4.61 A assign (resid 159 and name HB2) (resid 167 and name HN) 3.65 1.85 1.85 ! 0.7936 313:10 Ambig 5.46, 5.61 A or (resid 168 and name HB1) (resid 167 and name HN) ! 0.2064 313:10 ----- 6.83, 6.95 A assign (resid 171 and name HB) (resid 171 and name HN) 3.15 1.35 1.35 ! 0.0000 314:10 Intra 2.51, 2.55 A assign (resid 12 and name HB2) (resid 12 and name HN) 2.65 0.85 0.85 ! 0.9792 315:10 Intra 2.38, 2.52 A assign (resid 76 and name HA) (resid 75 and name HN) 4.15 2.35 2.35 ! 0.8656 316:10 Ambig 4.93, 5.10 A or (resid 40 and name HG*) (resid 75 and name HN) ! 0.1344 316:10 ----- 6.72, 7.80 A assign (resid 73 and name HB*) (resid 73 and name HN) 3.15 1.35 1.35 ! 0.9980 317:10 Intra 2.33, 2.55 A assign (resid 165 and name HB2) (resid 73 and name HN) 3.65 1.85 1.85 ! 0.0000 318:10 Long 3.28, 4.65 A assign (resid 29 and name HG2) (resid 29 and name HN) 2.30 0.50 0.50 ! 0.9843 320:10 Intra 2.07, 2.27 A assign (resid 142 and name HB1) (resid 86 and name HN) 3.65 1.85 1.85 ! 0.7747 321:10 Ambig 4.39, 4.78 A or (resid 143 and name HB2) (resid 86 and name HN) ! 0.2253 321:10 ----- 5.39, 5.59 A assign (resid 100 and name HB2) (resid 101 and name HN) 2.65 0.85 0.85 ! 0.9978 322:10 Seq 2.41, 2.95 A assign (resid 101 and name HB2) (resid 101 and name HN) 2.30 0.50 0.50 ! 0.0000 323:10 Intra 2.30, 2.45 A assign (resid 94 and name HB1) (resid 93 and name HN) 3.65 1.85 1.85 ! 0.0000 324:10 Seq 4.57, 4.86 A assign (resid 93 and name HG*) (resid 93 and name HN) 2.65 0.85 0.85 ! 0.7764 325:10 Ambig 1.81, 3.54 A or (resid 93 and name HB2) (resid 93 and name HN) ! 0.2236 325:10 ----- 2.23, 2.71 A assign (resid 37 and name HB1) (resid 38 and name HN) 3.15 1.35 1.35 ! 0.9660 326:10 Seq 3.39, 3.78 A assign (resid 126 and name HA) (resid 126 and name HN) 2.65 0.85 0.85 ! 0.0000 327:10 Intra 2.72, 2.75 A assign (resid 125 and name HB1) (resid 126 and name HN) 3.15 1.35 1.35 ! 0.7975 328:10 Ambig 3.70, 3.91 A or (resid 125 and name HG2) (resid 126 and name HN) ! 0.1426 328:10 ----- 4.93, 5.07 A assign (resid 151 and name HB2) (resid 152 and name HN) 3.65 1.85 1.85 ! 0.0000 329:10 Seq 2.59, 3.13 A assign (resid 149 and name HB1) (resid 152 and name HN) 3.15 1.35 1.35 ! 0.9546 330:10 Mid 2.17, 3.04 A assign (resid 94 and name HB1) (resid 94 and name HN) 2.30 0.50 0.50 ! 0.5869 331:10 Ambig 2.32, 2.43 A or (resid 135 and name HB2) (resid 136 and name HN) ! 0.4131 331:10 ----- 2.46, 2.96 A assign (resid 93 and name HB1) (resid 94 and name HN) 2.65 0.85 0.85 ! 0.6811 332:10 Ambig 2.27, 3.42 A or (resid 94 and name HB2) (resid 94 and name HN) ! 0.3139 332:10 ----- 2.58, 2.69 A assign (resid 169 and name HB) (resid 169 and name HN) 3.15 1.35 1.35 ! 0.9959 333:10 Intra 2.26, 2.35 A assign (resid 3 and name HB) (resid 3 and name HN) 2.65 0.85 0.85 ! 0.0000 334:10 Intra 2.94, 3.11 A assign (resid 179 and name HB1) (resid 3 and name HN) 4.15 2.35 2.35 ! 0.8315 335:10 Ambig 3.86, 5.09 A or (resid 5 and name HD*) (resid 3 and name HN) ! 0.1182 335:10 ----- 5.35, 7.07 A assign (resid 12 and name HB1) (resid 12 and name HN) 3.15 1.35 1.35 ! 0.0000 336:10 Intra 3.56, 3.64 A assign (resid 75 and name HB) (resid 75 and name HN) 3.15 1.35 1.35 ! 0.9542 337:10 Intra 2.52, 2.60 A assign (resid 8 and name HB) (resid 8 and name HN) 2.65 0.85 0.85 ! 0.6140 338:10 Ambig 2.64, 2.69 A or (resid 7 and name HB) (resid 8 and name HN) ! 0.3826 338:10 ----- 2.85, 3.04 A assign (resid 5 and name HD*) (resid 12 and name HN) 4.15 2.35 2.35 ! 0.8641 339:10 Ambig 3.53, 5.74 A or (resid 152 and name HB*) (resid 8 and name HN) ! 0.0913 339:10 ----- 5.14, 6.38 A assign (resid 8 and name HG12) (resid 8 and name HN) 2.65 0.85 0.85 ! 0.9923 340:10 Intra 1.97, 2.09 A assign (resid 40 and name HB1) (resid 73 and name HN) 3.65 1.85 1.85 ! 0.5014 341:10 Ambig 4.85, 5.41 A or (resid 78 and name HG2) (resid 73 and name HN) ! 0.2915 341:10 ----- 5.31, 6.78 A or (resid 78 and name HG1) (resid 73 and name HN) ! 0.2070 341:10 ----- 5.62, 6.64 A assign (resid 166 and name HG2) (resid 73 and name HN) 4.15 2.35 2.35 ! 0.7397 342:10 Ambig 4.97, 6.44 A or (resid 40 and name HB2) (resid 73 and name HN) ! 0.2603 342:10 ----- 5.91, 6.58 A assign (resid 28 and name HB2) (resid 29 and name HN) 2.30 0.50 0.50 ! 0.8371 343:10 Ambig 2.22, 2.46 A or (resid 29 and name HG1) (resid 29 and name HN) ! 0.1619 343:10 ----- 2.92, 3.22 A assign (resid 29 and name HB*) (resid 29 and name HN) 2.30 0.50 0.50 ! 0.8634 345:10 Ambig 2.63, 3.22 A or (resid 28 and name HB1) (resid 29 and name HN) ! 0.1317 345:10 ----- 3.60, 3.79 A assign (resid 116 and name HB) (resid 116 and name HN) 3.65 1.85 1.85 ! 0.0000 346:10 Intra 2.55, 2.61 A assign (resid 115 and name HB*) (resid 116 and name HN) 3.65 1.85 1.85 ! 0.9966 347:10 Seq 2.30, 3.45 A assign (resid 86 and name HG1) (resid 86 and name HN) 3.65 1.85 1.85 ! 0.9656 348:10 Intra 3.19, 4.25 A assign (resid 86 and name HB2) (resid 86 and name HN) 3.65 1.85 1.85 ! 0.0000 349:10 Intra 2.43, 2.60 A assign (resid 102 and name HB) (resid 101 and name HN) 3.65 1.85 1.85 ! 0.0000 350:10 Seq 4.78, 5.02 A assign (resid 101 and name HB1) (resid 101 and name HN) 2.30 0.50 0.50 ! 0.9856 351:10 Intra 2.40, 2.54 A assign (resid 163 and name HB*) (resid 163 and name HN) 2.30 0.50 0.50 ! 0.0000 352:10 Intra 2.36, 2.98 A assign (resid 70 and name HB1) (resid 71 and name HN) 3.65 1.85 1.85 ! 0.0000 353:10 Seq 2.11, 3.29 A assign (resid 70 and name HB2) (resid 71 and name HN) 3.65 1.85 1.85 ! 0.7806 354:10 Ambig 3.13, 4.13 A or (resid 72 and name HB*) (resid 71 and name HN) ! 0.1094 354:10 ----- 4.34, 5.73 A or (resid 43 and name HB) (resid 71 and name HN) ! 0.0593 354:10 ----- 4.81, 5.60 A assign (resid 7 and name HB) (resid 7 and name HN) 3.15 1.35 1.35 ! 0.9812 355:10 Intra 2.44, 2.56 A assign (resid 71 and name HD*) (resid 71 and name HN) 3.15 1.35 1.35 ! 0.8435 356:10 Ambig 2.09, 3.85 A or (resid 71 and name HG1) (resid 71 and name HN) ! 0.1565 356:10 ----- 2.76, 3.61 A assign (resid 93 and name HB1) (resid 93 and name HN) 2.65 0.85 0.85 ! 0.0000 357:10 Intra 2.32, 3.05 A assign (resid 95 and name HG2) (resid 93 and name HN) 3.65 1.85 1.85 ! 0.0000 358:10 Mid 4.78, 5.28 A assign (resid 123 and name HB1) (resid 126 and name HN) 3.65 1.85 1.85 ! 0.7644 359:10 Ambig 4.62, 4.79 A or (resid 31 and name HG2) (resid 126 and name HN) ! 0.1188 359:10 ----- 6.30, 6.78 A or (resid 127 and name HB2) (resid 126 and name HN) ! 0.1169 359:10 ----- 6.31, 6.48 A assign (resid 125 and name HB2) (resid 126 and name HN) 3.15 1.35 1.35 ! 0.9433 360:10 Seq 2.69, 2.93 A assign (resid 148 and name HB1) (resid 152 and name HN) 3.65 1.85 1.85 ! 0.5153 361:10 Ambig 4.65, 5.02 A or (resid 8 and name HB) (resid 152 and name HN) ! 0.3168 361:10 ----- 5.05, 5.56 A or (resid 150 and name HB1) (resid 152 and name HN) ! 0.1678 361:10 ----- 5.61, 5.74 A assign (resid 152 and name HB*) (resid 152 and name HN) 2.65 0.85 0.85 ! 0.0000 362:10 Intra 2.66, 3.34 A assign (resid 99 and name HB*) (resid 99 and name HN) 2.30 0.50 0.50 ! 0.6532 363:10 Ambig 2.22, 2.94 A or (resid 98 and name HB) (resid 99 and name HN) ! 0.3409 363:10 ----- 2.48, 2.64 A assign (resid 99 and name HG1) (resid 99 and name HN) 3.15 1.35 1.35 ! 0.5493 364:10 Ambig 2.13, 3.03 A or (resid 99 and name HD*) (resid 99 and name HN) ! 0.4494 364:10 ----- 2.20, 4.07 A assign (resid 169 and name HG2*) (resid 169 and name HN) 3.15 1.35 1.35 ! 0.0000 365:10 Intra 2.61, 3.56 A assign (resid 169 and name HG1*) (resid 169 and name HN) 3.65 1.85 1.85 ! 0.9160 366:10 Ambig 4.10, 4.48 A or (resid 166 and name HB2) (resid 169 and name HN) ! 0.0840 366:10 ----- 6.10, 6.63 A assign (resid 20 and name HG11) (resid 21 and name HN) 3.15 1.35 1.35 ! 0.5158 367:10 Ambig 4.13, 5.07 A or (resid 20 and name HB) (resid 21 and name HN) ! 0.4842 367:10 ----- 4.17, 4.29 A assign (resid 21 and name HG2*) (resid 21 and name HN) 2.65 0.85 0.85 ! 0.9899 368:10 Intra 3.14, 4.05 A assign (resid 36 and name HG1*) (resid 21 and name HN) 3.15 1.35 1.35 ! 0.9060 369:10 Ambig 4.26, 5.52 A or (resid 75 and name HG2*) (resid 21 and name HN) ! 0.0940 369:10 ----- 6.22, 7.79 A assign (resid 166 and name HB2) (resid 167 and name HN) 3.15 1.35 1.35 ! 0.0000 370:10 Seq 3.08, 3.71 A assign (resid 166 and name HB1) (resid 167 and name HN) 3.65 1.85 1.85 ! 0.0000 371:10 Seq 3.41, 3.74 A assign (resid 2 and name HB) (resid 3 and name HN) 3.15 1.35 1.35 ! 0.6933 372:10 Ambig 3.89, 4.15 A or (resid 5 and name HG2) (resid 3 and name HN) ! 0.1610 372:10 ----- 4.96, 6.53 A or (resid 2 and name HG11) (resid 3 and name HN) ! 0.1457 372:10 ----- 5.04, 5.48 A assign (resid 171 and name HG2*) (resid 171 and name HN) 2.65 0.85 0.85 ! 0.0000 373:10 Intra 2.22, 3.24 A assign (resid 171 and name HG1*) (resid 171 and name HN) 3.65 1.85 1.85 ! 0.6246 374:10 Ambig 4.36, 4.56 A or (resid 13 and name HG2*) (resid 171 and name HN) ! 0.3754 374:10 ----- 4.74, 6.22 A assign (resid 3 and name HG1*) (resid 3 and name HN) 2.65 0.85 0.85 ! 0.9594 375:10 Intra 2.31, 3.21 A assign (resid 75 and name HG2*) (resid 75 and name HN) 2.65 0.85 0.85 ! 0.9787 376:10 Intra 1.86, 2.98 A assign (resid 7 and name HG1*) (resid 8 and name HN) 2.65 0.85 0.85 ! 0.4144 377:10 Ambig 4.01, 4.79 A or (resid 7 and name HG2*) (resid 8 and name HN) ! 0.3479 377:10 ----- 4.12, 4.82 A or (resid 8 and name HG2*) (resid 8 and name HN) ! 0.2377 377:10 ----- 4.39, 4.57 A assign (resid 169 and name HG2*) (resid 170 and name HN) 3.15 1.35 1.35 ! 0.5646 378:10 Ambig 4.19, 5.03 A or (resid 33 and name HB1) (resid 170 and name HN) ! 0.3305 378:10 ----- 4.58, 4.90 A or (resid 33 and name HB2) (resid 170 and name HN) ! 0.0536 378:10 ----- 6.20, 6.55 A assign (resid 170 and name HB1) (resid 170 and name HN) 3.15 1.35 1.35 ! 0.6802 379:10 Ambig 3.73, 3.80 A or (resid 33 and name HD2*) (resid 170 and name HN) ! 0.1737 379:10 ----- 4.68, 5.78 A or (resid 23 and name HG2*) (resid 170 and name HN) ! 0.1461 379:10 ----- 4.82, 5.46 A assign (resid 116 and name HG2*) (resid 116 and name HN) 2.65 0.85 0.85 ! 0.9232 380:10 Intra 1.94, 2.94 A assign (resid 85 and name HB*) (resid 86 and name HN) 2.65 0.85 0.85 ! 0.0000 381:10 Seq 2.69, 3.69 A assign (resid 86 and name HB1) (resid 86 and name HN) 3.15 1.35 1.35 ! 0.9590 382:10 Intra 3.64, 3.73 A assign (resid 102 and name HG2*) (resid 101 and name HN) 3.15 1.35 1.35 ! 0.8490 383:10 Ambig 4.29, 5.52 A or (resid 98 and name HG2*) (resid 101 and name HN) ! 0.1510 383:10 ----- 5.72, 6.39 A assign (resid 98 and name HG1*) (resid 101 and name HN) 3.65 1.85 1.85 ! 0.5280 384:10 Ambig 5.22, 5.93 A or (resid 8 and name HG2*) (resid 101 and name HN) ! 0.3698 384:10 ----- 5.54, 6.65 A or (resid 102 and name HG1*) (resid 101 and name HN) ! 0.1022 384:10 ----- 6.86, 7.24 A assign (resid 7 and name HG2*) (resid 7 and name HN) 2.30 0.50 0.50 ! 0.9903 385:10 Intra 1.98, 3.09 A assign (resid 75 and name HG2*) (resid 38 and name HN) 4.15 2.35 2.35 ! 0.0000 386:10 Long 4.93, 6.78 A assign (resid 126 and name HB*) (resid 126 and name HN) 2.30 0.50 0.50 ! 0.9931 387:10 Intra 2.41, 2.95 A assign (resid 8 and name HG2*) (resid 152 and name HN) 3.65 1.85 1.85 ! 0.0000 388:10 Long 4.73, 5.34 A assign (resid 99 and name HG2) (resid 99 and name HN) 3.15 1.35 1.35 ! 0.9907 389:10 Intra 3.30, 3.77 A assign (resid 98 and name HG2*) (resid 99 and name HN) 3.15 1.35 1.35 ! 0.7497 390:10 Ambig 4.08, 4.74 A or (resid 102 and name HG2*) (resid 99 and name HN) ! 0.2503 390:10 ----- 4.90, 6.09 A assign (resid 98 and name HG1*) (resid 99 and name HN) 2.65 0.85 0.85 ! 0.0000 391:10 Seq 3.49, 4.32 A assign (resid 155 and name HG2*) (resid 169 and name HN) 3.15 1.35 1.35 ! 0.9811 392:10 Long 3.39, 4.14 A assign (resid 20 and name HG12) (resid 21 and name HN) 4.15 2.35 2.35 ! 0.0000 393:10 Seq 4.08, 4.56 A assign (resid 20 and name HG2*) (resid 21 and name HN) 2.65 0.85 0.85 ! 0.9857 394:10 Seq 2.67, 3.78 A assign (resid 170 and name HB1) (resid 171 and name HN) 3.65 1.85 1.85 ! 0.9809 395:10 Seq 2.33, 2.59 A assign (resid 2 and name HG2*) (resid 3 and name HN) 2.65 0.85 0.85 ! 0.9327 396:10 Seq 2.52, 3.64 A assign (resid 75 and name HG1*) (resid 75 and name HN) 3.65 1.85 1.85 ! 0.0000 397:10 Intra 4.36, 4.56 A assign (resid 79 and name HN) (resid 80 and name HN) 3.15 1.35 1.35 ! 0.0000 398:10 Seq 2.34, 2.53 A assign (resid 155 and name HN) (resid 143 and name HN) 3.15 1.35 1.35 ! 0.9127 399:10 Ambig 2.85, 3.03 A or (resid 157 and name HN) (resid 143 and name HN) ! 0.0817 399:10 ----- 4.26, 4.69 A assign (resid 72 and name HN) (resid 41 and name HN) 3.15 1.35 1.35 ! 0.9668 400:10 Long 2.70, 2.86 A assign (resid 143 and name HN) (resid 155 and name HN) 4.15 2.35 2.35 ! 0.9506 401:10 Long 2.85, 3.03 A assign (resid 105 and name HN) (resid 104 and name HN) 2.65 0.85 0.85 ! 0.9984 402:10 Seq 2.57, 2.65 A assign (resid 74 and name HN) (resid 39 and name HN) 4.15 2.35 2.35 ! 0.0000 403:10 Long 2.87, 3.20 A assign (resid 147 and name HN) (resid 146 and name HN) 4.15 2.35 2.35 ! 0.0000 404:10 Seq 2.50, 2.77 A assign (resid 16 and name HN) (resid 17 and name HN) 3.15 1.35 1.35 ! 0.9747 405:10 Seq 2.52, 2.65 A assign (resid 109 and name HN) (resid 110 and name HN) 2.65 0.85 0.85 ! 0.0000 406:10 Seq 2.73, 2.86 A assign (resid 72 and name HN) (resid 43 and name HN) 4.15 2.35 2.35 ! 0.0000 407:10 Long 3.57, 4.02 A assign (resid 9 and name HN) (resid 11 and name HN) 4.15 2.35 2.35 ! 0.0000 408:10 Mid 3.70, 3.93 A assign (resid 105 and name HN) (resid 106 and name HN) 2.65 0.85 0.85 ! 0.0000 409:10 Seq 2.63, 2.72 A assign (resid 25 and name HN) (resid 28 and name HN) 3.15 1.35 1.35 ! 0.0000 410:10 Mid 3.03, 3.62 A assign (resid 117 and name HN) (resid 118 and name HN) 3.65 1.85 1.85 ! 0.0000 411:10 Seq 2.39, 2.61 A assign (resid 98 and name HN) (resid 100 and name HN) 3.65 1.85 1.85 ! 0.0000 412:10 Mid 4.06, 4.30 A assign (resid 108 and name HN) (resid 109 and name HN) 2.65 0.85 0.85 ! 0.6778 413:10 Ambig 2.40, 2.53 A or (resid 110 and name HN) (resid 109 and name HN) ! 0.3064 413:10 ----- 2.73, 2.86 A assign (resid 104 and name HD21) (resid 104 and name HN) 3.15 1.35 1.35 ! 0.9901 414:10 Intra 2.13, 2.58 A assign (resid 106 and name HN) (resid 104 and name HN) 3.65 1.85 1.85 ! 0.6096 415:10 Ambig 3.95, 4.16 A or (resid 102 and name HN) (resid 104 and name HN) ! 0.3390 415:10 ----- 4.35, 4.45 A assign (resid 133 and name HN) (resid 135 and name HN) 3.65 1.85 1.85 ! 0.0000 416:10 Mid 3.86, 4.05 A assign (resid 130 and name HN) (resid 129 and name HN) 2.65 0.85 0.85 ! 0.0000 417:10 Seq 2.57, 2.68 A assign (resid 29 and name HN) (resid 28 and name HN) 3.65 1.85 1.85 ! 0.0000 418:10 Seq 4.33, 4.46 A assign (resid 135 and name HN) (resid 136 and name HN) 2.30 0.50 0.50 ! 0.0000 419:10 Seq 2.51, 2.67 A assign (resid 120 and name HN) (resid 118 and name HN) 3.65 1.85 1.85 ! 0.6771 420:10 Ambig 3.88, 4.00 A or (resid 115 and name HN) (resid 118 and name HN) ! 0.3229 420:10 ----- 4.39, 4.75 A assign (resid 101 and name HN) (resid 100 and name HN) 2.65 0.85 0.85 ! 0.0000 421:10 Seq 2.45, 2.60 A assign (resid 102 and name HN) (resid 100 and name HN) 3.65 1.85 1.85 ! 0.5969 422:10 Ambig 4.25, 4.44 A or (resid 97 and name HN) (resid 100 and name HN) ! 0.4031 422:10 ----- 4.53, 4.75 A assign (resid 135 and name HN) (resid 137 and name HN) 4.15 2.35 2.35 ! 0.0000 423:10 Mid 3.78, 3.90 A assign (resid 138 and name HN) (resid 137 and name HN) 3.15 1.35 1.35 ! 0.9064 424:10 Ambig 2.81, 2.96 A or (resid 139 and name HN) (resid 137 and name HN) ! 0.0936 424:10 ----- 4.10, 4.27 A assign (resid 139 and name HN) (resid 140 and name HN) 2.30 0.50 0.50 ! 0.9709 425:10 Seq 2.00, 2.22 A assign (resid 123 and name HN) (resid 122 and name HN) 2.65 0.85 0.85 ! 0.9082 426:10 Ambig 2.42, 2.57 A or (resid 124 and name HN) (resid 122 and name HN) ! 0.0730 426:10 ----- 3.69, 3.82 A assign (resid 17 and name HN) (resid 18 and name HN) 2.65 0.85 0.85 ! 0.9761 427:10 Seq 2.28, 2.43 A assign (resid 118 and name HN) (resid 117 and name HN) 3.65 1.85 1.85 ! 0.0000 428:10 Seq 2.39, 2.61 A assign (resid 154 and name HN) (resid 143 and name HN) 4.90 3.10 3.10 ! 0.0000 429:10 Long 6.58, 6.98 A assign (resid 142 and name HD*) (resid 143 and name HN) 4.15 2.35 2.35 ! 0.9548 430:10 Seq 3.62, 4.88 A assign (resid 99 and name HN) (resid 98 and name HN) 2.65 0.85 0.85 ! 0.9736 431:10 Seq 2.64, 2.77 A assign (resid 119 and name HN) (resid 120 and name HN) 2.30 0.50 0.50 ! 0.0000 432:10 Seq 2.58, 2.72 A assign (resid 136 and name HN) (resid 135 and name HN) 2.65 0.85 0.85 ! 0.9209 433:10 Seq 2.51, 2.67 A assign (resid 18 and name HN) (resid 17 and name HN) 2.65 0.85 0.85 ! 0.0000 434:10 Seq 2.28, 2.43 A assign (resid 107 and name HE22) (resid 106 and name HN) 3.65 1.85 1.85 ! 0.0000 435:10 Seq 4.38, 4.94 A assign (resid 122 and name HD*) (resid 125 and name HN) 3.65 1.85 1.85 ! 0.7466 436:10 Ambig 4.16, 6.11 A or (resid 128 and name HN) (resid 125 and name HN) ! 0.2122 436:10 ----- 5.13, 5.29 A assign (resid 128 and name HN) (resid 129 and name HN) 2.30 0.50 0.50 ! 0.7302 437:10 Ambig 2.46, 2.58 A or (resid 129 and name HD*) (resid 129 and name HN) ! 0.2698 437:10 ----- 2.90, 3.57 A assign (resid 81 and name HD*) (resid 81 and name HN) 2.30 0.50 0.50 ! 0.0000 438:10 Intra 2.36, 3.73 A assign (resid 119 and name HN) (resid 118 and name HN) 2.30 0.50 0.50 ! 0.0000 440:10 Seq 2.34, 2.50 A assign (resid 143 and name HD*) (resid 143 and name HN) 3.15 1.35 1.35 ! 0.0000 441:10 Intra 2.46, 4.22 A assign (resid 103 and name HN) (resid 104 and name HN) 2.30 0.50 0.50 ! 0.8536 443:10 Ambig 2.67, 2.83 A or (resid 104 and name HD22) (resid 104 and name HN) ! 0.1119 443:10 ----- 3.74, 3.90 A assign (resid 74 and name HD22) (resid 39 and name HN) 3.65 1.85 1.85 ! 0.0000 444:10 Long 2.80, 3.08 A assign (resid 137 and name HD*) (resid 137 and name HN) 3.15 1.35 1.35 ! 0.0000 446:10 Intra 4.16, 4.71 A assign (resid 157 and name HA) (resid 158 and name HN) 2.30 0.50 0.50 ! 0.0000 447:10 Seq 2.25, 2.33 A assign (resid 154 and name HA) (resid 143 and name HN) 3.65 1.85 1.85 ! 0.9527 448:10 Long 3.99, 4.52 A assign (resid 40 and name HA) (resid 41 and name HN) 2.65 0.85 0.85 ! 0.0000 449:10 Seq 2.01, 2.08 A assign (resid 168 and name HA) (resid 158 and name HN) 3.65 1.85 1.85 ! 0.8055 450:10 Ambig 3.54, 3.79 A or (resid 140 and name HA) (resid 158 and name HN) ! 0.1674 450:10 ----- 4.60, 4.76 A assign (resid 158 and name HA) (resid 158 and name HN) 3.65 1.85 1.85 ! 0.0000 451:10 Intra 2.84, 2.89 A assign (resid 71 and name HA) (resid 43 and name HN) 3.15 1.35 1.35 ! 0.0000 453:10 Long 2.50, 3.03 A assign (resid 24 and name HA) (resid 28 and name HN) 4.15 2.35 2.35 ! 0.0000 454:10 Mid 3.96, 4.57 A assign (resid 140 and name HA) (resid 140 and name HN) 3.15 1.35 1.35 ! 0.9930 455:10 Intra 2.87, 2.88 A assign (resid 117 and name HA) (resid 117 and name HN) 3.65 1.85 1.85 ! 0.9966 457:10 Intra 2.77, 2.82 A assign (resid 109 and name HA) (resid 109 and name HN) 2.65 0.85 0.85 ! 0.9335 458:10 Intra 2.77, 2.79 A assign (resid 103 and name HA) (resid 104 and name HN) 3.65 1.85 1.85 ! 0.0000 461:10 Seq 3.53, 3.56 A assign (resid 146 and name HA) (resid 146 and name HN) 3.15 1.35 1.35 ! 0.4864 462:10 Ambig 2.74, 2.78 A or (resid 135 and name HA) (resid 135 and name HN) ! 0.4372 462:10 ----- 2.79, 2.83 A assign (resid 132 and name HA) (resid 135 and name HN) 3.65 1.85 1.85 ! 0.9763 463:10 Mid 2.78, 3.19 A assign (resid 120 and name HA) (resid 120 and name HN) 2.30 0.50 0.50 ! 0.6311 464:10 Ambig 2.79, 2.81 A or (resid 117 and name HA) (resid 120 and name HN) ! 0.3666 464:10 ----- 3.05, 3.37 A assign (resid 38 and name HB*) (resid 39 and name HN) 3.15 1.35 1.35 ! 0.9759 466:10 Seq 2.74, 3.52 A assign (resid 50 and name HA) (resid 50 and name HN) 3.15 1.35 1.35 ! 0.8160 468:10 Ambig 2.19, 2.70 A or (resid 17 and name HA) (resid 17 and name HN) ! 0.1686 468:10 ----- 2.85, 2.87 A assign (resid 110 and name HA) (resid 110 and name HN) 2.30 0.50 0.50 ! 0.6105 469:10 Ambig 2.86, 2.88 A or (resid 107 and name HA) (resid 110 and name HN) ! 0.3246 469:10 ----- 3.18, 3.45 A assign (resid 42 and name HA) (resid 43 and name HN) 2.65 0.85 0.85 ! 0.9968 470:10 Seq 2.02, 2.11 A assign (resid 43 and name HA) (resid 43 and name HN) 3.15 1.35 1.35 ! 0.7255 471:10 Ambig 2.81, 2.89 A or (resid 69 and name HB) (resid 43 and name HN) ! 0.2745 471:10 ----- 3.31, 5.95 A assign (resid 47 and name HA) (resid 48 and name HN) 3.15 1.35 1.35 ! 0.9911 472:10 Seq 2.03, 2.86 A assign (resid 125 and name HA) (resid 125 and name HN) 2.65 0.85 0.85 ! 0.9243 473:10 Intra 2.79, 2.83 A assign (resid 10 and name HA*) (resid 11 and name HN) 3.65 1.85 1.85 ! 0.9468 474:10 Seq 3.03, 3.27 A assign (resid 79 and name HA) (resid 81 and name HN) 4.15 2.35 2.35 ! 0.7448 476:10 Ambig 5.50, 5.89 A or (resid 145 and name HA) (resid 81 and name HN) ! 0.2552 476:10 ----- 6.57, 7.25 A assign (resid 80 and name HA) (resid 81 and name HN) 3.65 1.85 1.85 ! 0.6830 477:10 Ambig 3.55, 3.58 A or (resid 78 and name HA) (resid 81 and name HN) ! 0.1956 477:10 ----- 4.38, 4.72 A or (resid 75 and name HA) (resid 81 and name HN) ! 0.0855 477:10 ----- 5.02, 6.25 A assign (resid 128 and name HA) (resid 129 and name HN) 3.15 1.35 1.35 ! 0.7026 478:10 Ambig 3.53, 3.56 A or (resid 127 and name HA) (resid 129 and name HN) ! 0.2801 478:10 ----- 4.12, 4.23 A assign (resid 78 and name HA) (resid 82 and name HN) 3.15 1.35 1.35 ! 0.8830 479:10 Ambig 2.68, 3.15 A or (resid 77 and name HA1) (resid 82 and name HN) ! 0.0865 479:10 ----- 3.95, 4.36 A assign (resid 80 and name HA) (resid 80 and name HN) 3.15 1.35 1.35 ! 0.7405 481:10 Ambig 2.88, 2.92 A or (resid 78 and name HA) (resid 80 and name HN) ! 0.2342 481:10 ----- 3.49, 3.86 A assign (resid 27 and name HA1) (resid 28 and name HN) 3.15 1.35 1.35 ! 0.0000 483:10 Seq 2.80, 3.10 A assign (resid 135 and name HA) (resid 136 and name HN) 3.65 1.85 1.85 ! 0.9735 484:10 Seq 3.33, 3.48 A assign (resid 136 and name HA) (resid 136 and name HN) 2.30 0.50 0.50 ! 0.4607 485:10 Ambig 2.86, 2.91 A or (resid 113 and name HA1) (resid 114 and name HN) ! 0.1965 485:10 ----- 3.29, 3.44 A or (resid 112 and name HB*) (resid 114 and name HN) ! 0.1745 485:10 ----- 3.36, 4.28 A or (resid 132 and name HA) (resid 136 and name HN) ! 0.1049 485:10 ----- 3.66, 4.09 A assign (resid 100 and name HA) (resid 100 and name HN) 3.15 1.35 1.35 ! 0.0000 486:10 Intra 2.80, 2.83 A assign (resid 97 and name HA) (resid 100 and name HN) 3.65 1.85 1.85 ! 0.7553 487:10 Ambig 3.23, 3.44 A or (resid 96 and name HA) (resid 100 and name HN) ! 0.2447 487:10 ----- 3.90, 4.20 A assign (resid 99 and name HA) (resid 100 and name HN) 3.15 1.35 1.35 ! 0.8458 488:10 Ambig 3.53, 3.55 A or (resid 96 and name HB*) (resid 100 and name HN) ! 0.1367 488:10 ----- 4.78, 5.45 A assign (resid 118 and name HA) (resid 118 and name HN) 3.65 1.85 1.85 ! 0.0000 489:10 Intra 2.80, 2.84 A assign (resid 136 and name HA) (resid 137 and name HN) 2.65 0.85 0.85 ! 0.0000 490:10 Seq 3.17, 3.28 A assign (resid 138 and name HA) (resid 140 and name HN) 3.65 1.85 1.85 ! 0.8202 491:10 Ambig 3.46, 3.82 A or (resid 136 and name HA) (resid 140 and name HN) ! 0.0971 491:10 ----- 4.93, 5.30 A or (resid 141 and name HA) (resid 140 and name HN) ! 0.0828 491:10 ----- 5.07, 5.36 A assign (resid 120 and name HA) (resid 122 and name HN) 3.15 1.35 1.35 ! 0.7053 492:10 Ambig 4.20, 4.37 A or (resid 123 and name HA) (resid 122 and name HN) ! 0.2223 492:10 ----- 5.09, 5.20 A assign (resid 157 and name HB1) (resid 143 and name HN) 4.15 2.35 2.35 ! 0.0000 493:10 Long 4.66, 5.88 A assign (resid 105 and name HA) (resid 109 and name HN) 3.65 1.85 1.85 ! 0.0000 494:10 Mid 3.98, 4.19 A assign (resid 155 and name HA) (resid 155 and name HN) 3.65 1.85 1.85 ! 0.0000 495:10 Intra 2.86, 2.88 A assign (resid 97 and name HB*) (resid 98 and name HN) 2.30 0.50 0.50 ! 0.7097 496:10 Ambig 2.39, 3.20 A or (resid 98 and name HA) (resid 98 and name HN) ! 0.2903 496:10 ----- 2.77, 2.79 A assign (resid 157 and name HB1) (resid 158 and name HN) 3.15 1.35 1.35 ! 0.0000 497:10 Seq 2.55, 3.09 A assign (resid 119 and name HA) (resid 120 and name HN) 3.15 1.35 1.35 ! 0.7019 498:10 Ambig 3.47, 3.51 A or (resid 116 and name HA) (resid 120 and name HN) ! 0.2981 498:10 ----- 4.00, 4.27 A assign (resid 145 and name HB*) (resid 146 and name HN) 2.65 0.85 0.85 ! 0.9072 499:10 Ambig 2.23, 3.05 A or (resid 134 and name HA) (resid 135 and name HN) ! 0.0630 499:10 ----- 3.48, 3.52 A assign (resid 106 and name HA) (resid 106 and name HN) 2.65 0.85 0.85 ! 0.9925 500:10 Intra 2.77, 2.81 A assign (resid 127 and name HD2) (resid 125 and name HN) 3.65 1.85 1.85 ! 0.0000 501:10 Mid 3.81, 3.96 A assign (resid 106 and name HD*) (resid 106 and name HN) 3.15 1.35 1.35 ! 0.9681 502:10 Intra 3.68, 4.70 A assign (resid 6 and name HB1) (resid 11 and name HN) 3.15 1.35 1.35 ! 0.0000 503:10 Long 2.52, 2.93 A assign (resid 82 and name HA) (resid 81 and name HN) 4.15 2.35 2.35 ! 0.7762 504:10 Ambig 4.30, 4.46 A or (resid 145 and name HB*) (resid 81 and name HN) ! 0.2238 504:10 ----- 5.29, 6.82 A assign (resid 129 and name HB2) (resid 129 and name HN) 2.65 0.85 0.85 ! 0.9916 505:10 Intra 2.66, 2.75 A assign (resid 80 and name HB*) (resid 81 and name HN) 2.30 0.50 0.50 ! 0.0000 506:10 Seq 1.83, 2.58 A assign (resid 129 and name HB1) (resid 129 and name HN) 3.15 1.35 1.35 ! 0.0000 507:10 Intra 3.65, 3.67 A assign (resid 82 and name HA) (resid 82 and name HN) 2.30 0.50 0.50 ! 0.9898 508:10 Intra 2.19, 2.22 A assign (resid 80 and name HB*) (resid 82 and name HN) 3.15 1.35 1.35 ! 0.9683 509:10 Mid 3.59, 4.76 A assign (resid 79 and name HB2) (resid 80 and name HN) 3.15 1.35 1.35 ! 0.9291 510:10 Seq 2.84, 3.66 A assign (resid 80 and name HB*) (resid 80 and name HN) 2.65 0.85 0.85 ! 0.0000 511:10 Intra 2.50, 3.19 A assign (resid 27 and name HA2) (resid 28 and name HN) 3.15 1.35 1.35 ! 0.0000 512:10 Seq 3.21, 3.40 A assign (resid 114 and name HA) (resid 114 and name HN) 2.30 0.50 0.50 ! 0.5001 513:10 Ambig 2.80, 2.88 A or (resid 113 and name HA2) (resid 114 and name HN) ! 0.4999 513:10 ----- 2.80, 2.96 A assign (resid 137 and name HB1) (resid 136 and name HN) 3.65 1.85 1.85 ! 0.7988 514:10 Ambig 4.50, 4.83 A or (resid 132 and name HB2) (resid 136 and name HN) ! 0.2012 514:10 ----- 5.66, 6.16 A assign (resid 98 and name HA) (resid 100 and name HN) 4.15 2.35 2.35 ! 0.7750 515:10 Ambig 4.41, 4.61 A or (resid 97 and name HB*) (resid 100 and name HN) ! 0.2250 515:10 ----- 5.42, 5.67 A assign (resid 137 and name HA) (resid 137 and name HN) 2.30 0.50 0.50 ! 0.6900 516:10 Ambig 2.68, 2.74 A or (resid 134 and name HA) (resid 137 and name HN) ! 0.2555 516:10 ----- 3.16, 3.41 A assign (resid 137 and name HB1) (resid 137 and name HN) 2.65 0.85 0.85 ! 0.0000 517:10 Intra 2.45, 2.61 A assign (resid 119 and name HA) (resid 122 and name HN) 2.65 0.85 0.85 ! 0.9851 518:10 Mid 2.95, 3.20 A assign (resid 137 and name HA) (resid 140 and name HN) 3.65 1.85 1.85 ! 0.0000 519:10 Mid 3.28, 3.61 A assign (resid 122 and name HB2) (resid 122 and name HN) 2.30 0.50 0.50 ! 0.0000 520:10 Intra 2.04, 2.12 A assign (resid 16 and name HB2) (resid 18 and name HN) 4.15 2.35 2.35 ! 0.0000 521:10 Mid 4.83, 5.22 A assign (resid 143 and name HB2) (resid 143 and name HN) 2.65 0.85 0.85 ! 0.6464 522:10 Ambig 2.42, 2.64 A or (resid 142 and name HB1) (resid 143 and name HN) ! 0.3528 522:10 ----- 2.68, 2.92 A assign (resid 117 and name HG2) (resid 117 and name HN) 3.65 1.85 1.85 ! 0.0000 523:10 Intra 3.22, 3.59 A assign (resid 40 and name HG*) (resid 41 and name HN) 3.65 1.85 1.85 ! 0.9442 524:10 Seq 3.95, 4.68 A assign (resid 104 and name HB2) (resid 104 and name HN) 2.65 0.85 0.85 ! 0.0000 525:10 Intra 2.32, 2.41 A assign (resid 104 and name HB1) (resid 104 and name HN) 3.15 1.35 1.35 ! 0.6885 526:10 Ambig 3.58, 3.63 A or (resid 107 and name HG2) (resid 104 and name HN) ! 0.2564 526:10 ----- 4.22, 6.32 A assign (resid 118 and name HB1) (resid 120 and name HN) 4.15 2.35 2.35 ! 0.0000 527:10 Mid 5.33, 5.45 A assign (resid 135 and name HB2) (resid 135 and name HN) 2.30 0.50 0.50 ! 0.9518 528:10 Intra 2.26, 2.39 A assign (resid 135 and name HB1) (resid 135 and name HN) 3.15 1.35 1.35 ! 0.9510 529:10 Intra 3.54, 3.62 A assign (resid 74 and name HB1) (resid 39 and name HN) 4.15 2.35 2.35 ! 0.5290 530:10 Ambig 4.42, 4.81 A or (resid 40 and name HG*) (resid 39 and name HN) ! 0.4346 530:10 ----- 4.56, 5.13 A assign (resid 16 and name HB1) (resid 17 and name HN) 4.15 2.35 2.35 ! 0.9379 531:10 Seq 2.63, 3.82 A assign (resid 125 and name HG1) (resid 125 and name HN) 2.65 0.85 0.85 ! 0.9981 532:10 Intra 2.10, 2.23 A assign (resid 11 and name HB*) (resid 11 and name HN) 2.65 0.85 0.85 ! 0.9614 533:10 Intra 2.25, 2.80 A assign (resid 125 and name HG2) (resid 125 and name HN) 2.65 0.85 0.85 ! 0.5222 534:10 Ambig 3.20, 3.43 A or (resid 125 and name HB1) (resid 125 and name HN) ! 0.3045 534:10 ----- 3.50, 3.57 A or (resid 124 and name HG*) (resid 125 and name HN) ! 0.1733 534:10 ----- 3.84, 4.65 A assign (resid 126 and name HA) (resid 129 and name HN) 3.65 1.85 1.85 ! 0.0000 535:10 Mid 3.35, 3.46 A assign (resid 81 and name HB*) (resid 81 and name HN) 2.65 0.85 0.85 ! 0.0000 536:10 Intra 2.38, 3.04 A assign (resid 76 and name HA) (resid 82 and name HN) 4.15 2.35 2.35 ! 0.8192 537:10 Ambig 3.99, 4.54 A or (resid 83 and name HB2) (resid 82 and name HN) ! 0.1808 537:10 ----- 5.14, 5.32 A assign (resid 100 and name HB2) (resid 100 and name HN) 2.30 0.50 0.50 ! 0.0000 538:10 Intra 2.19, 2.36 A assign (resid 100 and name HB1) (resid 100 and name HN) 3.15 1.35 1.35 ! 0.0000 539:10 Intra 3.48, 3.60 A assign (resid 118 and name HB1) (resid 118 and name HN) 3.15 1.35 1.35 ! 0.0000 540:10 Intra 3.55, 3.60 A assign (resid 118 and name HB2) (resid 118 and name HN) 2.65 0.85 0.85 ! 0.0000 541:10 Intra 2.30, 2.37 A assign (resid 137 and name HB2) (resid 137 and name HN) 2.30 0.50 0.50 ! 0.9991 542:10 Intra 2.17, 2.44 A assign (resid 16 and name HB1) (resid 18 and name HN) 3.65 1.85 1.85 ! 0.6318 543:10 Ambig 4.80, 5.26 A or (resid 1 and name HG1) (resid 18 and name HN) ! 0.2524 543:10 ----- 5.59, 6.72 A or (resid 138 and name HB1) (resid 137 and name HN) ! 0.1158 543:10 ----- 6.37, 6.57 A assign (resid 139 and name HB2) (resid 140 and name HN) 3.65 1.85 1.85 ! 0.8093 545:10 Ambig 3.32, 3.61 A or (resid 158 and name HB*) (resid 140 and name HN) ! 0.1907 545:10 ----- 4.22, 4.80 A assign (resid 125 and name HG1) (resid 122 and name HN) 3.65 1.85 1.85 ! 0.3673 546:10 Ambig 4.36, 4.81 A or (resid 123 and name HG1) (resid 122 and name HN) ! 0.3249 546:10 ----- 4.45, 4.68 A or (resid 118 and name HB1) (resid 122 and name HN) ! 0.3078 546:10 ----- 4.49, 4.75 A assign (resid 118 and name HB2) (resid 122 and name HN) 4.15 2.35 2.35 ! 0.6059 547:10 Ambig 5.46, 5.64 A or (resid 123 and name HG2) (resid 122 and name HN) ! 0.3941 547:10 ----- 5.86, 6.08 A assign (resid 139 and name HB1) (resid 140 and name HN) 3.65 1.85 1.85 ! 0.0000 548:10 Seq 4.11, 4.24 A assign (resid 117 and name HB*) (resid 117 and name HN) 2.65 0.85 0.85 ! 0.9800 549:10 Intra 2.43, 3.11 A assign (resid 40 and name HB2) (resid 41 and name HN) 3.15 1.35 1.35 ! 0.7176 550:10 Ambig 3.91, 4.18 A or (resid 71 and name HB2) (resid 41 and name HN) ! 0.2824 550:10 ----- 4.57, 5.55 A assign (resid 115 and name HB*) (resid 117 and name HN) 2.65 0.85 0.85 ! 0.8962 551:10 Ambig 3.06, 4.12 A or (resid 120 and name HG*) (resid 117 and name HN) ! 0.0938 551:10 ----- 4.46, 5.10 A assign (resid 109 and name HB2) (resid 109 and name HN) 2.30 0.50 0.50 ! 0.6658 552:10 Ambig 2.21, 2.26 A or (resid 98 and name HB) (resid 98 and name HN) ! 0.3207 552:10 ----- 2.49, 2.59 A assign (resid 103 and name HB1) (resid 104 and name HN) 2.30 0.50 0.50 ! 0.5984 553:10 Ambig 2.14, 2.92 A or (resid 103 and name HB2) (resid 104 and name HN) ! 0.4016 553:10 ----- 2.28, 2.98 A assign (resid 103 and name HG1) (resid 104 and name HN) 3.65 1.85 1.85 ! 0.9156 554:10 Ambig 4.25, 4.50 A or (resid 8 and name HG12) (resid 104 and name HN) ! 0.0844 554:10 ----- 6.32, 6.59 A assign (resid 120 and name HB*) (resid 120 and name HN) 2.30 0.50 0.50 ! 0.0000 555:10 Intra 2.43, 3.09 A assign (resid 120 and name HG*) (resid 120 and name HN) 2.30 0.50 0.50 ! 0.9762 556:10 Intra 2.07, 2.96 A assign (resid 134 and name HB) (resid 135 and name HN) 2.65 0.85 0.85 ! 0.9924 557:10 Seq 2.52, 2.79 A assign (resid 40 and name HB2) (resid 39 and name HN) 4.15 2.35 2.35 ! 0.0000 558:10 Seq 6.01, 6.16 A assign (resid 146 and name HB2) (resid 146 and name HN) 2.30 0.50 0.50 ! 0.9990 559:10 Intra 2.18, 2.39 A assign (resid 146 and name HD*) (resid 146 and name HN) 3.65 1.85 1.85 ! 0.6349 560:10 Ambig 4.37, 5.00 A or (resid 131 and name HB1) (resid 135 and name HN) ! 0.3651 560:10 ----- 4.79, 5.55 A assign (resid 146 and name HG*) (resid 146 and name HN) 3.15 1.35 1.35 ! 0.9629 561:10 Intra 2.42, 4.36 A assign (resid 50 and name HB) (resid 50 and name HN) 3.65 1.85 1.85 ! 0.9937 562:10 Intra 2.49, 2.94 A assign (resid 110 and name HB*) (resid 110 and name HN) 2.30 0.50 0.50 ! 0.5000 563:10 Ambig 2.43, 3.11 A or (resid 109 and name HB2) (resid 110 and name HN) ! 0.4920 563:10 ----- 2.44, 2.62 A assign (resid 43 and name HB) (resid 43 and name HN) 2.65 0.85 0.85 ! 0.7843 564:10 Ambig 2.46, 2.57 A or (resid 70 and name HB2) (resid 43 and name HN) ! 0.1928 564:10 ----- 3.11, 3.74 A assign (resid 124 and name HB2) (resid 125 and name HN) 2.30 0.50 0.50 ! 0.9912 565:10 Seq 2.35, 2.73 A assign (resid 106 and name HB*) (resid 106 and name HN) 2.30 0.50 0.50 ! 0.9756 566:10 Intra 2.28, 2.80 A assign (resid 48 and name HB) (resid 48 and name HN) 3.15 1.35 1.35 ! 0.0000 567:10 Intra 2.50, 3.06 A assign (resid 106 and name HG*) (resid 106 and name HN) 2.30 0.50 0.50 ! 0.7203 568:10 Ambig 2.16, 3.65 A or (resid 105 and name HB) (resid 106 and name HN) ! 0.2787 568:10 ----- 2.53, 2.78 A assign (resid 31 and name HG2) (resid 129 and name HN) 4.15 2.35 2.35 ! 0.0000 569:10 Long 5.44, 6.30 A assign (resid 130 and name HB) (resid 129 and name HN) 3.65 1.85 1.85 ! 0.8757 570:10 Ambig 4.80, 4.91 A or (resid 31 and name HB2) (resid 129 and name HN) ! 0.1243 570:10 ----- 6.64, 7.23 A assign (resid 78 and name HB2) (resid 80 and name HN) 4.15 2.35 2.35 ! 0.4935 571:10 Ambig 4.68, 4.89 A or (resid 72 and name HB*) (resid 80 and name HN) ! 0.2700 571:10 ----- 5.17, 7.81 A or (resid 78 and name HG1) (resid 80 and name HN) ! 0.1356 571:10 ----- 5.80, 6.01 A or (resid 78 and name HG2) (resid 80 and name HN) ! 0.1009 571:10 ----- 6.09, 6.29 A assign (resid 28 and name HG1) (resid 28 and name HN) 3.15 1.35 1.35 ! 0.9945 572:10 Intra 2.69, 3.09 A assign (resid 28 and name HB2) (resid 28 and name HN) 3.15 1.35 1.35 ! 0.9792 573:10 Intra 3.65, 3.75 A assign (resid 28 and name HB1) (resid 28 and name HN) 2.65 0.85 0.85 ! 0.8456 574:10 Ambig 2.88, 3.06 A or (resid 25 and name HB*) (resid 28 and name HN) ! 0.1371 574:10 ----- 3.90, 5.43 A assign (resid 114 and name HB) (resid 114 and name HN) 2.30 0.50 0.50 ! 0.9281 575:10 Intra 2.43, 2.57 A assign (resid 99 and name HB*) (resid 100 and name HN) 2.30 0.50 0.50 ! 0.9977 576:10 Seq 2.22, 3.03 A assign (resid 99 and name HD*) (resid 100 and name HN) 3.15 1.35 1.35 ! 0.7379 577:10 Ambig 3.21, 5.13 A or (resid 99 and name HG1) (resid 100 and name HN) ! 0.1737 577:10 ----- 4.09, 4.53 A or (resid 101 and name HB1) (resid 100 and name HN) ! 0.0884 577:10 ----- 4.57, 4.80 A assign (resid 117 and name HB*) (resid 118 and name HN) 2.30 0.50 0.50 ! 0.9705 578:10 Seq 2.35, 3.21 A assign (resid 115 and name HB*) (resid 118 and name HN) 2.65 0.85 0.85 ! 0.9107 579:10 Ambig 2.80, 3.89 A or (resid 121 and name HG1) (resid 118 and name HN) ! 0.0453 579:10 ----- 4.62, 5.96 A assign (resid 121 and name HB*) (resid 122 and name HN) 2.30 0.50 0.50 ! 0.9726 580:10 Seq 2.25, 3.17 A assign (resid 18 and name HG) (resid 18 and name HN) 2.30 0.50 0.50 ! 0.0000 581:10 Intra 2.43, 2.64 A assign (resid 140 and name HG) (resid 140 and name HN) 2.65 0.85 0.85 ! 0.0000 582:10 Intra 2.60, 2.72 A assign (resid 155 and name HB) (resid 143 and name HN) 3.65 1.85 1.85 ! 0.9746 583:10 Long 2.50, 2.78 A assign (resid 116 and name HG1*) (resid 117 and name HN) 3.15 1.35 1.35 ! 0.7934 584:10 Ambig 3.24, 4.32 A or (resid 116 and name HG2*) (resid 117 and name HN) ! 0.1975 584:10 ----- 4.09, 4.72 A assign (resid 41 and name HG1*) (resid 41 and name HN) 2.65 0.85 0.85 ! 0.8415 585:10 Ambig 2.77, 3.78 A or (resid 43 and name HG2*) (resid 41 and name HN) ! 0.1585 585:10 ----- 3.66, 5.58 A assign (resid 154 and name HB1) (resid 143 and name HN) 4.15 2.35 2.35 ! 0.9648 586:10 Long 4.15, 5.94 A assign (resid 108 and name HB*) (resid 109 and name HN) 2.65 0.85 0.85 ! 0.9939 587:10 Seq 2.50, 3.44 A assign (resid 98 and name HG2*) (resid 98 and name HN) 2.30 0.50 0.50 ! 0.9569 588:10 Intra 2.07, 3.06 A assign (resid 155 and name HB) (resid 155 and name HN) 2.65 0.85 0.85 ! 0.5231 589:10 Ambig 2.21, 2.32 A or (resid 155 and name HG1*) (resid 155 and name HN) ! 0.4769 589:10 ----- 2.25, 3.24 A assign (resid 109 and name HD1*) (resid 109 and name HN) 2.30 0.50 0.50 ! 0.9476 590:10 Intra 2.51, 3.15 A assign (resid 169 and name HG2*) (resid 158 and name HN) 3.15 1.35 1.35 ! 0.9640 592:10 Long 2.64, 4.02 A assign (resid 119 and name HG2*) (resid 120 and name HN) 3.15 1.35 1.35 ! 0.7577 593:10 Ambig 3.46, 4.36 A or (resid 116 and name HG1*) (resid 120 and name HN) ! 0.2423 593:10 ----- 4.18, 5.23 A assign (resid 134 and name HG1*) (resid 135 and name HN) 2.65 0.85 0.85 ! 0.6117 594:10 Ambig 3.58, 4.43 A or (resid 166 and name HB2) (resid 158 and name HN) ! 0.2773 594:10 ----- 4.08, 4.95 A or (resid 136 and name HB1) (resid 135 and name HN) ! 0.0709 594:10 ----- 5.12, 6.07 A assign (resid 119 and name HG11) (resid 120 and name HN) 3.15 1.35 1.35 ! 0.6746 595:10 Ambig 4.53, 5.13 A or (resid 119 and name HD1*) (resid 120 and name HN) ! 0.3254 595:10 ----- 5.11, 5.85 A assign (resid 39 and name HB*) (resid 39 and name HN) 2.65 0.85 0.85 ! 0.0000 596:10 Intra 2.54, 3.30 A assign (resid 75 and name HG2*) (resid 39 and name HN) 3.15 1.35 1.35 ! 0.9316 597:10 Long 3.60, 5.05 A assign (resid 82 and name HB*) (resid 146 and name HN) 3.15 1.35 1.35 ! 0.9308 598:10 Long 3.06, 4.51 A assign (resid 50 and name HG12) (resid 50 and name HN) 2.30 0.50 0.50 ! 0.6730 599:10 Ambig 2.15, 3.44 A or (resid 17 and name HB*) (resid 17 and name HN) ! 0.3205 599:10 ----- 2.43, 2.91 A assign (resid 109 and name HB1) (resid 110 and name HN) 3.15 1.35 1.35 ! 0.9638 600:10 Seq 2.81, 3.00 A assign (resid 50 and name HD1*) (resid 50 and name HN) 3.15 1.35 1.35 ! 0.9125 601:10 Ambig 2.05, 4.41 A or (resid 48 and name HG2*) (resid 50 and name HN) ! 0.0636 601:10 ----- 3.19, 5.61 A assign (resid 119 and name HD1*) (resid 110 and name HN) 3.15 1.35 1.35 ! 0.6175 602:10 Ambig 4.23, 6.01 A or (resid 109 and name HD1*) (resid 110 and name HN) ! 0.3218 602:10 ----- 4.72, 5.29 A assign (resid 42 and name HB*) (resid 43 and name HN) 2.65 0.85 0.85 ! 0.0000 603:10 Seq 2.79, 3.93 A assign (resid 43 and name HG2*) (resid 43 and name HN) 2.30 0.50 0.50 ! 0.9890 604:10 Intra 2.00, 3.18 A assign (resid 48 and name HG11) (resid 48 and name HN) 3.65 1.85 1.85 ! 0.9473 605:10 Intra 2.16, 3.37 A assign (resid 50 and name HD1*) (resid 48 and name HN) 3.65 1.85 1.85 ! 0.5431 606:10 Ambig 1.98, 7.79 A or (resid 48 and name HD1*) (resid 48 and name HN) ! 0.4518 606:10 ----- 2.04, 4.34 A assign (resid 126 and name HB*) (resid 125 and name HN) 3.15 1.35 1.35 ! 0.0000 607:10 Seq 4.53, 5.25 A assign (resid 128 and name HG2*) (resid 129 and name HN) 3.15 1.35 1.35 ! 0.7185 608:10 Ambig 3.81, 4.65 A or (resid 33 and name HG) (resid 129 and name HN) ! 0.2586 608:10 ----- 4.51, 4.73 A assign (resid 82 and name HB*) (resid 81 and name HN) 3.65 1.85 1.85 ! 0.0000 609:10 Seq 4.50, 5.38 A assign (resid 130 and name HG2*) (resid 129 and name HN) 3.15 1.35 1.35 ! 0.8534 610:10 Ambig 3.97, 5.12 A or (resid 133 and name HD1*) (resid 129 and name HN) ! 0.0630 610:10 ----- 6.13, 7.13 A or (resid 102 and name HG1*) (resid 129 and name HN) ! 0.0526 610:10 ----- 6.32, 7.97 A assign (resid 82 and name HB*) (resid 82 and name HN) 2.65 0.85 0.85 ! 0.0000 611:10 Intra 3.01, 3.63 A assign (resid 82 and name HB*) (resid 80 and name HN) 3.65 1.85 1.85 ! 0.0000 612:10 Mid 4.08, 5.41 A assign (resid 114 and name HG2*) (resid 114 and name HN) 2.30 0.50 0.50 ! 0.9948 613:10 Intra 1.97, 3.09 A assign (resid 99 and name HG2) (resid 100 and name HN) 3.65 1.85 1.85 ! 0.0000 614:10 Seq 3.04, 4.82 A assign (resid 102 and name HG2*) (resid 100 and name HN) 4.15 2.35 2.35 ! 0.6363 615:10 Ambig 5.47, 6.73 A or (resid 98 and name HG2*) (resid 100 and name HN) ! 0.3637 615:10 ----- 6.00, 6.76 A assign (resid 98 and name HG1*) (resid 100 and name HN) 3.65 1.85 1.85 ! 0.0000 616:10 Mid 5.53, 6.39 A assign (resid 17 and name HB*) (resid 18 and name HN) 2.65 0.85 0.85 ! 0.7772 617:10 Ambig 2.99, 3.88 A or (resid 20 and name HG11) (resid 18 and name HN) ! 0.1733 617:10 ----- 3.84, 4.16 A assign (resid 140 and name HB2) (resid 140 and name HN) 2.65 0.85 0.85 ! 0.9900 618:10 Intra 2.43, 2.47 A assign (resid 18 and name HD2*) (resid 18 and name HN) 2.65 0.85 0.85 ! 0.4134 619:10 Ambig 3.35, 4.41 A or (resid 136 and name HB1) (resid 137 and name HN) ! 0.3761 619:10 ----- 3.40, 4.03 A or (resid 18 and name HD1*) (resid 18 and name HN) ! 0.1259 619:10 ----- 4.08, 4.73 A or (resid 134 and name HG1*) (resid 137 and name HN) ! 0.0451 619:10 ----- 4.84, 5.61 A assign (resid 154 and name HD1*) (resid 143 and name HN) 4.15 2.35 2.35 ! 0.9712 620:10 Long 3.47, 4.74 A assign (resid 109 and name HD2*) (resid 109 and name HN) 3.15 1.35 1.35 ! 0.0000 621:10 Intra 3.96, 4.78 A assign (resid 105 and name HG1*) (resid 109 and name HN) 3.65 1.85 1.85 ! 0.0000 622:10 Mid 4.19, 5.02 A assign (resid 154 and name HD1*) (resid 155 and name HN) 3.15 1.35 1.35 ! 0.0000 623:10 Seq 2.78, 4.08 A assign (resid 155 and name HD1*) (resid 155 and name HN) 3.15 1.35 1.35 ! 0.0000 624:10 Intra 2.12, 3.97 A assign (resid 154 and name HD2*) (resid 155 and name HN) 3.65 1.85 1.85 ! 0.0000 625:10 Seq 5.57, 5.78 A assign (resid 33 and name HD1*) (resid 34 and name HN) 3.65 1.85 1.85 ! 0.7200 626:10 Ambig 5.06, 5.89 A or (resid 133 and name HD2*) (resid 34 and name HN) ! 0.1595 626:10 ----- 6.50, 7.73 A or (resid 30 and name HG1*) (resid 34 and name HN) ! 0.1204 626:10 ----- 6.82, 7.84 A assign (resid 105 and name HG2*) (resid 104 and name HN) 4.15 2.35 2.35 ! 0.0000 627:10 Seq 4.29, 5.54 A assign (resid 140 and name HD2*) (resid 158 and name HN) 3.15 1.35 1.35 ! 0.5511 628:10 Ambig 3.74, 4.64 A or (resid 136 and name HD*) (resid 135 and name HN) ! 0.2383 628:10 ----- 4.30, 6.43 A or (resid 136 and name HG1) (resid 135 and name HN) ! 0.0463 628:10 ----- 5.65, 6.38 A or (resid 136 and name HD*) (resid 158 and name HN) ! 0.0453 628:10 ----- 5.67, 7.59 A or (resid 136 and name HG1) (resid 158 and name HN) ! 0.0415 628:10 ----- 5.75, 6.81 A assign (resid 109 and name HD2*) (resid 110 and name HN) 3.65 1.85 1.85 ! 0.0000 629:10 Seq 4.84, 5.48 A assign (resid 105 and name HG2*) (resid 106 and name HN) 3.15 1.35 1.35 ! 0.0000 630:10 Seq 4.30, 4.89 A assign (resid 105 and name HG1*) (resid 106 and name HN) 3.15 1.35 1.35 ! 0.0000 631:10 Seq 3.27, 4.25 A assign (resid 136 and name HD*) (resid 136 and name HN) 3.15 1.35 1.35 ! 0.8104 632:10 Ambig 2.66, 4.27 A or (resid 136 and name HG1) (resid 136 and name HN) ! 0.1105 632:10 ----- 3.71, 4.09 A assign (resid 140 and name HD1*) (resid 137 and name HN) 2.65 0.85 0.85 ! 0.5578 633:10 Ambig 3.66, 4.61 A or (resid 136 and name HG1) (resid 137 and name HN) ! 0.1327 633:10 ----- 4.65, 5.32 A or (resid 136 and name HD*) (resid 137 and name HN) ! 0.1295 633:10 ----- 4.67, 5.52 A or (resid 140 and name HD2*) (resid 137 and name HN) ! 0.0875 633:10 ----- 4.99, 6.00 A or (resid 20 and name HG12) (resid 18 and name HN) ! 0.0692 633:10 ----- 5.19, 5.42 A assign (resid 140 and name HB1) (resid 140 and name HN) 2.30 0.50 0.50 ! 0.3576 634:10 Ambig 3.61, 3.65 A or (resid 140 and name HD2*) (resid 140 and name HN) ! 0.2743 634:10 ----- 3.78, 4.52 A or (resid 140 and name HD1*) (resid 140 and name HN) ! 0.1822 634:10 ----- 4.04, 4.75 A or (resid 136 and name HG1) (resid 140 and name HN) ! 0.1516 634:10 ----- 4.17, 6.62 A assign (resid 20 and name HD1*) (resid 18 and name HN) 3.65 1.85 1.85 ! 0.9736 635:10 Mid 3.86, 5.13 A assign (resid 21 and name HN) (resid 35 and name HN) 3.15 1.35 1.35 ! 0.8123 636:10 Ambig 3.37, 3.64 A or (resid 36 and name HN) (resid 35 and name HN) ! 0.1877 636:10 ----- 4.31, 4.36 A assign (resid 41 and name HN) (resid 72 and name HN) 3.15 1.35 1.35 ! 0.0000 637:10 Long 2.70, 2.86 A assign (resid 84 and name HN) (resid 144 and name HN) 3.15 1.35 1.35 ! 0.9723 638:10 Long 2.58, 2.76 A assign (resid 147 and name HN) (resid 148 and name HN) 3.15 1.35 1.35 ! 0.0000 639:10 Seq 2.46, 2.57 A assign (resid 149 and name HN) (resid 148 and name HN) 3.65 1.85 1.85 ! 0.0000 640:10 Seq 4.44, 4.50 A assign (resid 41 and name HN) (resid 40 and name HN) 4.15 2.35 2.35 ! 0.0000 641:10 Seq 4.22, 4.39 A assign (resid 148 and name HN) (resid 149 and name HN) 3.15 1.35 1.35 ! 0.5453 642:10 Ambig 4.44, 4.50 A or (resid 153 and name HN) (resid 149 and name HN) ! 0.3927 642:10 ----- 4.69, 4.89 A assign (resid 172 and name HN) (resid 34 and name HN) 3.65 1.85 1.85 ! 0.9237 643:10 Long 2.86, 3.16 A assign (resid 86 and name HN) (resid 144 and name HN) 3.65 1.85 1.85 ! 0.0000 644:10 Long 4.41, 4.94 A assign (resid 157 and name HN) (resid 141 and name HN) 2.65 0.85 0.85 ! 0.0000 645:10 Long 2.66, 2.89 A assign (resid 97 and name HN) (resid 95 and name HN) 4.15 2.35 2.35 ! 0.0000 646:10 Mid 3.69, 3.85 A assign (resid 86 and name HN) (resid 142 and name HN) 3.65 1.85 1.85 ! 0.8600 647:10 Ambig 3.05, 3.42 A or (resid 141 and name HN) (resid 142 and name HN) ! 0.1400 647:10 ----- 4.13, 4.38 A assign (resid 120 and name HN) (resid 121 and name HN) 2.65 0.85 0.85 ! 0.0000 648:10 Seq 2.64, 2.73 A assign (resid 123 and name HN) (resid 121 and name HN) 3.65 1.85 1.85 ! 0.6972 649:10 Ambig 3.89, 4.03 A or (resid 124 and name HN) (resid 121 and name HN) ! 0.2574 649:10 ----- 4.60, 4.74 A assign (resid 84 and name HN) (resid 83 and name HN) 3.15 1.35 1.35 ! 0.3528 650:10 Ambig 4.19, 4.36 A or (resid 130 and name HN) (resid 132 and name HN) ! 0.2841 650:10 ----- 4.35, 4.46 A or (resid 135 and name HN) (resid 132 and name HN) ! 0.2381 650:10 ----- 4.48, 4.67 A or (resid 146 and name HN) (resid 83 and name HN) ! 0.1250 650:10 ----- 4.98, 5.50 A assign (resid 133 and name HN) (resid 132 and name HN) 2.65 0.85 0.85 ! 0.0000 651:10 Seq 2.53, 2.59 A assign (resid 130 and name HN) (resid 131 and name HN) 2.65 0.85 0.85 ! 0.9927 652:10 Seq 2.63, 2.78 A assign (resid 104 and name HN) (resid 103 and name HN) 2.65 0.85 0.85 ! 0.0000 653:10 Seq 2.67, 2.83 A assign (resid 102 and name HN) (resid 103 and name HN) 2.65 0.85 0.85 ! 0.9646 654:10 Seq 2.55, 2.67 A assign (resid 96 and name HN) (resid 95 and name HN) 2.65 0.85 0.85 ! 0.0000 655:10 Seq 2.37, 2.55 A assign (resid 94 and name HN) (resid 95 and name HN) 2.65 0.85 0.85 ! 0.9906 656:10 Seq 2.33, 2.49 A assign (resid 140 and name HN) (resid 141 and name HN) 4.15 2.35 2.35 ! 0.6128 657:10 Ambig 4.33, 4.40 A or (resid 142 and name HD*) (resid 141 and name HN) ! 0.2265 657:10 ----- 5.12, 5.95 A or (resid 156 and name HD*) (resid 141 and name HN) ! 0.1607 657:10 ----- 5.42, 7.26 A assign (resid 140 and name HN) (resid 139 and name HN) 2.30 0.50 0.50 ! 0.0000 658:10 Seq 2.00, 2.22 A assign (resid 54 and name HD22) (resid 56 and name HN) 4.15 2.35 2.35 ! 0.6541 659:10 Ambig 3.32, 6.99 A or (resid 122 and name HN) (resid 124 and name HN) ! 0.3459 659:10 ----- 3.69, 3.82 A assign (resid 18 and name HN) (resid 19 and name HN) 4.15 2.35 2.35 ! 0.0000 660:10 Seq 4.23, 4.42 A assign (resid 142 and name HD*) (resid 142 and name HN) 2.65 0.85 0.85 ! 0.0000 661:10 Intra 2.60, 3.77 A assign (resid 152 and name HN) (resid 151 and name HN) 2.30 0.50 0.50 ! 0.9268 662:10 Seq 2.16, 2.32 A assign (resid 142 and name HD*) (resid 88 and name HN) 3.15 1.35 1.35 ! 0.0000 664:10 Long 2.10, 5.83 A assign (resid 129 and name HN) (resid 131 and name HN) 4.15 2.35 2.35 ! 0.0000 665:10 Mid 3.84, 4.16 A assign (resid 132 and name HN) (resid 131 and name HN) 2.65 0.85 0.85 ! 0.0000 666:10 Seq 2.72, 2.85 A assign (resid 132 and name HH2) (resid 34 and name HN) 4.15 2.35 2.35 ! 0.0000 669:10 Long 4.59, 5.14 A assign (resid 159 and name HD*) (resid 159 and name HN) 2.65 0.85 0.85 ! 0.6246 670:10 Ambig 2.29, 3.87 A or (resid 158 and name HD*) (resid 159 and name HN) ! 0.3754 670:10 ----- 2.49, 4.15 A assign (resid 103 and name HN) (resid 102 and name HN) 2.30 0.50 0.50 ! 0.7429 673:10 Ambig 2.55, 2.67 A or (resid 101 and name HD*) (resid 102 and name HN) ! 0.2571 673:10 ----- 3.04, 4.38 A assign (resid 131 and name HN) (resid 132 and name HN) 2.65 0.85 0.85 ! 0.0000 676:10 Seq 2.72, 2.85 A assign (resid 14 and name HN) (resid 15 and name HN) 3.15 1.35 1.35 ! 0.0000 678:10 Seq 4.12, 4.23 A assign (resid 33 and name HA) (resid 34 and name HN) 2.65 0.85 0.85 ! 0.0000 679:10 Seq 2.27, 2.34 A assign (resid 15 and name HA) (resid 15 and name HN) 3.65 1.85 1.85 ! 0.0000 681:10 Intra 2.88, 2.91 A assign (resid 34 and name HA) (resid 35 and name HN) 3.15 1.35 1.35 ! 0.9934 682:10 Seq 2.12, 2.25 A assign (resid 34 and name HA) (resid 34 and name HN) 2.65 0.85 0.85 ! 0.9636 683:10 Intra 2.82, 2.86 A assign (resid 158 and name HA) (resid 159 and name HN) 2.65 0.85 0.85 ! 0.0000 684:10 Seq 2.24, 2.52 A assign (resid 71 and name HA) (resid 72 and name HN) 2.30 0.50 0.50 ! 0.0000 685:10 Seq 2.02, 2.12 A assign (resid 140 and name HA) (resid 141 and name HN) 2.30 0.50 0.50 ! 0.9920 686:10 Seq 1.94, 2.02 A assign (resid 5 and name HA) (resid 13 and name HN) 3.15 1.35 1.35 ! 0.0000 687:10 Long 2.62, 3.03 A assign (resid 151 and name HA) (resid 151 and name HN) 2.65 0.85 0.85 ! 0.0000 689:10 Intra 2.85, 2.91 A assign (resid 83 and name HA) (resid 83 and name HN) 3.65 1.85 1.85 ! 0.0000 690:10 Intra 2.87, 2.90 A assign (resid 148 and name HA) (resid 149 and name HN) 2.65 0.85 0.85 ! 0.8689 691:10 Ambig 2.39, 2.56 A or (resid 171 and name HA) (resid 34 and name HN) ! 0.1311 691:10 ----- 3.27, 3.46 A assign (resid 72 and name HA) (resid 72 and name HN) 3.15 1.35 1.35 ! 0.7791 692:10 Ambig 2.86, 2.91 A or (resid 42 and name HA) (resid 72 and name HN) ! 0.1779 692:10 ----- 3.66, 3.95 A assign (resid 85 and name HA) (resid 144 and name HN) 4.15 2.35 2.35 ! 0.0000 693:10 Long 3.68, 4.11 A assign (resid 141 and name HA) (resid 141 and name HN) 3.15 1.35 1.35 ! 0.9929 694:10 Intra 2.85, 2.91 A assign (resid 92 and name HA1) (resid 95 and name HN) 3.65 1.85 1.85 ! 0.5475 695:10 Ambig 4.33, 4.47 A or (resid 96 and name HB*) (resid 95 and name HN) ! 0.4525 695:10 ----- 4.47, 5.28 A assign (resid 138 and name HA) (resid 139 and name HN) 3.15 1.35 1.35 ! 0.6280 697:10 Ambig 3.20, 3.37 A or (resid 136 and name HA) (resid 139 and name HN) ! 0.3720 697:10 ----- 3.49, 3.74 A assign (resid 148 and name HA) (resid 148 and name HN) 2.65 0.85 0.85 ! 0.0000 698:10 Intra 2.89, 2.91 A assign (resid 124 and name HA) (resid 124 and name HN) 2.30 0.50 0.50 ! 0.5482 700:10 Ambig 2.86, 2.88 A or (resid 121 and name HA) (resid 124 and name HN) ! 0.4518 700:10 ----- 2.95, 3.25 A assign (resid 19 and name HA) (resid 19 and name HN) 2.65 0.85 0.85 ! 0.8878 701:10 Ambig 2.86, 2.89 A or (resid 75 and name HA) (resid 19 and name HN) ! 0.1032 701:10 ----- 4.09, 4.82 A assign (resid 141 and name HA) (resid 142 and name HN) 2.30 0.50 0.50 ! 0.0000 702:10 Seq 2.22, 2.40 A assign (resid 99 and name HA) (resid 102 and name HN) 3.15 1.35 1.35 ! 0.9319 703:10 Mid 3.35, 3.74 A assign (resid 118 and name HA) (resid 121 and name HN) 3.65 1.85 1.85 ! 0.0000 704:10 Mid 3.14, 3.36 A assign (resid 121 and name HA) (resid 121 and name HN) 2.65 0.85 0.85 ! 0.9960 705:10 Intra 2.82, 2.85 A assign (resid 87 and name HA) (resid 88 and name HN) 2.65 0.85 0.85 ! 0.0000 706:10 Seq 2.11, 2.35 A assign (resid 132 and name HA) (resid 132 and name HN) 2.30 0.50 0.50 ! 0.8223 708:10 Ambig 2.81, 2.84 A or (resid 128 and name HA) (resid 132 and name HN) ! 0.1619 708:10 ----- 3.68, 3.94 A assign (resid 100 and name HA) (resid 103 and name HN) 4.15 2.35 2.35 ! 0.0000 709:10 Mid 3.00, 3.33 A assign (resid 131 and name HA) (resid 131 and name HN) 2.30 0.50 0.50 ! 0.9011 710:10 Ambig 2.74, 2.78 A or (resid 127 and name HA) (resid 131 and name HN) ! 0.0989 710:10 ----- 3.96, 4.10 A assign (resid 103 and name HA) (resid 103 and name HN) 3.15 1.35 1.35 ! 0.8897 711:10 Ambig 2.78, 2.81 A or (resid 99 and name HA) (resid 103 and name HN) ! 0.1103 711:10 ----- 3.93, 4.20 A assign (resid 34 and name HB1) (resid 35 and name HN) 3.15 1.35 1.35 ! 0.0000 712:10 Seq 3.65, 3.87 A assign (resid 149 and name HB2) (resid 149 and name HN) 2.65 0.85 0.85 ! 0.8127 713:10 Ambig 2.49, 2.62 A or (resid 34 and name HB1) (resid 34 and name HN) ! 0.1873 713:10 ----- 3.19, 3.28 A assign (resid 94 and name HA) (resid 95 and name HN) 2.65 0.85 0.85 ! 0.9866 714:10 Seq 3.46, 3.49 A assign (resid 157 and name HB2) (resid 141 and name HN) 4.15 2.35 2.35 ! 0.0000 715:10 Long 3.48, 4.17 A assign (resid 95 and name HA) (resid 95 and name HN) 2.65 0.85 0.85 ! 0.0000 716:10 Intra 2.83, 2.85 A assign (resid 137 and name HA) (resid 139 and name HN) 4.15 2.35 2.35 ! 0.0000 717:10 Mid 3.77, 3.97 A assign (resid 142 and name HB2) (resid 142 and name HN) 2.65 0.85 0.85 ! 0.0000 718:10 Intra 2.51, 2.59 A assign (resid 102 and name HA) (resid 102 and name HN) 2.65 0.85 0.85 ! 0.0000 719:10 Intra 2.78, 2.82 A assign (resid 119 and name HA) (resid 121 and name HN) 4.15 2.35 2.35 ! 0.9354 720:10 Mid 4.22, 4.41 A assign (resid 122 and name HB2) (resid 121 and name HN) 4.15 2.35 2.35 ! 0.0000 721:10 Seq 4.16, 4.32 A assign (resid 82 and name HA) (resid 83 and name HN) 2.30 0.50 0.50 ! 0.7569 723:10 Ambig 2.01, 2.13 A or (resid 132 and name HB2) (resid 132 and name HN) ! 0.2394 723:10 ----- 2.44, 2.54 A assign (resid 132 and name HB1) (resid 132 and name HN) 2.30 0.50 0.50 ! 0.0000 724:10 Intra 2.43, 2.51 A assign (resid 130 and name HA) (resid 131 and name HN) 3.15 1.35 1.35 ! 0.9715 726:10 Seq 3.48, 3.54 A assign (resid 102 and name HA) (resid 103 and name HN) 3.65 1.85 1.85 ! 0.8137 727:10 Ambig 3.44, 3.51 A or (resid 106 and name HD*) (resid 103 and name HN) ! 0.1863 727:10 ----- 4.40, 6.27 A assign (resid 103 and name HD*) (resid 103 and name HN) 3.65 1.85 1.85 ! 0.9708 728:10 Intra 3.67, 4.68 A assign (resid 34 and name HB2) (resid 35 and name HN) 3.15 1.35 1.35 ! 0.9987 729:10 Seq 2.34, 2.60 A assign (resid 34 and name HB2) (resid 34 and name HN) 3.65 1.85 1.85 ! 0.0000 730:10 Intra 3.92, 3.95 A assign (resid 149 and name HB1) (resid 149 and name HN) 2.65 0.85 0.85 ! 0.8247 731:10 Ambig 2.61, 3.61 A or (resid 148 and name HG2) (resid 149 and name HN) ! 0.1586 731:10 ----- 3.43, 3.58 A assign (resid 148 and name HB2) (resid 149 and name HN) 2.65 0.85 0.85 ! 0.8543 732:10 Ambig 3.22, 3.40 A or (resid 148 and name HG1) (resid 149 and name HN) ! 0.1377 732:10 ----- 4.36, 4.48 A assign (resid 158 and name HB*) (resid 159 and name HN) 2.65 0.85 0.85 ! 0.9612 733:10 Seq 2.20, 3.11 A assign (resid 143 and name HB2) (resid 144 and name HN) 3.15 1.35 1.35 ! 0.8243 734:10 Ambig 3.55, 3.79 A or (resid 83 and name HB2) (resid 144 and name HN) ! 0.1246 734:10 ----- 4.86, 5.38 A assign (resid 148 and name HB2) (resid 144 and name HN) 4.15 2.35 2.35 ! 0.8656 735:10 Ambig 5.22, 5.70 A or (resid 148 and name HG1) (resid 144 and name HN) ! 0.1344 735:10 ----- 7.11, 7.75 A assign (resid 94 and name HB1) (resid 95 and name HN) 2.65 0.85 0.85 ! 0.0000 736:10 Seq 2.56, 2.80 A assign (resid 94 and name HB2) (resid 95 and name HN) 3.15 1.35 1.35 ! 0.0000 737:10 Seq 3.88, 4.02 A assign (resid 141 and name HG1) (resid 141 and name HN) 3.15 1.35 1.35 ! 0.0000 738:10 Intra 2.77, 3.44 A assign (resid 139 and name HB2) (resid 139 and name HN) 2.65 0.85 0.85 ! 0.9652 739:10 Intra 2.45, 2.51 A assign (resid 138 and name HB2) (resid 139 and name HN) 3.15 1.35 1.35 ! 0.9180 740:10 Ambig 2.77, 3.26 A or (resid 6 and name HB2) (resid 13 and name HN) ! 0.0414 740:10 ----- 4.65, 4.98 A assign (resid 148 and name HG2) (resid 148 and name HN) 3.15 1.35 1.35 ! 0.9690 741:10 Intra 3.84, 4.08 A assign (resid 139 and name HB1) (resid 139 and name HN) 2.65 0.85 0.85 ! 0.4989 742:10 Ambig 3.65, 3.69 A or (resid 138 and name HB1) (resid 139 and name HN) ! 0.4919 742:10 ----- 3.65, 4.03 A assign (resid 148 and name HB2) (resid 148 and name HN) 2.30 0.50 0.50 ! 0.6225 743:10 Ambig 2.37, 2.44 A or (resid 148 and name HG1) (resid 148 and name HN) ! 0.3775 743:10 ----- 2.58, 2.91 A assign (resid 125 and name HG1) (resid 124 and name HN) 3.15 1.35 1.35 ! 0.8071 744:10 Ambig 3.64, 3.90 A or (resid 123 and name HG1) (resid 124 and name HN) ! 0.1929 744:10 ----- 4.62, 4.73 A assign (resid 124 and name HG*) (resid 124 and name HN) 2.65 0.85 0.85 ! 0.9909 745:10 Intra 2.19, 3.08 A assign (resid 142 and name HB1) (resid 142 and name HN) 3.15 1.35 1.35 ! 0.9512 746:10 Intra 3.64, 3.71 A assign (resid 40 and name HG*) (resid 40 and name HN) 2.65 0.85 0.85 ! 0.9930 747:10 Intra 2.36, 3.19 A assign (resid 101 and name HB2) (resid 102 and name HN) 3.15 1.35 1.35 ! 0.0000 748:10 Seq 3.53, 3.69 A assign (resid 151 and name HB2) (resid 151 and name HN) 2.65 0.85 0.85 ! 0.9974 749:10 Intra 2.33, 2.48 A assign (resid 149 and name HB1) (resid 151 and name HN) 2.30 0.50 0.50 ! 0.9433 750:10 Mid 2.24, 2.53 A assign (resid 120 and name HE*) (resid 121 and name HN) 4.15 2.35 2.35 ! 0.0000 751:10 Seq 6.31, 6.84 A assign (resid 88 and name HB*) (resid 88 and name HN) 2.65 0.85 0.85 ! 0.0000 752:10 Intra 2.37, 3.11 A assign (resid 83 and name HB2) (resid 83 and name HN) 2.30 0.50 0.50 ! 0.7606 753:10 Ambig 2.31, 2.47 A or (resid 76 and name HA) (resid 83 and name HN) ! 0.2354 753:10 ----- 2.81, 3.97 A assign (resid 133 and name HG) (resid 132 and name HN) 3.15 1.35 1.35 ! 0.5316 754:10 Ambig 4.15, 4.42 A or (resid 133 and name HB2) (resid 132 and name HN) ! 0.2389 754:10 ----- 4.74, 4.83 A or (resid 78 and name HB1) (resid 83 and name HN) ! 0.2295 754:10 ----- 4.77, 5.44 A assign (resid 100 and name HB2) (resid 103 and name HN) 3.65 1.85 1.85 ! 0.6825 755:10 Ambig 5.47, 5.61 A or (resid 104 and name HB1) (resid 103 and name HN) ! 0.3175 755:10 ----- 6.21, 6.37 A assign (resid 14 and name HA) (resid 15 and name HN) 2.65 0.85 0.85 ! 0.0000 756:10 Seq 2.20, 2.34 A assign (resid 35 and name HB2) (resid 35 and name HN) 3.15 1.35 1.35 ! 0.0000 757:10 Intra 2.81, 3.02 A assign (resid 172 and name HD*) (resid 35 and name HN) 4.15 2.35 2.35 ! 0.0000 758:10 Long 5.73, 7.19 A assign (resid 148 and name HB1) (resid 149 and name HN) 3.15 1.35 1.35 ! 0.9965 759:10 Seq 1.80, 2.00 A assign (resid 172 and name HB2) (resid 34 and name HN) 2.65 0.85 0.85 ! 0.9716 760:10 Long 2.74, 3.25 A assign (resid 152 and name HB*) (resid 149 and name HN) 3.15 1.35 1.35 ! 0.9836 761:10 Mid 3.41, 4.68 A assign (resid 72 and name HB*) (resid 72 and name HN) 2.65 0.85 0.85 ! 0.7709 762:10 Ambig 2.48, 3.15 A or (resid 40 and name HB1) (resid 72 and name HN) ! 0.2195 762:10 ----- 3.05, 3.75 A assign (resid 71 and name HB2) (resid 72 and name HN) 3.15 1.35 1.35 ! 0.8588 763:10 Ambig 3.55, 4.14 A or (resid 40 and name HB2) (resid 72 and name HN) ! 0.1412 763:10 ----- 4.80, 5.39 A assign (resid 141 and name HB*) (resid 141 and name HN) 3.15 1.35 1.35 ! 0.0000 765:10 Intra 2.44, 3.00 A assign (resid 95 and name HB*) (resid 95 and name HN) 2.30 0.50 0.50 ! 0.0000 766:10 Intra 2.40, 3.07 A assign (resid 95 and name HG2) (resid 95 and name HN) 2.65 0.85 0.85 ! 0.9440 767:10 Intra 2.06, 2.29 A assign (resid 148 and name HB1) (resid 148 and name HN) 3.15 1.35 1.35 ! 0.8577 768:10 Ambig 3.62, 3.66 A or (resid 146 and name HB2) (resid 148 and name HN) ! 0.1423 768:10 ----- 4.88, 5.59 A assign (resid 12 and name HB1) (resid 13 and name HN) 3.15 1.35 1.35 ! 0.9936 769:10 Seq 3.03, 3.26 A assign (resid 140 and name HG) (resid 139 and name HN) 3.15 1.35 1.35 ! 0.0000 770:10 Seq 3.23, 3.42 A assign (resid 124 and name HB2) (resid 124 and name HN) 2.30 0.50 0.50 ! 0.9486 771:10 Intra 2.36, 2.45 A assign (resid 18 and name HB1) (resid 19 and name HN) 2.30 0.50 0.50 ! 0.8353 772:10 Ambig 1.90, 2.26 A or (resid 19 and name HB1) (resid 19 and name HN) ! 0.1611 772:10 ----- 2.50, 3.14 A assign (resid 121 and name HG1) (resid 124 and name HN) 4.15 2.35 2.35 ! 0.7566 773:10 Ambig 6.02, 6.73 A or (resid 120 and name HG*) (resid 124 and name HN) ! 0.2434 773:10 ----- 7.28, 7.68 A assign (resid 141 and name HB*) (resid 142 and name HN) 2.65 0.85 0.85 ! 0.0000 774:10 Seq 2.18, 3.37 A assign (resid 102 and name HB) (resid 102 and name HN) 2.30 0.50 0.50 ! 0.9717 775:10 Intra 2.55, 2.58 A assign (resid 40 and name HB1) (resid 40 and name HN) 3.15 1.35 1.35 ! 0.0000 776:10 Intra 3.59, 3.64 A assign (resid 101 and name HB1) (resid 102 and name HN) 2.65 0.85 0.85 ! 0.9871 777:10 Seq 2.19, 2.30 A assign (resid 40 and name HB2) (resid 40 and name HN) 2.65 0.85 0.85 ! 0.9964 778:10 Intra 2.37, 2.48 A assign (resid 150 and name HG2) (resid 151 and name HN) 2.30 0.50 0.50 ! 0.9557 779:10 Seq 2.32, 2.64 A assign (resid 152 and name HB*) (resid 151 and name HN) 3.15 1.35 1.35 ! 0.8064 780:10 Ambig 4.31, 5.15 A or (resid 131 and name HD*) (resid 133 and name HN) ! 0.1936 780:10 ----- 5.47, 7.28 A assign (resid 121 and name HB*) (resid 121 and name HN) 2.30 0.50 0.50 ! 0.9838 781:10 Intra 2.31, 3.05 A assign (resid 121 and name HG1) (resid 121 and name HN) 2.65 0.85 0.85 ! 0.5825 782:10 Ambig 1.86, 3.45 A or (resid 121 and name HG2) (resid 121 and name HN) ! 0.4118 782:10 ----- 1.97, 2.46 A assign (resid 87 and name HB1) (resid 88 and name HN) 3.15 1.35 1.35 ! 0.9331 783:10 Seq 2.89, 3.53 A assign (resid 87 and name HB2) (resid 88 and name HN) 2.65 0.85 0.85 ! 0.9540 784:10 Seq 2.62, 2.96 A assign (resid 131 and name HB2) (resid 132 and name HN) 3.15 1.35 1.35 ! 0.9185 785:10 Ambig 2.58, 3.49 A or (resid 78 and name HG1) (resid 83 and name HN) ! 0.0701 785:10 ----- 3.97, 4.71 A assign (resid 103 and name HB2) (resid 103 and name HN) 2.30 0.50 0.50 ! 0.6229 786:10 Ambig 2.20, 2.44 A or (resid 103 and name HB1) (resid 103 and name HN) ! 0.3771 786:10 ----- 2.39, 3.17 A assign (resid 131 and name HB2) (resid 131 and name HN) 2.30 0.50 0.50 ! 0.6296 787:10 Ambig 2.10, 2.43 A or (resid 130 and name HB) (resid 131 and name HN) ! 0.3704 787:10 ----- 2.29, 2.48 A assign (resid 103 and name HG1) (resid 103 and name HN) 3.15 1.35 1.35 ! 0.9954 788:10 Intra 2.26, 3.25 A assign (resid 14 and name HB) (resid 15 and name HN) 3.15 1.35 1.35 ! 0.8619 790:10 Ambig 3.98, 4.09 A or (resid 3 and name HB) (resid 15 and name HN) ! 0.1149 790:10 ----- 5.56, 5.92 A assign (resid 23 and name HB) (resid 35 and name HN) 4.15 2.35 2.35 ! 0.6713 791:10 Ambig 4.91, 5.30 A or (resid 33 and name HB2) (resid 35 and name HN) ! 0.2310 791:10 ----- 5.86, 6.25 A or (resid 20 and name HB) (resid 35 and name HN) ! 0.0977 791:10 ----- 6.76, 7.28 A assign (resid 36 and name HG1*) (resid 35 and name HN) 4.15 2.35 2.35 ! 0.0000 792:10 Seq 6.43, 7.40 A assign (resid 23 and name HG2*) (resid 35 and name HN) 3.15 1.35 1.35 ! 0.9965 793:10 Long 2.67, 3.82 A assign (resid 33 and name HB2) (resid 34 and name HN) 3.15 1.35 1.35 ! 0.9682 794:10 Seq 3.67, 3.89 A assign (resid 169 and name HG1*) (resid 34 and name HN) 3.65 1.85 1.85 ! 0.5740 795:10 Ambig 5.13, 6.37 A or (resid 154 and name HB2) (resid 149 and name HN) ! 0.4260 795:10 ----- 5.39, 5.93 A assign (resid 36 and name HG2*) (resid 34 and name HN) 3.65 1.85 1.85 ! 0.4543 796:10 Ambig 5.67, 6.98 A or (resid 155 and name HG1*) (resid 149 and name HN) ! 0.3643 796:10 ----- 5.88, 7.73 A or (resid 8 and name HG2*) (resid 149 and name HN) ! 0.1814 796:10 ----- 6.60, 7.60 A assign (resid 71 and name HG2) (resid 72 and name HN) 3.65 1.85 1.85 ! 0.0000 797:10 Seq 3.83, 4.74 A assign (resid 43 and name HG2*) (resid 72 and name HN) 2.65 0.85 0.85 ! 0.9901 798:10 Long 2.18, 3.71 A assign (resid 84 and name HG2*) (resid 144 and name HN) 3.65 1.85 1.85 ! 0.6885 799:10 Ambig 4.57, 5.66 A or (resid 154 and name HG) (resid 144 and name HN) ! 0.3115 799:10 ----- 5.22, 6.83 A assign (resid 85 and name HB*) (resid 144 and name HN) 4.15 2.35 2.35 ! 0.0000 800:10 Long 5.60, 6.46 A assign (resid 95 and name HG1) (resid 95 and name HN) 3.15 1.35 1.35 ! 0.0000 801:10 Intra 3.56, 3.71 A assign (resid 140 and name HB2) (resid 141 and name HN) 3.15 1.35 1.35 ! 0.9386 802:10 Seq 3.69, 4.15 A assign (resid 98 and name HG1*) (resid 95 and name HN) 4.15 2.35 2.35 ! 0.0000 803:10 Mid 7.03, 7.76 A assign (resid 140 and name HB2) (resid 139 and name HN) 3.65 1.85 1.85 ! 0.7996 804:10 Ambig 4.07, 4.33 A or (resid 136 and name HB2) (resid 139 and name HN) ! 0.2004 804:10 ----- 5.13, 5.42 A assign (resid 13 and name HG1*) (resid 13 and name HN) 2.65 0.85 0.85 ! 0.9468 805:10 Intra 2.60, 3.65 A assign (resid 13 and name HG2*) (resid 13 and name HN) 2.65 0.85 0.85 ! 0.9804 806:10 Intra 2.03, 2.97 A assign (resid 75 and name HG2*) (resid 19 and name HN) 2.65 0.85 0.85 ! 0.9399 807:10 Long 1.94, 3.38 A assign (resid 39 and name HB*) (resid 40 and name HN) 2.65 0.85 0.85 ! 0.0000 808:10 Seq 2.91, 3.86 A assign (resid 102 and name HG2*) (resid 102 and name HN) 2.30 0.50 0.50 ! 0.9984 809:10 Intra 2.00, 3.02 A assign (resid 41 and name HG2*) (resid 40 and name HN) 4.15 2.35 2.35 ! 0.0000 810:10 Seq 5.74, 6.86 A assign (resid 98 and name HG1*) (resid 102 and name HN) 3.15 1.35 1.35 ! 0.5330 811:10 Ambig 4.10, 5.15 A or (resid 102 and name HG1*) (resid 102 and name HN) ! 0.3229 811:10 ----- 4.46, 4.57 A or (resid 133 and name HD1*) (resid 102 and name HN) ! 0.0767 811:10 ----- 5.67, 6.82 A assign (resid 82 and name HB*) (resid 83 and name HN) 2.65 0.85 0.85 ! 0.6829 812:10 Ambig 3.41, 4.23 A or (resid 128 and name HG2*) (resid 132 and name HN) ! 0.2601 812:10 ----- 4.00, 5.13 A assign (resid 130 and name HG1*) (resid 132 and name HN) 3.15 1.35 1.35 ! 0.4144 813:10 Ambig 5.51, 6.43 A or (resid 133 and name HD1*) (resid 132 and name HN) ! 0.3413 813:10 ----- 5.70, 6.57 A or (resid 130 and name HG2*) (resid 132 and name HN) ! 0.2443 813:10 ----- 6.02, 6.75 A assign (resid 102 and name HG2*) (resid 103 and name HN) 3.15 1.35 1.35 ! 0.0000 814:10 Seq 4.01, 4.75 A assign (resid 130 and name HG1*) (resid 131 and name HN) 2.65 0.85 0.85 ! 0.5786 815:10 Ambig 3.58, 4.35 A or (resid 130 and name HG2*) (resid 131 and name HN) ! 0.3815 815:10 ----- 3.84, 4.55 A assign (resid 102 and name HG1*) (resid 103 and name HN) 3.15 1.35 1.35 ! 0.9309 816:10 Seq 3.62, 4.47 A assign (resid 14 and name HG2*) (resid 15 and name HN) 2.30 0.50 0.50 ! 0.9975 817:10 Seq 1.89, 3.06 A assign (resid 20 and name HG2*) (resid 35 and name HN) 3.65 1.85 1.85 ! 0.0000 818:10 Long 4.12, 5.63 A assign (resid 23 and name HG2*) (resid 34 and name HN) 2.65 0.85 0.85 ! 0.6811 819:10 Ambig 3.16, 3.90 A or (resid 33 and name HD2*) (resid 34 and name HN) ! 0.2327 819:10 ----- 3.78, 4.46 A or (resid 170 and name HB1) (resid 34 and name HN) ! 0.0863 819:10 ----- 4.46, 4.97 A assign (resid 140 and name HD2*) (resid 159 and name HN) 3.65 1.85 1.85 ! 0.4001 820:10 Ambig 5.33, 6.65 A or (resid 136 and name HD*) (resid 159 and name HN) ! 0.3455 820:10 ----- 5.46, 7.61 A or (resid 136 and name HG1) (resid 159 and name HN) ! 0.1801 820:10 ----- 6.09, 7.73 A assign (resid 140 and name HB1) (resid 141 and name HN) 2.65 0.85 0.85 ! 0.8823 821:10 Ambig 2.45, 3.18 A or (resid 140 and name HD2*) (resid 141 and name HN) ! 0.1003 821:10 ----- 3.52, 4.34 A assign (resid 136 and name HG1) (resid 139 and name HN) 3.15 1.35 1.35 ! 0.3680 822:10 Ambig 3.97, 5.91 A or (resid 136 and name HD*) (resid 139 and name HN) ! 0.2936 822:10 ----- 4.12, 5.72 A or (resid 140 and name HD2*) (resid 139 and name HN) ! 0.1672 822:10 ----- 4.53, 5.44 A or (resid 140 and name HD1*) (resid 139 and name HN) ! 0.1115 822:10 ----- 4.85, 5.71 A assign (resid 33 and name HD2*) (resid 132 and name HN) 3.65 1.85 1.85 ! 0.7529 823:10 Ambig 5.12, 6.22 A or (resid 30 and name HG2*) (resid 132 and name HN) ! 0.2471 823:10 ----- 6.16, 7.45 A assign (resid 33 and name HD1*) (resid 132 and name HN) 3.15 1.35 1.35 ! 0.7851 824:10 Ambig 3.42, 4.36 A or (resid 30 and name HG1*) (resid 132 and name HN) ! 0.1626 824:10 ----- 4.44, 5.37 A assign (resid 14 and name HG1*) (resid 15 and name HN) 3.15 1.35 1.35 ! 0.0000 825:10 Seq 3.37, 4.47 A assign (resid 176 and name HN) (resid 175 and name HN) 3.65 1.85 1.85 ! 0.0000 826:10 Seq 4.42, 4.47 A assign (resid 168 and name HN) (resid 36 and name HN) 3.65 1.85 1.85 ! 0.8775 827:10 Ambig 2.89, 3.31 A or (resid 37 and name HN) (resid 36 and name HN) ! 0.1034 827:10 ----- 4.13, 4.18 A assign (resid 144 and name HN) (resid 84 and name HN) 3.15 1.35 1.35 ! 0.9561 828:10 Long 2.58, 2.76 A assign (resid 134 and name HN) (resid 133 and name HN) 3.15 1.35 1.35 ! 0.0000 829:10 Seq 2.53, 2.61 A assign (resid 109 and name HN) (resid 107 and name HN) 3.65 1.85 1.85 ! 0.0000 830:10 Mid 3.83, 4.07 A assign (resid 34 and name HN) (resid 33 and name HN) 3.65 1.85 1.85 ! 0.0000 831:10 Seq 4.36, 4.42 A assign (resid 17 and name HN) (resid 16 and name HN) 3.15 1.35 1.35 ! 0.0000 832:10 Seq 2.52, 2.65 A assign (resid 133 and name HN) (resid 134 and name HN) 3.15 1.35 1.35 ! 0.0000 833:10 Seq 2.53, 2.61 A assign (resid 141 and name HN) (resid 157 and name HN) 3.15 1.35 1.35 ! 0.9957 834:10 Long 2.66, 2.89 A assign (resid 156 and name HN) (resid 157 and name HN) 3.65 1.85 1.85 ! 0.6491 835:10 Ambig 4.50, 4.54 A or (resid 142 and name HN) (resid 157 and name HN) ! 0.3509 835:10 ----- 4.98, 5.13 A assign (resid 106 and name HN) (resid 107 and name HN) 2.65 0.85 0.85 ! 0.5525 836:10 Ambig 2.33, 2.71 A or (resid 108 and name HN) (resid 107 and name HN) ! 0.4393 836:10 ----- 2.43, 2.56 A assign (resid 174 and name HN) (resid 175 and name HN) 2.65 0.85 0.85 ! 0.0000 837:10 Seq 2.07, 2.25 A assign (resid 13 and name HN) (resid 14 and name HN) 2.65 0.85 0.85 ! 0.0000 838:10 Seq 2.03, 2.20 A assign (resid 4 and name HN) (resid 14 and name HN) 3.15 1.35 1.35 ! 0.0000 839:10 Long 3.03, 3.28 A assign (resid 32 and name HN) (resid 33 and name HN) 2.65 0.85 0.85 ! 0.9790 840:10 Seq 2.29, 2.46 A assign (resid 136 and name HN) (resid 134 and name HN) 3.15 1.35 1.35 ! 0.7231 841:10 Ambig 3.95, 4.10 A or (resid 137 and name HN) (resid 134 and name HN) ! 0.2769 841:10 ----- 4.63, 4.77 A assign (resid 131 and name HN) (resid 134 and name HN) 3.65 1.85 1.85 ! 0.8798 842:10 Ambig 4.70, 4.82 A or (resid 132 and name HD1) (resid 134 and name HN) ! 0.1202 842:10 ----- 6.55, 6.89 A assign (resid 156 and name HD*) (resid 157 and name HN) 3.65 1.85 1.85 ! 0.5187 844:10 Ambig 4.14, 5.26 A or (resid 142 and name HD*) (resid 157 and name HN) ! 0.4150 844:10 ----- 4.29, 5.63 A assign (resid 137 and name HN) (resid 138 and name HN) 3.15 1.35 1.35 ! 0.9524 845:10 Seq 2.81, 2.96 A assign (resid 140 and name HN) (resid 138 and name HN) 4.15 2.35 2.35 ! 0.0000 846:10 Mid 3.83, 4.04 A assign (resid 132 and name HN) (resid 133 and name HN) 2.65 0.85 0.85 ! 0.8330 847:10 Ambig 2.53, 2.59 A or (resid 149 and name HD21) (resid 151 and name HN) ! 0.1454 847:10 ----- 3.39, 5.16 A assign (resid 143 and name HD*) (resid 84 and name HN) 3.65 1.85 1.85 ! 0.9293 848:10 Long 3.06, 5.43 A assign (resid 137 and name HD*) (resid 138 and name HN) 3.15 1.35 1.35 ! 0.0000 849:10 Seq 3.27, 4.65 A assign (resid 175 and name HD*) (resid 175 and name HN) 3.15 1.35 1.35 ! 0.0000 850:10 Intra 2.50, 3.96 A assign (resid 4 and name HD*) (resid 175 and name HN) 4.15 2.35 2.35 ! 0.0000 851:10 Long 3.76, 6.22 A assign (resid 35 and name HA) (resid 36 and name HN) 2.65 0.85 0.85 ! 0.0000 852:10 Seq 2.21, 2.30 A assign (resid 15 and name HA) (resid 16 and name HN) 3.15 1.35 1.35 ! 0.0000 854:10 Seq 2.30, 2.48 A assign (resid 157 and name HA) (resid 157 and name HN) 3.15 1.35 1.35 ! 0.0000 855:10 Intra 2.87, 2.91 A assign (resid 33 and name HA) (resid 33 and name HN) 3.15 1.35 1.35 ! 0.0000 856:10 Intra 2.92, 2.94 A assign (resid 83 and name HA) (resid 84 and name HN) 2.65 0.85 0.85 ! 0.0000 857:10 Seq 1.98, 2.08 A assign (resid 156 and name HA) (resid 157 and name HN) 2.65 0.85 0.85 ! 0.8912 858:10 Ambig 2.25, 2.30 A or (resid 140 and name HA) (resid 157 and name HN) ! 0.0992 858:10 ----- 3.25, 3.52 A assign (resid 175 and name HA) (resid 175 and name HN) 3.15 1.35 1.35 ! 0.0000 859:10 Intra 2.89, 2.91 A assign (resid 15 and name HB2) (resid 16 and name HN) 3.65 1.85 1.85 ! 0.0000 862:10 Seq 2.12, 2.37 A assign (resid 131 and name HA) (resid 134 and name HN) 3.15 1.35 1.35 ! 0.8571 863:10 Ambig 3.45, 3.67 A or (resid 85 and name HA) (resid 84 and name HN) ! 0.1429 863:10 ----- 4.65, 5.02 A assign (resid 138 and name HA) (resid 138 and name HN) 2.65 0.85 0.85 ! 0.8138 864:10 Ambig 2.80, 2.85 A or (resid 136 and name HA) (resid 138 and name HN) ! 0.1862 864:10 ----- 3.59, 4.00 A assign (resid 132 and name HA) (resid 133 and name HN) 3.15 1.35 1.35 ! 0.9888 866:10 Seq 3.48, 3.52 A assign (resid 107 and name HA) (resid 107 and name HN) 2.65 0.85 0.85 ! 0.9972 867:10 Intra 2.82, 2.84 A assign (resid 83 and name HB1) (resid 84 and name HN) 3.15 1.35 1.35 ! 0.9902 868:10 Seq 2.42, 3.23 A assign (resid 16 and name HB2) (resid 16 and name HN) 3.15 1.35 1.35 ! 0.0000 869:10 Intra 2.18, 3.21 A assign (resid 134 and name HA) (resid 134 and name HN) 2.65 0.85 0.85 ! 0.6646 870:10 Ambig 2.82, 2.85 A or (resid 133 and name HA) (resid 134 and name HN) ! 0.1941 870:10 ----- 3.47, 3.51 A or (resid 130 and name HA) (resid 134 and name HN) ! 0.1026 870:10 ----- 3.86, 4.24 A assign (resid 157 and name HB2) (resid 157 and name HN) 3.15 1.35 1.35 ! 0.0000 871:10 Intra 2.79, 3.02 A assign (resid 156 and name HB2) (resid 157 and name HN) 3.15 1.35 1.35 ! 0.0000 872:10 Seq 3.95, 4.09 A assign (resid 137 and name HA) (resid 138 and name HN) 3.15 1.35 1.35 ! 0.9224 873:10 Seq 3.46, 3.52 A assign (resid 137 and name HB1) (resid 138 and name HN) 3.15 1.35 1.35 ! 0.0000 874:10 Seq 2.41, 2.72 A assign (resid 150 and name HD2) (resid 151 and name HN) 2.65 0.85 0.85 ! 0.6335 875:10 Ambig 2.41, 2.80 A or (resid 133 and name HA) (resid 133 and name HN) ! 0.2496 875:10 ----- 2.81, 2.83 A or (resid 130 and name HA) (resid 133 and name HN) ! 0.0604 875:10 ----- 3.56, 3.76 A assign (resid 132 and name HB1) (resid 133 and name HN) 3.15 1.35 1.35 ! 0.0000 876:10 Seq 2.69, 2.86 A assign (resid 106 and name HA) (resid 107 and name HN) 3.65 1.85 1.85 ! 0.9888 877:10 Seq 3.36, 3.51 A assign (resid 105 and name HA) (resid 107 and name HN) 3.65 1.85 1.85 ! 0.9631 878:10 Mid 4.02, 4.26 A assign (resid 174 and name HA2) (resid 175 and name HN) 3.15 1.35 1.35 ! 0.9262 879:10 Seq 3.27, 3.39 A assign (resid 174 and name HA1) (resid 175 and name HN) 3.65 1.85 1.85 ! 0.0000 880:10 Seq 2.94, 3.10 A assign (resid 32 and name HA1) (resid 33 and name HN) 3.15 1.35 1.35 ! 0.9819 881:10 Seq 3.07, 3.24 A assign (resid 144 and name HB*) (resid 84 and name HN) 2.65 0.85 0.85 ! 0.4999 882:10 Ambig 3.19, 4.21 A or (resid 143 and name HB1) (resid 84 and name HN) ! 0.2414 882:10 ----- 3.60, 3.90 A or (resid 83 and name HB2) (resid 84 and name HN) ! 0.2280 882:10 ----- 3.64, 4.22 A assign (resid 16 and name HB1) (resid 16 and name HN) 3.15 1.35 1.35 ! 0.7115 883:10 Ambig 2.32, 2.57 A or (resid 1 and name HG1) (resid 16 and name HN) ! 0.2865 883:10 ----- 2.70, 4.07 A assign (resid 156 and name HB1) (resid 157 and name HN) 3.65 1.85 1.85 ! 0.9963 884:10 Seq 3.00, 3.25 A assign (resid 138 and name HB2) (resid 138 and name HN) 2.65 0.85 0.85 ! 0.9982 885:10 Intra 2.34, 2.47 A assign (resid 138 and name HB1) (resid 138 and name HN) 3.15 1.35 1.35 ! 0.9198 886:10 Ambig 3.57, 3.62 A or (resid 139 and name HB1) (resid 138 and name HN) ! 0.0479 886:10 ----- 5.84, 6.14 A assign (resid 133 and name HG) (resid 133 and name HN) 2.30 0.50 0.50 ! 0.6146 887:10 Ambig 2.18, 2.40 A or (resid 133 and name HB2) (resid 133 and name HN) ! 0.2970 887:10 ----- 2.47, 2.52 A or (resid 150 and name HB2) (resid 151 and name HN) ! 0.0880 887:10 ----- 3.02, 3.44 A assign (resid 107 and name HG1) (resid 107 and name HN) 3.15 1.35 1.35 ! 0.5315 888:10 Ambig 2.41, 3.84 A or (resid 107 and name HG2) (resid 107 and name HN) ! 0.4685 888:10 ----- 2.46, 3.91 A assign (resid 175 and name HB*) (resid 175 and name HN) 2.65 0.85 0.85 ! 0.0000 889:10 Intra 2.30, 3.02 A assign (resid 14 and name HA) (resid 14 and name HN) 2.65 0.85 0.85 ! 0.0000 890:10 Intra 2.77, 2.81 A assign (resid 4 and name HB2) (resid 14 and name HN) 3.15 1.35 1.35 ! 0.9567 891:10 Long 2.92, 3.19 A assign (resid 31 and name HB1) (resid 33 and name HN) 4.15 2.35 2.35 ! 0.6151 892:10 Ambig 5.40, 5.56 A or (resid 22 and name HB2) (resid 33 and name HN) ! 0.3849 892:10 ----- 5.84, 6.54 A assign (resid 36 and name HB) (resid 36 and name HN) 3.15 1.35 1.35 ! 0.0000 893:10 Intra 2.52, 2.62 A assign (resid 35 and name HB1) (resid 36 and name HN) 3.15 1.35 1.35 ! 0.8624 894:10 Ambig 3.67, 3.91 A or (resid 170 and name HB2) (resid 36 and name HN) ! 0.1029 894:10 ----- 5.23, 5.71 A assign (resid 131 and name HB1) (resid 134 and name HN) 3.65 1.85 1.85 ! 0.5685 895:10 Ambig 5.28, 5.50 A or (resid 130 and name HB) (resid 134 and name HN) ! 0.4315 895:10 ----- 5.53, 5.77 A assign (resid 134 and name HB) (resid 134 and name HN) 2.30 0.50 0.50 ! 0.9989 896:10 Intra 2.41, 2.52 A assign (resid 141 and name HB*) (resid 157 and name HN) 3.65 1.85 1.85 ! 0.0000 897:10 Long 3.88, 4.86 A assign (resid 106 and name HB*) (resid 107 and name HN) 2.30 0.50 0.50 ! 0.5233 898:10 Ambig 2.18, 3.32 A or (resid 107 and name HB2) (resid 107 and name HN) ! 0.4468 898:10 ----- 2.24, 2.42 A assign (resid 110 and name HD*) (resid 107 and name HN) 3.65 1.85 1.85 ! 0.0000 899:10 Mid 4.63, 5.97 A assign (resid 13 and name HB) (resid 14 and name HN) 3.65 1.85 1.85 ! 0.0000 900:10 Seq 3.65, 3.94 A assign (resid 14 and name HB) (resid 14 and name HN) 3.65 1.85 1.85 ! 0.9583 901:10 Intra 3.36, 3.43 A assign (resid 172 and name HB2) (resid 33 and name HN) 4.15 2.35 2.35 ! 0.8341 902:10 Ambig 3.73, 3.95 A or (resid 31 and name HB2) (resid 33 and name HN) ! 0.1659 902:10 ----- 4.88, 5.11 A assign (resid 172 and name HD*) (resid 33 and name HN) 3.65 1.85 1.85 ! 0.0000 903:10 Long 3.62, 5.07 A assign (resid 167 and name HG2*) (resid 36 and name HN) 3.65 1.85 1.85 ! 0.9781 904:10 Long 2.58, 3.97 A assign (resid 36 and name HG2*) (resid 36 and name HN) 2.65 0.85 0.85 ! 0.9692 905:10 Intra 2.29, 3.50 A assign (resid 23 and name HG2*) (resid 36 and name HN) 4.15 2.35 2.35 ! 0.8067 906:10 Ambig 5.46, 6.50 A or (resid 170 and name HB1) (resid 36 and name HN) ! 0.1933 906:10 ----- 6.92, 7.38 A assign (resid 2 and name HB) (resid 16 and name HN) 3.15 1.35 1.35 ! 0.8461 907:10 Ambig 3.12, 3.54 A or (resid 17 and name HB*) (resid 16 and name HN) ! 0.0730 907:10 ----- 4.69, 5.33 A or (resid 2 and name HG11) (resid 16 and name HN) ! 0.0680 907:10 ----- 4.75, 5.61 A assign (resid 133 and name HB1) (resid 134 and name HN) 2.65 0.85 0.85 ! 0.7006 908:10 Ambig 3.59, 3.70 A or (resid 84 and name HG2*) (resid 84 and name HN) ! 0.2186 908:10 ----- 4.36, 4.55 A or (resid 82 and name HB*) (resid 84 and name HN) ! 0.0808 908:10 ----- 5.15, 6.20 A assign (resid 3 and name HG2*) (resid 16 and name HN) 3.15 1.35 1.35 ! 0.5786 909:10 Ambig 3.93, 5.64 A or (resid 2 and name HG12) (resid 16 and name HN) ! 0.2594 909:10 ----- 4.49, 5.43 A or (resid 3 and name HG1*) (resid 16 and name HN) ! 0.0993 909:10 ----- 5.27, 6.66 A assign (resid 134 and name HG2*) (resid 134 and name HN) 2.30 0.50 0.50 ! 0.0000 910:10 Intra 2.20, 3.18 A assign (resid 169 and name HG2*) (resid 157 and name HN) 4.15 2.35 2.35 ! 0.6091 911:10 Ambig 4.19, 5.22 A or (resid 140 and name HB2) (resid 157 and name HN) ! 0.3550 911:10 ----- 4.58, 4.91 A assign (resid 133 and name HB1) (resid 133 and name HN) 3.15 1.35 1.35 ! 0.8141 912:10 Ambig 3.61, 3.63 A or (resid 136 and name HB2) (resid 133 and name HN) ! 0.0940 912:10 ----- 5.18, 5.53 A or (resid 128 and name HG2*) (resid 133 and name HN) ! 0.0322 912:10 ----- 6.19, 7.33 A assign (resid 134 and name HG2*) (resid 133 and name HN) 3.65 1.85 1.85 ! 0.5768 913:10 Ambig 4.17, 5.39 A or (resid 154 and name HB2) (resid 151 and name HN) ! 0.2947 913:10 ----- 4.67, 5.22 A or (resid 169 and name HG1*) (resid 133 and name HN) ! 0.1285 913:10 ----- 5.36, 6.54 A assign (resid 133 and name HD1*) (resid 133 and name HN) 3.15 1.35 1.35 ! 0.7667 914:10 Ambig 3.94, 4.56 A or (resid 130 and name HG1*) (resid 133 and name HN) ! 0.1336 914:10 ----- 5.27, 6.04 A or (resid 130 and name HG2*) (resid 133 and name HN) ! 0.0559 914:10 ----- 6.09, 6.65 A assign (resid 108 and name HB*) (resid 107 and name HN) 3.15 1.35 1.35 ! 0.0000 915:10 Seq 4.67, 5.31 A assign (resid 109 and name HD1*) (resid 107 and name HN) 4.15 2.35 2.35 ! 0.4931 916:10 Ambig 4.71, 6.13 A or (resid 7 and name HG1*) (resid 107 and name HN) ! 0.4023 916:10 ----- 4.87, 6.24 A or (resid 7 and name HG2*) (resid 107 and name HN) ! 0.1046 916:10 ----- 6.10, 7.56 A assign (resid 7 and name HG2*) (resid 175 and name HN) 3.15 1.35 1.35 ! 0.6425 917:10 Ambig 4.78, 5.39 A or (resid 109 and name HD1*) (resid 175 and name HN) ! 0.3575 917:10 ----- 5.27, 6.28 A assign (resid 13 and name HG1*) (resid 14 and name HN) 3.65 1.85 1.85 ! 0.7348 918:10 Ambig 4.45, 5.04 A or (resid 5 and name HG1) (resid 14 and name HN) ! 0.2652 918:10 ----- 5.28, 6.61 A assign (resid 13 and name HG2*) (resid 14 and name HN) 2.65 0.85 0.85 ! 0.9666 919:10 Seq 2.43, 3.30 A assign (resid 33 and name HB2) (resid 33 and name HN) 2.30 0.50 0.50 ! 0.6904 920:10 Ambig 2.49, 2.58 A or (resid 33 and name HG) (resid 33 and name HN) ! 0.2708 920:10 ----- 2.92, 3.06 A assign (resid 2 and name HG2*) (resid 16 and name HN) 3.65 1.85 1.85 ! 0.0000 921:10 Long 4.46, 5.50 A assign (resid 20 and name HD1*) (resid 16 and name HN) 3.65 1.85 1.85 ! 0.9759 922:10 Mid 3.56, 4.60 A assign (resid 140 and name HD1*) (resid 134 and name HN) 4.15 2.35 2.35 ! 0.7070 923:10 Ambig 5.73, 6.72 A or (resid 136 and name HG1) (resid 134 and name HN) ! 0.2930 923:10 ----- 6.64, 7.46 A assign (resid 133 and name HD2*) (resid 134 and name HN) 4.15 2.35 2.35 ! 0.8256 924:10 Ambig 5.08, 5.77 A or (resid 33 and name HD1*) (resid 134 and name HN) ! 0.1744 924:10 ----- 6.58, 7.53 A assign (resid 140 and name HD2*) (resid 157 and name HN) 2.65 0.85 0.85 ! 0.6878 925:10 Ambig 2.50, 3.71 A or (resid 140 and name HB1) (resid 157 and name HN) ! 0.2714 925:10 ----- 2.91, 3.22 A assign (resid 140 and name HD1*) (resid 138 and name HN) 4.15 2.35 2.35 ! 0.3538 926:10 Ambig 5.10, 6.09 A or (resid 136 and name HD*) (resid 138 and name HN) ! 0.2804 926:10 ----- 5.31, 6.50 A or (resid 136 and name HG1) (resid 138 and name HN) ! 0.2676 926:10 ----- 5.35, 6.78 A or (resid 140 and name HD2*) (resid 138 and name HN) ! 0.0982 926:10 ----- 6.32, 6.94 A assign (resid 133 and name HD2*) (resid 133 and name HN) 2.65 0.85 0.85 ! 0.7468 927:10 Ambig 3.33, 4.26 A or (resid 33 and name HD1*) (resid 133 and name HN) ! 0.2328 927:10 ----- 4.05, 5.04 A assign (resid 23 and name HG2*) (resid 33 and name HN) 3.15 1.35 1.35 ! 0.5331 928:10 Ambig 4.09, 5.12 A or (resid 33 and name HD2*) (resid 33 and name HN) ! 0.4364 928:10 ----- 4.23, 4.97 A assign (resid 33 and name HD1*) (resid 33 and name HN) 3.15 1.35 1.35 ! 0.5134 929:10 Ambig 3.89, 4.77 A or (resid 30 and name HG1*) (resid 33 and name HN) ! 0.4866 929:10 ----- 3.93, 5.39 A assign (resid 14 and name HG1*) (resid 14 and name HN) 3.15 1.35 1.35 ! 0.0000 930:10 Intra 2.53, 3.62 A assign (resid 8 and name HN) (resid 9 and name HN) 2.65 0.85 0.85 ! 0.0000 931:10 Seq 2.27, 2.54 A assign (resid 174 and name HN) (resid 173 and name HN) 3.15 1.35 1.35 ! 0.9872 932:10 Seq 2.32, 2.46 A assign (resid 172 and name HN) (resid 173 and name HN) 3.65 1.85 1.85 ! 0.0000 933:10 Seq 2.57, 2.72 A assign (resid 10 and name HN) (resid 9 and name HN) 3.15 1.35 1.35 ! 0.9397 934:10 Seq 2.33, 2.38 A assign (resid 146 and name HN) (resid 147 and name HN) 3.15 1.35 1.35 ! 0.0000 935:10 Seq 2.50, 2.77 A assign (resid 148 and name HN) (resid 147 and name HN) 3.15 1.35 1.35 ! 0.0000 936:10 Seq 2.46, 2.57 A assign (resid 84 and name HN) (resid 145 and name HN) 4.15 2.35 2.35 ! 0.5095 937:10 Ambig 4.71, 4.88 A or (resid 155 and name HN) (resid 145 and name HN) ! 0.4905 937:10 ----- 4.74, 5.26 A assign (resid 175 and name HN) (resid 173 and name HN) 3.65 1.85 1.85 ! 0.5860 938:10 Ambig 4.06, 4.26 A or (resid 129 and name HD*) (resid 173 and name HN) ! 0.3470 938:10 ----- 4.44, 5.99 A assign (resid 80 and name HN) (resid 79 and name HN) 3.65 1.85 1.85 ! 0.9991 939:10 Seq 2.34, 2.53 A assign (resid 122 and name HN) (resid 123 and name HN) 2.65 0.85 0.85 ! 0.9989 940:10 Seq 2.42, 2.57 A assign (resid 77 and name HA1) (resid 79 and name HN) 3.15 1.35 1.35 ! 0.5998 943:10 Ambig 3.27, 3.80 A or (resid 8 and name HA) (resid 9 and name HN) ! 0.3882 943:10 ----- 3.52, 3.55 A assign (resid 145 and name HA) (resid 147 and name HN) 3.65 1.85 1.85 ! 0.0000 944:10 Mid 4.17, 4.43 A assign (resid 123 and name HA) (resid 123 and name HN) 2.65 0.85 0.85 ! 0.7544 946:10 Ambig 2.84, 2.86 A or (resid 120 and name HA) (resid 123 and name HN) ! 0.2398 946:10 ----- 3.44, 3.58 A assign (resid 174 and name HA1) (resid 173 and name HN) 4.15 2.35 2.35 ! 0.0000 947:10 Seq 4.56, 4.61 A assign (resid 173 and name HB*) (resid 173 and name HN) 2.65 0.85 0.85 ! 0.9852 948:10 Intra 2.41, 3.01 A assign (resid 79 and name HB2) (resid 79 and name HN) 2.65 0.85 0.85 ! 0.3320 949:10 Ambig 2.46, 2.87 A or (resid 79 and name HB1) (resid 79 and name HN) ! 0.3289 949:10 ----- 2.47, 3.10 A or (resid 78 and name HD*) (resid 79 and name HN) ! 0.2826 949:10 ----- 2.53, 3.39 A assign (resid 76 and name HB2) (resid 79 and name HN) 4.90 3.10 3.10 ! 0.0000 950:10 Mid 6.82, 7.38 A assign (resid 6 and name HB1) (resid 9 and name HN) 3.65 1.85 1.85 ! 0.9234 951:10 Mid 3.03, 3.21 A assign (resid 122 and name HB1) (resid 123 and name HN) 2.65 0.85 0.85 ! 0.9977 952:10 Seq 2.36, 2.55 A assign (resid 123 and name HG1) (resid 123 and name HN) 3.15 1.35 1.35 ! 0.9779 954:10 Intra 2.51, 2.63 A assign (resid 123 and name HG2) (resid 123 and name HN) 3.15 1.35 1.35 ! 0.9883 955:10 Intra 3.58, 3.74 A assign (resid 148 and name HB2) (resid 145 and name HN) 3.15 1.35 1.35 ! 0.7589 956:10 Ambig 1.89, 2.14 A or (resid 70 and name HG*) (resid 69 and name HN) ! 0.1852 956:10 ----- 2.39, 5.49 A assign (resid 104 and name HB1) (resid 104 and name HD21) 3.15 1.35 1.35 ! 0.8773 957:10 Ambig 2.88, 3.41 A or (resid 100 and name HB2) (resid 104 and name HD21) ! 0.1036 957:10 ----- 4.11, 4.43 A assign (resid 172 and name HB2) (resid 173 and name HN) 3.15 1.35 1.35 ! 0.9581 958:10 Seq 3.48, 3.61 A assign (resid 172 and name HG*) (resid 173 and name HN) 3.15 1.35 1.35 ! 0.0000 959:10 Seq 3.24, 4.04 A assign (resid 78 and name HG2) (resid 79 and name HN) 3.15 1.35 1.35 ! 0.5610 960:10 Ambig 3.99, 4.28 A or (resid 78 and name HG1) (resid 79 and name HN) ! 0.2803 960:10 ----- 4.48, 4.61 A or (resid 7 and name HB) (resid 9 and name HN) ! 0.1011 960:10 ----- 5.31, 5.51 A assign (resid 152 and name HB*) (resid 9 and name HN) 3.15 1.35 1.35 ! 0.0000 961:10 Long 3.06, 4.47 A assign (resid 146 and name HB2) (resid 147 and name HN) 3.15 1.35 1.35 ! 0.9911 962:10 Seq 2.67, 3.92 A assign (resid 146 and name HG*) (resid 147 and name HN) 3.15 1.35 1.35 ! 0.0000 963:10 Seq 3.68, 4.65 A assign (resid 146 and name HD*) (resid 147 and name HN) 4.15 2.35 2.35 ! 0.0000 964:10 Seq 3.85, 5.28 A assign (resid 123 and name HB1) (resid 123 and name HN) 3.15 1.35 1.35 ! 0.8130 965:10 Ambig 3.60, 3.64 A or (resid 124 and name HB2) (resid 123 and name HN) ! 0.1870 965:10 ----- 4.60, 4.75 A assign (resid 123 and name HB2) (resid 123 and name HN) 2.65 0.85 0.85 ! 0.9940 966:10 Intra 2.37, 2.44 A assign (resid 121 and name HG1) (resid 123 and name HN) 4.15 2.35 2.35 ! 0.5817 967:10 Ambig 5.74, 6.86 A or (resid 120 and name HG*) (resid 123 and name HN) ! 0.4183 967:10 ----- 6.06, 6.66 A assign (resid 70 and name HB2) (resid 69 and name HN) 4.15 2.35 2.35 ! 0.7435 968:10 Ambig 4.16, 5.81 A or (resid 43 and name HB) (resid 69 and name HN) ! 0.2316 968:10 ----- 5.05, 7.51 A assign (resid 148 and name HB1) (resid 145 and name HN) 3.15 1.35 1.35 ! 0.8887 969:10 Ambig 3.29, 3.57 A or (resid 70 and name HB1) (resid 69 and name HN) ! 0.0729 969:10 ----- 5.00, 6.51 A assign (resid 171 and name HG1*) (resid 173 and name HN) 3.15 1.35 1.35 ! 0.0000 970:10 Mid 2.77, 3.90 A assign (resid 43 and name HG1*) (resid 79 and name HN) 2.65 0.85 0.85 ! 0.8094 971:10 Ambig 2.34, 4.49 A or (resid 43 and name HG2*) (resid 79 and name HN) ! 0.1071 971:10 ----- 3.28, 5.39 A or (resid 8 and name HG2*) (resid 9 and name HN) ! 0.0687 971:10 ----- 3.53, 4.36 A assign (resid 119 and name HG2*) (resid 123 and name HN) 4.15 2.35 2.35 ! 0.0000 973:10 Mid 4.12, 4.92 A assign (resid 119 and name HD1*) (resid 123 and name HN) 3.65 1.85 1.85 ! 0.6605 974:10 Ambig 5.34, 6.29 A or (resid 119 and name HG11) (resid 123 and name HN) ! 0.2077 974:10 ----- 6.47, 7.02 A or (resid 109 and name HD1*) (resid 123 and name HN) ! 0.1318 974:10 ----- 6.98, 7.91 A assign (resid 154 and name HD1*) (resid 145 and name HN) 4.15 2.35 2.35 ! 0.0000 975:10 Long 5.65, 7.31 A assign (resid 155 and name HD1*) (resid 145 and name HN) 4.15 2.35 2.35 ! 0.0000 976:10 Long 2.62, 3.67 A assign (resid 9 and name HN) (resid 10 and name HN) 3.15 1.35 1.35 ! 0.0000 977:10 Seq 2.33, 2.38 A assign (resid 8 and name HN) (resid 10 and name HN) 3.15 1.35 1.35 ! 0.9684 978:10 Mid 3.44, 3.68 A assign (resid 98 and name HN) (resid 96 and name HN) 3.65 1.85 1.85 ! 0.7958 979:10 Ambig 4.01, 4.16 A or (resid 109 and name HN) (resid 112 and name HN) ! 0.2042 979:10 ----- 5.04, 5.14 A assign (resid 95 and name HN) (resid 96 and name HN) 2.65 0.85 0.85 ! 0.0000 980:10 Seq 2.37, 2.55 A assign (resid 97 and name HN) (resid 96 and name HN) 2.65 0.85 0.85 ! 0.0000 981:10 Seq 2.50, 2.59 A assign (resid 130 and name HN) (resid 128 and name HN) 3.65 1.85 1.85 ! 0.0000 982:10 Mid 4.16, 4.23 A assign (resid 99 and name HN) (resid 96 and name HN) 3.65 1.85 1.85 ! 0.0000 984:10 Mid 4.63, 4.84 A assign (resid 129 and name HN) (resid 128 and name HN) 2.65 0.85 0.85 ! 0.9449 985:10 Seq 2.46, 2.58 A assign (resid 100 and name HN) (resid 104 and name HD22) 4.15 2.35 2.35 ! 0.0000 986:10 Mid 6.19, 6.42 A assign (resid 6 and name HA) (resid 10 and name HN) 3.65 1.85 1.85 ! 0.0000 991:10 Mid 4.52, 4.67 A assign (resid 96 and name HB*) (resid 96 and name HN) 2.30 0.50 0.50 ! 0.4785 992:10 Ambig 2.45, 2.96 A or (resid 112 and name HB*) (resid 112 and name HN) ! 0.4047 992:10 ----- 2.52, 3.10 A or (resid 111 and name HA*) (resid 112 and name HN) ! 0.1167 992:10 ----- 3.10, 3.29 A assign (resid 128 and name HA) (resid 128 and name HN) 2.65 0.85 0.85 ! 0.7508 994:10 Ambig 2.78, 2.81 A or (resid 127 and name HA) (resid 128 and name HN) ! 0.2253 994:10 ----- 3.40, 3.45 A assign (resid 90 and name HB2) (resid 90 and name HN) 3.15 1.35 1.35 ! 0.5890 995:10 Ambig 2.49, 3.32 A or (resid 89 and name HB2) (resid 90 and name HN) ! 0.2526 995:10 ----- 2.87, 3.51 A or (resid 107 and name HA) (resid 107 and name HE22) ! 0.0994 995:10 ----- 3.35, 4.12 A assign (resid 9 and name HB1) (resid 10 and name HN) 3.15 1.35 1.35 ! 0.0000 996:10 Seq 3.90, 3.99 A assign (resid 6 and name HB1) (resid 10 and name HN) 3.65 1.85 1.85 ! 0.0000 997:10 Mid 2.56, 2.90 A assign (resid 92 and name HA2) (resid 96 and name HN) 3.15 1.35 1.35 ! 0.7861 998:10 Ambig 3.64, 4.22 A or (resid 97 and name HB*) (resid 96 and name HN) ! 0.1945 998:10 ----- 4.60, 4.86 A assign (resid 95 and name HA) (resid 96 and name HN) 2.65 0.85 0.85 ! 0.0000 999:10 Seq 3.45, 3.50 A assign (resid 127 and name HD1) (resid 128 and name HN) 3.15 1.35 1.35 ! 0.0000 1000:10 Seq 3.78, 3.87 A assign (resid 104 and name HB2) (resid 104 and name HD21) 2.65 0.85 0.85 ! 0.0000 1002:10 Intra 2.22, 2.28 A assign (resid 93 and name HB2) (resid 96 and name HN) 3.65 1.85 1.85 ! 0.6046 1004:10 Ambig 4.97, 5.56 A or (resid 93 and name HG*) (resid 96 and name HN) ! 0.3954 1004:10 ----- 5.34, 6.11 A assign (resid 88 and name HB*) (resid 90 and name HN) 3.15 1.35 1.35 ! 0.6707 1006:10 Ambig 2.52, 4.32 A or (resid 94 and name HB1) (resid 90 and name HN) ! 0.3293 1006:10 ----- 2.84, 4.37 A assign (resid 107 and name HG1) (resid 107 and name HE22) 2.65 0.85 0.85 ! 0.5218 1007:10 Ambig 3.38, 3.60 A or (resid 107 and name HG2) (resid 107 and name HE22) ! 0.4782 1007:10 ----- 3.43, 3.89 A assign (resid 107 and name HB2) (resid 107 and name HE22) 3.65 1.85 1.85 ! 0.7013 1008:10 Ambig 3.95, 4.40 A or (resid 107 and name HB1) (resid 107 and name HE22) ! 0.2573 1008:10 ----- 4.66, 5.06 A assign (resid 104 and name HB2) (resid 104 and name HD22) 3.15 1.35 1.35 ! 0.0000 1009:10 Intra 3.46, 3.49 A assign (resid 104 and name HB1) (resid 104 and name HD22) 3.15 1.35 1.35 ! 0.6943 1010:10 Ambig 3.76, 4.02 A or (resid 100 and name HB2) (resid 104 and name HD22) ! 0.2481 1010:10 ----- 4.46, 4.83 A assign (resid 95 and name HB*) (resid 96 and name HN) 2.30 0.50 0.50 ! 0.9755 1011:10 Seq 2.54, 3.21 A assign (resid 127 and name HB2) (resid 128 and name HN) 3.15 1.35 1.35 ! 0.9191 1012:10 Ambig 3.30, 3.43 A or (resid 31 and name HG2) (resid 128 and name HN) ! 0.0613 1012:10 ----- 5.17, 5.63 A assign (resid 127 and name HG2) (resid 128 and name HN) 3.15 1.35 1.35 ! 0.9712 1013:10 Seq 2.40, 2.57 A assign (resid 127 and name HG1) (resid 128 and name HN) 3.15 1.35 1.35 ! 0.5751 1014:10 Ambig 3.93, 4.04 A or (resid 127 and name HB1) (resid 128 and name HN) ! 0.4249 1014:10 ----- 4.13, 4.20 A assign (resid 8 and name HD1*) (resid 104 and name HD21) 4.15 2.35 2.35 ! 0.0000 1016:10 Long 1.96, 3.44 A assign (resid 8 and name HG2*) (resid 10 and name HN) 3.65 1.85 1.85 ! 0.4044 1017:10 Ambig 5.56, 6.46 A or (resid 7 and name HG1*) (resid 10 and name HN) ! 0.3193 1017:10 ----- 5.79, 6.76 A or (resid 7 and name HG2*) (resid 10 and name HN) ! 0.2763 1017:10 ----- 5.93, 6.75 A assign (resid 95 and name HG1) (resid 96 and name HN) 3.65 1.85 1.85 ! 0.8069 1018:10 Ambig 4.87, 4.99 A or (resid 99 and name HG2) (resid 96 and name HN) ! 0.1931 1018:10 ----- 6.18, 6.87 A assign (resid 119 and name HG11) (resid 112 and name HN) 4.90 3.10 3.10 ! 0.7972 1019:10 Ambig 5.84, 6.68 A or (resid 98 and name HG1*) (resid 96 and name HN) ! 0.2028 1019:10 ----- 7.34, 7.76 A assign (resid 128 and name HG2*) (resid 128 and name HN) 3.15 1.35 1.35 ! 0.9157 1020:10 Ambig 4.25, 4.46 A or (resid 33 and name HG) (resid 128 and name HN) ! 0.0843 1020:10 ----- 6.33, 6.61 A assign (resid 130 and name HG2*) (resid 128 and name HN) 3.65 1.85 1.85 ! 0.0000 1021:10 Mid 4.86, 6.09 A assign (resid 8 and name HD1*) (resid 104 and name HD22) 4.15 2.35 2.35 ! 0.0000 1022:10 Long 3.45, 4.39 A assign (resid 149 and name HB2) (resid 149 and name HD21) 3.15 1.35 1.35 ! 0.0000 1027:10 Intra 2.20, 2.51 A assign (resid 74 and name HB2) (resid 74 and name HD21) 3.65 1.85 1.85 ! 0.0000 1028:10 Intra 3.47, 3.54 A assign (resid 149 and name HB2) (resid 149 and name HD22) 2.65 0.85 0.85 ! 0.7271 1029:10 Ambig 3.43, 3.58 A or (resid 74 and name HB2) (resid 74 and name HD22) ! 0.2729 1029:10 ----- 4.04, 4.07 A assign (resid 149 and name HB1) (resid 149 and name HD21) 3.15 1.35 1.35 ! 0.9654 1030:10 Intra 2.19, 3.21 A assign (resid 149 and name HB1) (resid 149 and name HD22) 3.15 1.35 1.35 ! 0.6985 1031:10 Ambig 3.45, 3.91 A or (resid 151 and name HB1) (resid 149 and name HD22) ! 0.2505 1031:10 ----- 4.09, 7.62 A assign (resid 176 and name HD*) (resid 10 and name HN) 3.65 1.85 1.85 ! 0.4879 1032:10 Ambig 4.45, 6.91 A or (resid 152 and name HB*) (resid 10 and name HN) ! 0.3108 1032:10 ----- 4.80, 6.08 A or (resid 5 and name HD*) (resid 10 and name HN) ! 0.1270 1032:10 ----- 5.57, 7.12 A assign (resid 39 and name HB*) (resid 74 and name HD22) 3.15 1.35 1.35 ! 0.9991 1033:10 Long 2.07, 3.54 A assign (resid 75 and name HG2*) (resid 74 and name HD21) 2.65 0.85 0.85 ! 0.9291 1034:10 Seq 2.40, 4.19 A assign (resid 75 and name HG2*) (resid 74 and name HD22) 2.65 0.85 0.85 ! 0.9590 1035:10 Seq 2.21, 3.41 A assign (resid 75 and name HN) (resid 76 and name HN) 3.15 1.35 1.35 ! 0.0000 1036:10 Seq 2.32, 2.52 A assign (resid 77 and name HA2) (resid 77 and name HN) 3.15 1.35 1.35 ! 0.9989 1038:10 Intra 2.29, 2.43 A assign (resid 77 and name HA1) (resid 77 and name HN) 2.65 0.85 0.85 ! 0.9475 1039:10 Intra 2.20, 2.52 A assign (resid 78 and name HD*) (resid 77 and name HN) 3.65 1.85 1.85 ! 0.9933 1040:10 Seq 2.74, 4.00 A assign (resid 80 and name HB*) (resid 77 and name HN) 3.65 1.85 1.85 ! 0.9134 1041:10 Ambig 3.84, 6.10 A or (resid 166 and name HD2) (resid 77 and name HN) ! 0.0599 1041:10 ----- 6.05, 7.32 A assign (resid 76 and name HA) (resid 76 and name HN) 3.15 1.35 1.35 ! 0.9275 1042:10 Intra 2.78, 2.83 A assign (resid 73 and name HB*) (resid 77 and name HN) 3.15 1.35 1.35 ! 0.8005 1043:10 Ambig 3.52, 4.75 A or (resid 81 and name HB*) (resid 77 and name HN) ! 0.1995 1043:10 ----- 4.43, 5.98 A assign (resid 74 and name HB1) (resid 74 and name HD21) 4.15 2.35 2.35 ! 0.9970 1044:10 Intra 2.28, 2.62 A assign (resid 75 and name HB) (resid 76 and name HN) 3.15 1.35 1.35 ! 0.9977 1045:10 Seq 2.18, 2.60 A assign (resid 78 and name HG1) (resid 77 and name HN) 3.65 1.85 1.85 ! 0.6923 1046:10 Ambig 4.71, 5.40 A or (resid 78 and name HG2) (resid 77 and name HN) ! 0.3077 1046:10 ----- 5.39, 6.10 A assign (resid 75 and name HB) (resid 77 and name HN) 3.65 1.85 1.85 ! 0.8320 1047:10 Ambig 4.45, 4.89 A or (resid 166 and name HG2) (resid 77 and name HN) ! 0.1155 1047:10 ----- 6.19, 7.48 A assign (resid 75 and name HG2*) (resid 76 and name HN) 3.15 1.35 1.35 ! 0.7647 1048:10 Ambig 3.44, 4.59 A or (resid 36 and name HG1*) (resid 76 and name HN) ! 0.0755 1048:10 ----- 5.07, 6.63 A or (resid 18 and name HD1*) (resid 76 and name HN) ! 0.0705 1048:10 ----- 5.12, 6.40 A or (resid 18 and name HD2*) (resid 76 and name HN) ! 0.0653 1048:10 ----- 5.19, 6.53 A assign (resid 41 and name HG2*) (resid 77 and name HN) 3.65 1.85 1.85 ! 0.3457 1049:10 Ambig 5.09, 5.90 A or (resid 75 and name HG2*) (resid 77 and name HN) ! 0.2758 1049:10 ----- 5.29, 6.44 A or (resid 18 and name HD2*) (resid 77 and name HN) ! 0.2257 1049:10 ----- 5.47, 6.74 A or (resid 18 and name HD1*) (resid 77 and name HN) ! 0.1529 1049:10 ----- 5.84, 7.20 A assign (resid 39 and name HB*) (resid 74 and name HD21) 3.15 1.35 1.35 ! 0.9804 1050:10 Long 1.83, 3.47 A assign (resid 75 and name HG1*) (resid 76 and name HN) 3.65 1.85 1.85 ! 0.0000 1051:10 Seq 3.47, 4.49 A assign (resid 173 and name HN) (resid 174 and name HN) 3.65 1.85 1.85 ! 0.0000 1052:10 Seq 2.32, 2.46 A assign (resid 175 and name HN) (resid 174 and name HN) 2.65 0.85 0.85 ! 0.9911 1053:10 Seq 2.07, 2.25 A assign (resid 175 and name HD*) (resid 174 and name HN) 3.15 1.35 1.35 ! 0.9783 1054:10 Seq 3.44, 5.39 A assign (resid 111 and name HA*) (resid 111 and name HN) 3.65 1.85 1.85 ! 0.8182 1055:10 Ambig 2.25, 2.58 A or (resid 107 and name HA) (resid 111 and name HN) ! 0.0923 1055:10 ----- 3.24, 3.81 A or (resid 110 and name HA) (resid 111 and name HN) ! 0.0737 1055:10 ----- 3.37, 3.47 A assign (resid 173 and name HB*) (resid 174 and name HN) 2.65 0.85 0.85 ! 0.5283 1056:10 Ambig 2.83, 3.83 A or (resid 174 and name HA2) (resid 174 and name HN) ! 0.4717 1056:10 ----- 2.88, 2.92 A assign (resid 174 and name HA1) (resid 174 and name HN) 2.65 0.85 0.85 ! 0.9971 1057:10 Intra 2.29, 2.39 A assign (resid 171 and name HG2*) (resid 174 and name HN) 3.65 1.85 1.85 ! 0.0000 1058:10 Mid 5.12, 5.50 A assign (resid 171 and name HG1*) (resid 174 and name HN) 2.65 0.85 0.85 ! 0.0000 1059:10 Mid 1.78, 2.91 A assign (resid 105 and name HG2*) (resid 174 and name HN) 4.15 2.35 2.35 ! 0.0000 1060:10 Long 5.25, 6.44 A assign (resid 105 and name HG1*) (resid 174 and name HN) 3.65 1.85 1.85 ! 0.0000 1061:10 Long 4.35, 5.22 A assign (resid 129 and name HD*) (resid 32 and name HN) 4.15 2.35 2.35 ! 0.0000 1062:10 Long 5.52, 7.63 A assign (resid 33 and name HN) (resid 32 and name HN) 3.15 1.35 1.35 ! 0.9779 1063:10 Seq 2.29, 2.46 A assign (resid 8 and name HA) (resid 153 and name HN) 3.65 1.85 1.85 ! 0.8717 1066:10 Ambig 5.07, 5.43 A or (resid 171 and name HA) (resid 32 and name HN) ! 0.1283 1066:10 ----- 6.98, 7.25 A assign (resid 32 and name HA1) (resid 32 and name HN) 2.65 0.85 0.85 ! 0.4122 1067:10 Ambig 2.82, 2.89 A or (resid 153 and name HA1) (resid 153 and name HN) ! 0.3458 1067:10 ----- 2.90, 2.91 A or (resid 9 and name HB1) (resid 153 and name HN) ! 0.2419 1067:10 ----- 3.08, 3.38 A assign (resid 31 and name HB1) (resid 32 and name HN) 3.15 1.35 1.35 ! 0.8664 1068:10 Ambig 3.70, 3.82 A or (resid 148 and name HB2) (resid 153 and name HN) ! 0.0408 1068:10 ----- 6.15, 6.57 A or (resid 22 and name HB2) (resid 32 and name HN) ! 0.0359 1068:10 ----- 6.28, 7.04 A assign (resid 8 and name HB) (resid 153 and name HN) 3.15 1.35 1.35 ! 0.9808 1069:10 Long 2.13, 2.50 A assign (resid 31 and name HB2) (resid 32 and name HN) 2.65 0.85 0.85 ! 0.9206 1070:10 Seq 3.08, 3.36 A assign (resid 152 and name HB*) (resid 153 and name HN) 2.65 0.85 0.85 ! 0.9637 1071:10 Seq 3.39, 4.13 A assign (resid 33 and name HG) (resid 32 and name HN) 3.65 1.85 1.85 ! 0.5157 1072:10 Ambig 4.58, 4.79 A or (resid 128 and name HG2*) (resid 32 and name HN) ! 0.1975 1072:10 ----- 5.37, 6.61 A or (resid 30 and name HB) (resid 32 and name HN) ! 0.1088 1072:10 ----- 5.93, 6.21 A or (resid 23 and name HB) (resid 32 and name HN) ! 0.0908 1072:10 ----- 6.11, 6.54 A or (resid 154 and name HG) (resid 153 and name HN) ! 0.0872 1072:10 ----- 6.16, 6.69 A assign (resid 8 and name HG2*) (resid 153 and name HN) 3.15 1.35 1.35 ! 0.9602 1073:10 Long 2.90, 3.95 A assign (resid 86 and name HN) (resid 85 and name HN) 4.15 2.35 2.35 ! 0.0000 1074:10 Seq 4.41, 4.52 A assign (resid 175 and name HN) (resid 172 and name HN) 3.65 1.85 1.85 ! 0.0000 1075:10 Mid 4.83, 5.03 A assign (resid 33 and name HN) (resid 172 and name HN) 4.15 2.35 2.35 ! 0.6819 1076:10 Ambig 4.05, 4.21 A or (resid 175 and name HD*) (resid 172 and name HN) ! 0.3181 1076:10 ----- 4.60, 6.68 A assign (resid 173 and name HN) (resid 172 and name HN) 3.65 1.85 1.85 ! 0.0000 1077:10 Seq 2.57, 2.72 A assign (resid 19 and name HE*) (resid 20 and name HN) 3.65 1.85 1.85 ! 0.0000 1078:10 Seq 3.58, 5.69 A assign (resid 152 and name HB*) (resid 97 and name HE1) 4.90 3.10 3.10 ! 0.0000 1079:10 Long 4.47, 5.38 A assign (resid 10 and name HA*) (resid 6 and name HN) 4.15 2.35 2.35 ! 0.7869 1080:10 Ambig 3.97, 4.99 A or (resid 7 and name HA) (resid 6 and name HN) ! 0.1481 1080:10 ----- 5.25, 5.43 A assign (resid 114 and name HB) (resid 115 and name HN) 3.15 1.35 1.35 ! 0.6720 1082:10 Ambig 3.66, 3.79 A or (resid 119 and name HG12) (resid 115 and name HN) ! 0.3280 1082:10 ----- 4.12, 4.45 A assign (resid 118 and name HB1) (resid 115 and name HN) 3.65 1.85 1.85 ! 0.0000 1083:10 Mid 4.16, 4.61 A assign (resid 118 and name HB2) (resid 115 and name HN) 3.65 1.85 1.85 ! 0.0000 1084:10 Mid 2.94, 3.35 A assign (resid 31 and name HD1) (resid 30 and name HN) 3.65 1.85 1.85 ! 0.0000 1085:10 Seq 4.26, 4.54 A assign (resid 155 and name HN) (resid 156 and name HN) 3.65 1.85 1.85 ! 0.5470 1087:10 Ambig 4.36, 4.46 A or (resid 157 and name HN) (resid 156 and name HN) ! 0.4530 1087:10 ----- 4.50, 4.54 A assign (resid 169 and name HN) (resid 156 and name HN) 3.65 1.85 1.85 ! 0.0000 1088:10 Long 3.87, 4.22 A assign (resid 169 and name HG2*) (resid 156 and name HN) 3.65 1.85 1.85 ! 0.8071 1089:10 Ambig 5.50, 6.32 A or (resid 140 and name HB2) (resid 156 and name HN) ! 0.1929 1089:10 ----- 6.98, 7.69 A assign (resid 120 and name HN) (resid 119 and name HN) 2.65 0.85 0.85 ! 0.9724 1091:10 Seq 2.58, 2.72 A assign (resid 97 and name HN) (resid 99 and name HN) 3.65 1.85 1.85 ! 0.7357 1092:10 Ambig 3.97, 4.17 A or (resid 102 and name HN) (resid 99 and name HN) ! 0.2643 1092:10 ----- 4.71, 4.89 A assign (resid 19 and name HB1) (resid 21 and name HN) 3.65 1.85 1.85 ! 0.9594 1093:10 Mid 4.54, 5.39 A assign (resid 35 and name HB2) (resid 21 and name HN) 4.15 2.35 2.35 ! 0.0000 1094:10 Long 5.22, 5.93 A assign (resid 165 and name HB2) (resid 73 and name HD21) 3.65 1.85 1.85 ! 0.9951 1095:10 Long 2.49, 3.79 A assign (resid 73 and name HB*) (resid 73 and name HD21) 3.15 1.35 1.35 ! 0.9974 1096:10 Intra 2.19, 2.55 A assign (resid 6 and name HB2) (resid 10 and name HN) 3.65 1.85 1.85 ! 0.0000 1097:10 Mid 4.22, 4.53 A assign (resid 8 and name HB) (resid 10 and name HN) 3.65 1.85 1.85 ! 0.7798 1098:10 Ambig 4.38, 4.67 A or (resid 7 and name HB) (resid 10 and name HN) ! 0.1689 1098:10 ----- 5.65, 5.98 A assign (resid 110 and name HB*) (resid 111 and name HN) 4.15 2.35 2.35 ! 0.9968 1100:10 Seq 2.49, 3.67 A assign (resid 5 and name HE*) (resid 12 and name HN) 4.15 2.35 2.35 ! 0.6152 1102:10 Ambig 4.74, 6.49 A or (resid 104 and name HB2) (resid 8 and name HN) ! 0.3848 1102:10 ----- 5.12, 5.49 A assign (resid 8 and name HD1*) (resid 8 and name HN) 3.65 1.85 1.85 ! 0.9180 1103:10 Ambig 3.04, 3.90 A or (resid 3 and name HG2*) (resid 12 and name HN) ! 0.0384 1103:10 ----- 5.16, 5.99 A assign (resid 11 and name HB*) (resid 12 and name HN) 3.15 1.35 1.35 ! 0.9920 1104:10 Seq 1.89, 3.25 A assign (resid 7 and name HG1*) (resid 8 and name HN) 3.65 1.85 1.85 ! 0.3891 1105:10 Ambig 4.01, 4.79 A or (resid 7 and name HG2*) (resid 8 and name HN) ! 0.3267 1105:10 ----- 4.12, 4.82 A or (resid 8 and name HG2*) (resid 8 and name HN) ! 0.2232 1105:10 ----- 4.39, 4.57 A assign (resid 20 and name HD1*) (resid 15 and name HN) 3.65 1.85 1.85 ! 0.9803 1107:10 Long 3.63, 5.12 A assign (resid 75 and name HG1*) (resid 15 and name HN) 3.65 1.85 1.85 ! 0.0000 1108:10 Long 4.33, 5.86 A assign (resid 17 and name HB*) (resid 15 and name HN) 3.65 1.85 1.85 ! 0.8406 1109:10 Ambig 4.67, 5.98 A or (resid 20 and name HB) (resid 15 and name HN) ! 0.0837 1109:10 ----- 6.85, 7.30 A assign (resid 4 and name HD*) (resid 16 and name HN) 3.65 1.85 1.85 ! 0.0000 1110:10 Long 3.93, 7.09 A assign (resid 4 and name HE*) (resid 16 and name HN) 4.15 2.35 2.35 ! 0.0000 1111:10 Long 3.63, 7.40 A assign (resid 3 and name HB) (resid 16 and name HN) 3.65 1.85 1.85 ! 0.9936 1112:10 Long 3.23, 4.41 A assign (resid 2 and name HD1*) (resid 16 and name HN) 4.15 2.35 2.35 ! 0.0000 1113:10 Long 5.34, 6.83 A assign (resid 18 and name HB2) (resid 19 and name HN) 3.15 1.35 1.35 ! 0.0000 1114:10 Seq 2.73, 3.27 A assign (resid 20 and name HB) (resid 19 and name HN) 4.15 2.35 2.35 ! 0.6491 1115:10 Ambig 6.04, 6.30 A or (resid 17 and name HB*) (resid 19 and name HN) ! 0.3509 1115:10 ----- 6.69, 7.44 A assign (resid 19 and name HG*) (resid 19 and name HN) 3.15 1.35 1.35 ! 0.9535 1116:10 Intra 2.31, 3.90 A assign (resid 30 and name HN) (resid 23 and name HN) 3.65 1.85 1.85 ! 0.0000 1117:10 Long 3.30, 3.81 A assign (resid 30 and name HN) (resid 25 and name HN) 3.65 1.85 1.85 ! 0.0000 1118:10 Long 3.78, 4.08 A assign (resid 172 and name HE*) (resid 33 and name HN) 3.65 1.85 1.85 ! 0.0000 1119:10 Long 2.82, 4.42 A assign (resid 35 and name HA) (resid 35 and name HN) 3.65 1.85 1.85 ! 0.0000 1120:10 Intra 2.91, 2.92 A assign (resid 34 and name HN) (resid 35 and name HN) 4.15 2.35 2.35 ! 0.0000 1121:10 Seq 4.17, 4.28 A assign (resid 74 and name HD21) (resid 39 and name HN) 3.65 1.85 1.85 ! 0.0000 1122:10 Long 2.25, 2.64 A assign (resid 43 and name HN) (resid 72 and name HN) 3.65 1.85 1.85 ! 0.7072 1123:10 Ambig 3.57, 4.02 A or (resid 71 and name HN) (resid 72 and name HN) ! 0.2928 1123:10 ----- 4.14, 4.30 A assign (resid 75 and name HA) (resid 76 and name HN) 3.65 1.85 1.85 ! 0.6298 1125:10 Ambig 3.52, 3.57 A or (resid 74 and name HA) (resid 76 and name HN) ! 0.1843 1125:10 ----- 4.31, 4.64 A or (resid 77 and name HA1) (resid 76 and name HN) ! 0.1442 1125:10 ----- 4.49, 4.66 A assign (resid 76 and name HB2) (resid 76 and name HN) 3.65 1.85 1.85 ! 0.0000 1126:10 Intra 3.41, 3.47 A assign (resid 105 and name HG1*) (resid 107 and name HN) 3.65 1.85 1.85 ! 0.0000 1127:10 Mid 5.17, 6.11 A assign (resid 65 and name HB*) (resid 67 and name HN) 3.65 1.85 1.85 ! 0.8450 1128:10 Ambig 2.47, 5.32 A or (resid 68 and name HB*) (resid 67 and name HN) ! 0.1550 1128:10 ----- 3.28, 5.91 A assign (resid 110 and name HG*) (resid 110 and name HN) 2.30 0.50 0.50 ! 0.9650 1129:10 Intra 1.95, 2.83 A assign (resid 122 and name HN) (resid 120 and name HN) 3.15 1.35 1.35 ! 0.5286 1130:10 Ambig 3.80, 3.91 A or (resid 118 and name HN) (resid 120 and name HN) ! 0.4714 1130:10 ----- 3.88, 4.00 A assign (resid 133 and name HB2) (resid 130 and name HN) 3.65 1.85 1.85 ! 0.5770 1131:10 Ambig 4.95, 5.27 A or (resid 127 and name HB2) (resid 130 and name HN) ! 0.3498 1131:10 ----- 5.38, 5.49 A assign (resid 126 and name HA) (resid 130 and name HN) 3.65 1.85 1.85 ! 0.0000 1132:10 Mid 4.56, 4.69 A assign (resid 129 and name HB1) (resid 130 and name HN) 3.65 1.85 1.85 ! 0.0000 1133:10 Seq 3.34, 3.39 A assign (resid 133 and name HN) (resid 131 and name HN) 3.65 1.85 1.85 ! 0.0000 1134:10 Mid 4.11, 4.19 A assign (resid 158 and name HD*) (resid 158 and name HN) 2.65 0.85 0.85 ! 0.9933 1135:10 Intra 2.08, 3.84 A assign (resid 140 and name HG) (resid 138 and name HN) 3.65 1.85 1.85 ! 0.0000 1137:10 Mid 4.34, 4.53 A assign (resid 156 and name HB1) (resid 141 and name HN) 3.65 1.85 1.85 ! 0.0000 1138:10 Long 4.91, 5.34 A assign (resid 140 and name HG) (resid 141 and name HN) 3.65 1.85 1.85 ! 0.0000 1139:10 Seq 4.78, 4.97 A assign (resid 143 and name HN) (resid 142 and name HN) 3.65 1.85 1.85 ! 0.9487 1140:10 Seq 4.13, 4.39 A assign (resid 140 and name HB1) (resid 142 and name HN) 4.15 2.35 2.35 ! 0.4764 1141:10 Ambig 4.99, 5.55 A or (resid 154 and name HD1*) (resid 142 and name HN) ! 0.4430 1141:10 ----- 5.05, 6.52 A or (resid 140 and name HD2*) (resid 142 and name HN) ! 0.0806 1141:10 ----- 6.70, 7.93 A assign (resid 141 and name HG1) (resid 142 and name HN) 3.65 1.85 1.85 ! 0.9928 1142:10 Seq 2.41, 4.24 A assign (resid 143 and name HD*) (resid 144 and name HN) 3.65 1.85 1.85 ! 0.0000 1143:10 Seq 3.24, 4.52 A assign (resid 154 and name HD1*) (resid 144 and name HN) 3.65 1.85 1.85 ! 0.0000 1144:10 Long 4.49, 5.93 A assign (resid 83 and name HB1) (resid 144 and name HN) 3.65 1.85 1.85 ! 0.9920 1145:10 Long 3.19, 3.74 A assign (resid 84 and name HB) (resid 144 and name HN) 3.65 1.85 1.85 ! 0.9910 1146:10 Long 3.12, 3.48 A assign (resid 145 and name HB*) (resid 145 and name HN) 3.65 1.85 1.85 ! 0.0000 1147:10 Intra 2.61, 3.18 A assign (resid 144 and name HN) (resid 145 and name HN) 3.65 1.85 1.85 ! 0.9413 1148:10 Seq 4.18, 4.29 A assign (resid 155 and name HB) (resid 145 and name HN) 4.15 2.35 2.35 ! 0.0000 1149:10 Long 4.79, 5.29 A assign (resid 146 and name HG*) (resid 148 and name HN) 4.15 2.35 2.35 ! 0.0000 1151:10 Mid 5.27, 6.07 A assign (resid 149 and name HB2) (resid 153 and name HN) 4.90 3.10 3.10 ! 0.0000 1152:10 Mid 5.24, 5.67 A assign (resid 152 and name HA) (resid 153 and name HN) 3.15 1.35 1.35 ! 0.9988 1153:10 Seq 2.12, 2.17 A assign (resid 142 and name HB1) (resid 155 and name HN) 3.65 1.85 1.85 ! 0.6548 1154:10 Ambig 3.77, 4.19 A or (resid 143 and name HB1) (resid 155 and name HN) ! 0.2059 1154:10 ----- 4.57, 4.84 A or (resid 144 and name HB*) (resid 155 and name HN) ! 0.1169 1154:10 ----- 5.03, 5.61 A assign (resid 154 and name HG) (resid 155 and name HN) 3.65 1.85 1.85 ! 0.0000 1155:10 Seq 3.34, 3.49 A assign (resid 142 and name HD*) (resid 155 and name HN) 3.65 1.85 1.85 ! 0.8628 1156:10 Ambig 4.28, 6.27 A or (resid 156 and name HD*) (resid 155 and name HN) ! 0.1018 1156:10 ----- 6.10, 6.85 A assign (resid 154 and name HN) (resid 156 and name HN) 4.90 3.10 3.10 ! 0.0000 1157:10 Mid 6.38, 6.55 A assign (resid 169 and name HB) (resid 157 and name HN) 3.65 1.85 1.85 ! 0.9012 1158:10 Ambig 3.93, 4.18 A or (resid 141 and name HG2) (resid 157 and name HN) ! 0.0988 1158:10 ----- 5.68, 6.33 A assign (resid 157 and name HB1) (resid 157 and name HN) 3.15 1.35 1.35 ! 0.0000 1159:10 Intra 2.88, 3.64 A assign (resid 166 and name HA) (resid 160 and name HN) 3.65 1.85 1.85 ! 0.0000 1160:10 Long 4.19, 4.83 A assign (resid 159 and name HD*) (resid 167 and name HN) 3.65 1.85 1.85 ! 0.7888 1161:10 Ambig 3.60, 5.08 A or (resid 158 and name HD*) (resid 167 and name HN) ! 0.2112 1161:10 ----- 4.48, 5.61 A assign (resid 163 and name HB*) (resid 167 and name HN) 3.65 1.85 1.85 ! 0.5838 1162:10 Ambig 4.08, 5.09 A or (resid 160 and name HG*) (resid 167 and name HN) ! 0.4162 1162:10 ----- 4.32, 6.83 A assign (resid 158 and name HN) (resid 169 and name HN) 3.65 1.85 1.85 ! 0.0000 1163:10 Long 4.13, 4.61 A assign (resid 168 and name HN) (resid 169 and name HN) 3.65 1.85 1.85 ! 0.8926 1164:10 Ambig 4.40, 4.51 A or (resid 167 and name HN) (resid 169 and name HN) ! 0.1074 1164:10 ----- 6.26, 6.54 A assign (resid 169 and name HN) (resid 170 and name HN) 3.65 1.85 1.85 ! 0.5843 1165:10 Ambig 4.10, 4.26 A or (resid 36 and name HN) (resid 170 and name HN) ! 0.3971 1165:10 ----- 4.37, 4.83 A assign (resid 133 and name HD2*) (resid 170 and name HN) 3.65 1.85 1.85 ! 0.5276 1166:10 Ambig 5.20, 6.31 A or (resid 155 and name HG2*) (resid 170 and name HN) ! 0.2440 1166:10 ----- 5.91, 7.12 A or (resid 33 and name HD1*) (resid 170 and name HN) ! 0.2284 1166:10 ----- 5.98, 7.51 A assign (resid 170 and name HB2) (resid 171 and name HN) 3.65 1.85 1.85 ! 0.9643 1167:10 Seq 3.48, 3.74 A assign (resid 172 and name HE*) (resid 174 and name HN) 4.15 2.35 2.35 ! 0.0000 1168:10 Mid 5.69, 6.37 A assign (resid 171 and name HB) (resid 174 and name HN) 3.65 1.85 1.85 ! 0.9920 1169:10 Mid 3.13, 3.50 A assign (resid 172 and name HB1) (resid 174 and name HN) 3.65 1.85 1.85 ! 0.0000 1170:10 Mid 4.28, 4.37 A assign (resid 7 and name HN) (resid 175 and name HN) 4.15 2.35 2.35 ! 0.0000 1171:10 Long 6.08, 6.44 A assign (resid 5 and name HN) (resid 175 and name HN) 4.90 3.10 3.10 ! 0.0000 1172:10 Long 6.20, 6.60 A assign (resid 176 and name HB*) (resid 175 and name HN) 4.15 2.35 2.35 ! 0.5420 1173:10 Ambig 6.07, 6.91 A or (resid 177 and name HB) (resid 175 and name HN) ! 0.3127 1173:10 ----- 6.65, 7.22 A or (resid 105 and name HB) (resid 175 and name HN) ! 0.1453 1173:10 ----- 7.56, 7.78 A assign (resid 105 and name HG1*) (resid 175 and name HN) 4.15 2.35 2.35 ! 0.0000 1174:10 Long 4.81, 5.93 A assign (resid 7 and name HN) (resid 176 and name HN) 3.65 1.85 1.85 ! 0.9551 1175:10 Long 4.22, 4.46 A assign (resid 177 and name HN) (resid 176 and name HN) 3.65 1.85 1.85 ! 0.0000 1176:10 Seq 4.09, 4.25 A assign (resid 175 and name HN) (resid 176 and name HN) 3.65 1.85 1.85 ! 0.0000 1177:10 Seq 4.42, 4.47 A assign (resid 10 and name HA*) (resid 176 and name HN) 4.15 2.35 2.35 ! 0.7581 1179:10 Ambig 5.91, 7.34 A or (resid 172 and name HA) (resid 176 and name HN) ! 0.2419 1179:10 ----- 7.15, 7.55 A assign (resid 177 and name HG1*) (resid 179 and name HN) 4.15 2.35 2.35 ! 0.6005 1181:10 Ambig 4.01, 5.66 A or (resid 2 and name HG2*) (resid 179 and name HN) ! 0.3995 1181:10 ----- 4.29, 6.18 A assign (resid 178 and name HG1*) (resid 180 and name HN) 3.65 1.85 1.85 ! 0.0000 1182:10 Mid 3.64, 5.12 A assign (resid 3 and name HB) (resid 180 and name HN) 3.15 1.35 1.35 ! 0.6395 1183:10 Ambig 4.18, 4.84 A or (resid 178 and name HB) (resid 180 and name HN) ! 0.3605 1183:10 ----- 4.60, 5.16 A assign (resid 2 and name HG2*) (resid 180 and name HN) 3.65 1.85 1.85 ! 0.8853 1184:10 Ambig 4.53, 6.23 A or (resid 177 and name HG1*) (resid 180 and name HN) ! 0.1147 1184:10 ----- 6.37, 7.57 A assign (resid 97 and name HZ2) (resid 97 and name HE1) 2.65 0.85 0.85 ! 0.0000 1186:10 Intra 2.84, 2.87 A assign (resid 172 and name HA) (resid 172 and name HN) 3.15 1.35 1.35 ! 0.9572 1187:10 Intra 2.75, 2.85 A assign (resid 35 and name HB2) (resid 132 and name HE1) 4.15 2.35 2.35 ! 0.0000 1188:10 Long 5.35, 6.16 A assign (resid 29 and name HG1) (resid 30 and name HN) 3.65 1.85 1.85 ! 0.8699 1189:10 Ambig 3.65, 3.82 A or (resid 28 and name HB2) (resid 30 and name HN) ! 0.0657 1189:10 ----- 5.61, 5.91 A assign (resid 37 and name HB1) (resid 37 and name HN) 2.65 0.85 0.85 ! 0.9972 1190:10 Intra 2.30, 2.49 A assign (resid 114 and name HG2*) (resid 115 and name HN) 3.15 1.35 1.35 ! 0.0000 1191:10 Seq 4.09, 4.85 A assign (resid 97 and name HA) (resid 97 and name HN) 2.65 0.85 0.85 ! 0.7414 1192:10 Ambig 2.76, 2.80 A or (resid 96 and name HA) (resid 97 and name HN) ! 0.1803 1192:10 ----- 3.49, 3.53 A assign (resid 5 and name HG2) (resid 5 and name HN) 3.15 1.35 1.35 ! 0.7054 1193:10 Ambig 2.62, 3.70 A or (resid 176 and name HG*) (resid 5 and name HN) ! 0.2946 1193:10 ----- 3.03, 4.79 A assign (resid 103 and name HN) (resid 101 and name HN) 3.15 1.35 1.35 ! 0.6774 1194:10 Ambig 3.83, 3.98 A or (resid 101 and name HD*) (resid 101 and name HN) ! 0.3226 1194:10 ----- 4.33, 4.69 A assign (resid 12 and name HG*) (resid 12 and name HN) 2.65 0.85 0.85 ! 0.0000 1195:10 Intra 2.17, 3.34 A assign (resid 93 and name HB2) (resid 94 and name HN) 2.65 0.85 0.85 ! 0.5373 1196:10 Ambig 2.19, 3.27 A or (resid 93 and name HG*) (resid 94 and name HN) ! 0.4080 1196:10 ----- 2.29, 4.30 A assign (resid 71 and name HB2) (resid 71 and name HN) 3.15 1.35 1.35 ! 0.9973 1197:10 Intra 2.37, 2.57 A assign (resid 97 and name HE3) (resid 98 and name HN) 3.15 1.35 1.35 ! 0.9778 1198:10 Seq 2.67, 2.91 A assign (resid 82 and name HN) (resid 81 and name HN) 2.65 0.85 0.85 ! 0.9828 1199:10 Seq 2.12, 2.30 A assign (resid 40 and name HB1) (resid 41 and name HN) 3.15 1.35 1.35 ! 0.9401 1201:10 Seq 2.76, 3.27 A assign (resid 33 and name HD2*) (resid 129 and name HN) 3.15 1.35 1.35 ! 0.0000 1202:10 Long 4.44, 5.57 A assign (resid 119 and name HD1*) (resid 114 and name HN) 2.30 0.50 0.50 ! 0.5194 1203:10 Ambig 2.38, 3.76 A or (resid 136 and name HG2) (resid 136 and name HN) ! 0.4603 1203:10 ----- 2.42, 3.36 A assign (resid 136 and name HB2) (resid 136 and name HN) 2.30 0.50 0.50 ! 0.9828 1204:10 Intra 2.30, 2.49 A assign (resid 100 and name HN) (resid 102 and name HN) 3.65 1.85 1.85 ! 0.0000 1205:10 Mid 4.25, 4.44 A assign (resid 120 and name HA) (resid 121 and name HN) 2.65 0.85 0.85 ! 0.6882 1206:10 Ambig 3.47, 3.52 A or (resid 117 and name HA) (resid 121 and name HN) ! 0.2986 1206:10 ----- 3.99, 4.62 A assign (resid 159 and name HB2) (resid 159 and name HN) 2.65 0.85 0.85 ! 0.0000 1207:10 Intra 2.35, 2.50 A assign (resid 71 and name HG1) (resid 72 and name HN) 3.15 1.35 1.35 ! 0.7015 1208:10 Ambig 3.76, 4.58 A or (resid 71 and name HD*) (resid 72 and name HN) ! 0.2985 1208:10 ----- 4.34, 5.61 A assign (resid 141 and name HG2) (resid 142 and name HN) 3.15 1.35 1.35 ! 0.9808 1209:10 Seq 2.55, 3.85 A assign (resid 132 and name HB2) (resid 133 and name HN) 3.15 1.35 1.35 ! 0.8798 1212:10 Ambig 3.90, 4.02 A or (resid 129 and name HB2) (resid 133 and name HN) ! 0.1202 1212:10 ----- 5.43, 5.76 A assign (resid 137 and name HB2) (resid 138 and name HN) 3.15 1.35 1.35 ! 0.9704 1213:10 Seq 3.73, 3.95 A assign (resid 12 and name HB2) (resid 14 and name HN) 3.15 1.35 1.35 ! 0.5028 1214:10 Ambig 4.30, 4.80 A or (resid 4 and name HB1) (resid 14 and name HN) ! 0.4972 1214:10 ----- 4.30, 4.54 A assign (resid 130 and name HG1*) (resid 134 and name HN) 3.15 1.35 1.35 ! 0.5435 1215:10 Ambig 4.25, 5.30 A or (resid 133 and name HD1*) (resid 134 and name HN) ! 0.2798 1215:10 ----- 4.75, 5.67 A or (resid 155 and name HB) (resid 84 and name HN) ! 0.0615 1215:10 ----- 6.11, 6.58 A or (resid 130 and name HG2*) (resid 134 and name HN) ! 0.0517 1215:10 ----- 6.29, 7.10 A assign (resid 95 and name HG2) (resid 96 and name HN) 3.15 1.35 1.35 ! 0.7620 1216:10 Ambig 4.09, 4.28 A or (resid 95 and name HD*) (resid 96 and name HN) ! 0.2380 1216:10 ----- 4.96, 5.47 A assign (resid 73 and name HB*) (resid 76 and name HN) 3.15 1.35 1.35 ! 0.9775 1217:10 Mid 2.48, 3.71 A assign (resid 76 and name HA) (resid 77 and name HN) 3.15 1.35 1.35 ! 0.9154 1218:10 Ambig 3.34, 3.46 A or (resid 83 and name HB2) (resid 77 and name HN) ! 0.0598 1218:10 ----- 5.26, 5.93 A assign (resid 109 and name HD1*) (resid 174 and name HN) 3.15 1.35 1.35 ! 0.8960 1219:10 Ambig 4.43, 5.44 A or (resid 7 and name HG2*) (resid 174 and name HN) ! 0.1040 1219:10 ----- 6.34, 6.95 A assign (resid 125 and name HA) (resid 126 and name HN) 3.65 1.85 1.85 ! 0.0000 1221:10 Seq 3.40, 3.46 A assign (resid 76 and name HB2) (resid 77 and name HN) 3.15 1.35 1.35 ! 0.0000 1222:10 Seq 2.98, 3.50 A assign (resid 19 and name HD*) (resid 20 and name HN) 3.15 1.35 1.35 ! 0.9804 1223:10 Seq 2.79, 5.43 A assign (resid 131 and name HB1) (resid 132 and name HN) 2.65 0.85 0.85 ! 0.0000 1224:10 Seq 2.34, 2.76 A assign (resid 169 and name HN) (resid 157 and name HA) 4.15 2.35 2.35 ! 0.9972 0:20 Long 2.27, 2.69 A assign (resid 158 and name HN) (resid 157 and name HA) 2.65 0.85 0.85 ! 0.0000 1:20 Seq 2.25, 2.33 A assign (resid 158 and name HD*) (resid 157 and name HA) 3.65 1.85 1.85 ! 0.0000 2:20 Seq 3.07, 5.26 A assign (resid 4 and name HD*) (resid 15 and name HA) 3.65 1.85 1.85 ! 0.0000 3:20 Long 2.81, 5.63 A assign (resid 168 and name HA) (resid 157 and name HA) 2.65 0.85 0.85 ! 0.9726 5:20 Long 2.22, 2.51 A assign (resid 15 and name HB2) (resid 15 and name HA) 3.65 1.85 1.85 ! 0.0000 6:20 Intra 2.49, 2.52 A assign (resid 157 and name HB2) (resid 157 and name HA) 3.65 1.85 1.85 ! 0.0000 8:20 Intra 2.48, 2.87 A assign (resid 157 and name HB1) (resid 157 and name HA) 3.15 1.35 1.35 ! 0.0000 9:20 Intra 2.42, 2.56 A assign (resid 136 and name HB1) (resid 157 and name HA) 4.15 2.35 2.35 ! 0.5600 10:20 Ambig 6.25, 6.82 A or (resid 155 and name HB) (resid 157 and name HA) ! 0.4400 10:20 ----- 6.50, 6.67 A assign (resid 140 and name HD2*) (resid 157 and name HA) 4.15 2.35 2.35 ! 0.8766 11:20 Ambig 3.29, 4.22 A or (resid 140 and name HB1) (resid 157 and name HA) ! 0.0715 11:20 ----- 5.00, 5.49 A assign (resid 6 and name HN) (resid 5 and name HA) 2.65 0.85 0.85 ! 0.8920 12:20 Ambig 2.04, 2.13 A or (resid 5 and name HN) (resid 5 and name HA) ! 0.1080 12:20 ----- 2.91, 2.93 A assign (resid 16 and name HN) (resid 15 and name HA) 3.15 1.35 1.35 ! 0.9866 13:20 Seq 2.30, 2.48 A assign (resid 13 and name HN) (resid 5 and name HA) 4.15 2.35 2.35 ! 0.0000 14:20 Long 2.62, 3.03 A assign (resid 4 and name HN) (resid 15 and name HA) 3.65 1.85 1.85 ! 0.0000 15:20 Long 2.79, 3.16 A assign (resid 3 and name HA) (resid 15 and name HA) 2.65 0.85 0.85 ! 0.9996 16:20 Long 2.01, 2.13 A assign (resid 5 and name HG2) (resid 5 and name HA) 4.15 2.35 2.35 ! 0.9730 18:20 Intra 2.48, 2.70 A assign (resid 5 and name HB2) (resid 5 and name HA) 2.65 0.85 0.85 ! 0.0000 19:20 Intra 2.99, 3.02 A assign (resid 3 and name HG2*) (resid 15 and name HA) 3.15 1.35 1.35 ! 0.9837 20:20 Long 2.12, 3.73 A assign (resid 13 and name HG2*) (resid 5 and name HA) 4.15 2.35 2.35 ! 0.7598 21:20 Ambig 2.98, 4.60 A or (resid 3 and name HG2*) (resid 5 and name HA) ! 0.1737 21:20 ----- 3.81, 5.14 A assign (resid 34 and name HN) (resid 33 and name HA) 2.65 0.85 0.85 ! 0.0000 22:20 Seq 2.27, 2.34 A assign (resid 172 and name HN) (resid 33 and name HA) 3.65 1.85 1.85 ! 0.0000 24:20 Long 1.79, 1.89 A assign (resid 33 and name HN) (resid 33 and name HA) 3.65 1.85 1.85 ! 0.9962 25:20 Intra 2.92, 2.94 A assign (resid 171 and name HA) (resid 33 and name HA) 4.15 2.35 2.35 ! 0.0000 26:20 Long 2.36, 2.57 A assign (resid 33 and name HB2) (resid 33 and name HA) 2.65 0.85 0.85 ! 0.9908 27:20 Intra 3.00, 3.01 A assign (resid 33 and name HD2*) (resid 33 and name HA) 2.65 0.85 0.85 ! 0.9797 28:20 Intra 2.11, 3.09 A assign (resid 33 and name HD1*) (resid 33 and name HA) 3.65 1.85 1.85 ! 0.7426 29:20 Ambig 4.41, 4.67 A or (resid 30 and name HG1*) (resid 33 and name HA) ! 0.1696 29:20 ----- 5.64, 6.78 A or (resid 133 and name HD2*) (resid 33 and name HA) ! 0.0878 29:20 ----- 6.29, 7.54 A assign (resid 169 and name HN) (resid 168 and name HA) 3.15 1.35 1.35 ! 0.9914 30:20 Seq 2.04, 2.11 A assign (resid 176 and name HN) (resid 175 and name HA) 2.65 0.85 0.85 ! 0.0000 31:20 Seq 2.22, 2.40 A assign (resid 5 and name HN) (resid 175 and name HA) 3.65 1.85 1.85 ! 0.7051 32:20 Ambig 4.94, 5.34 A or (resid 6 and name HN) (resid 175 and name HA) ! 0.2949 32:20 ----- 5.72, 6.08 A assign (resid 158 and name HN) (resid 168 and name HA) 4.15 2.35 2.35 ! 0.0000 33:20 Long 3.54, 3.79 A assign (resid 143 and name HD*) (resid 168 and name HA) 4.15 2.35 2.35 ! 0.0000 35:20 Long 4.87, 6.89 A assign (resid 175 and name HD*) (resid 175 and name HA) 2.65 0.85 0.85 ! 0.0000 36:20 Intra 2.01, 3.42 A assign (resid 175 and name HN) (resid 175 and name HA) 3.65 1.85 1.85 ! 0.0000 37:20 Intra 2.89, 2.91 A assign (resid 157 and name HA) (resid 168 and name HA) 3.15 1.35 1.35 ! 0.0000 38:20 Long 2.22, 2.51 A assign (resid 169 and name HA) (resid 168 and name HA) 4.15 2.35 2.35 ! 0.9449 39:20 Seq 4.27, 4.32 A assign (resid 168 and name HB2) (resid 168 and name HA) 3.15 1.35 1.35 ! 0.9722 42:20 Intra 3.00, 3.02 A assign (resid 175 and name HB*) (resid 175 and name HA) 3.15 1.35 1.35 ! 0.9850 43:20 Intra 2.44, 2.79 A assign (resid 176 and name HB*) (resid 175 and name HA) 4.15 2.35 2.35 ! 0.7613 45:20 Ambig 4.40, 5.17 A or (resid 176 and name HD*) (resid 175 and name HA) ! 0.1663 45:20 ----- 5.67, 6.31 A assign (resid 155 and name HG2*) (resid 168 and name HA) 4.15 2.35 2.35 ! 0.9017 46:20 Ambig 3.64, 4.49 A or (resid 75 and name HG1*) (resid 168 and name HA) ! 0.0983 46:20 ----- 5.27, 6.94 A assign (resid 7 and name HG2*) (resid 175 and name HA) 3.15 1.35 1.35 ! 0.9953 47:20 Long 2.02, 2.88 A assign (resid 41 and name HN) (resid 40 and name HA) 2.65 0.85 0.85 ! 0.0000 48:20 Seq 2.01, 2.08 A assign (resid 84 and name HN) (resid 83 and name HA) 3.15 1.35 1.35 ! 0.9995 49:20 Seq 1.98, 2.08 A assign (resid 157 and name HN) (resid 156 and name HA) 2.65 0.85 0.85 ! 0.9927 51:20 Seq 2.25, 2.30 A assign (resid 141 and name HN) (resid 140 and name HA) 2.65 0.85 0.85 ! 0.9918 52:20 Seq 1.94, 2.02 A assign (resid 72 and name HN) (resid 71 and name HA) 2.30 0.50 0.50 ! 0.0000 54:20 Seq 2.02, 2.12 A assign (resid 156 and name HN) (resid 156 and name HA) 3.65 1.85 1.85 ! 0.9725 55:20 Intra 2.90, 2.92 A assign (resid 156 and name HD*) (resid 156 and name HA) 2.65 0.85 0.85 ! 0.5767 56:20 Ambig 2.54, 3.61 A or (resid 142 and name HD*) (resid 156 and name HA) ! 0.4233 56:20 ----- 2.68, 4.57 A assign (resid 140 and name HN) (resid 140 and name HA) 3.65 1.85 1.85 ! 0.0000 57:20 Intra 2.87, 2.88 A assign (resid 159 and name HD*) (resid 158 and name HA) 3.15 1.35 1.35 ! 0.8542 58:20 Ambig 2.89, 4.88 A or (resid 158 and name HD*) (resid 158 and name HA) ! 0.1348 58:20 ----- 3.93, 4.26 A assign (resid 73 and name HA) (resid 40 and name HA) 3.65 1.85 1.85 ! 0.9842 60:20 Long 2.12, 2.49 A assign (resid 73 and name HA) (resid 40 and name HA) 3.65 1.85 1.85 ! 0.9820 62:20 Long 2.12, 2.49 A assign (resid 145 and name HA) (resid 83 and name HA) 4.15 2.35 2.35 ! 0.0000 64:20 Long 2.05, 2.30 A assign (resid 70 and name HA) (resid 71 and name HA) 4.15 2.35 2.35 ! 0.5775 68:20 Ambig 4.28, 4.35 A or (resid 150 and name HA) (resid 151 and name HA) ! 0.3876 68:20 ----- 4.57, 4.70 A assign (resid 83 and name HB1) (resid 83 and name HA) 4.15 2.35 2.35 ! 0.9858 69:20 Intra 2.48, 2.54 A assign (resid 156 and name HB2) (resid 156 and name HA) 3.15 1.35 1.35 ! 0.0000 70:20 Intra 3.01, 3.02 A assign (resid 158 and name HB*) (resid 158 and name HA) 2.65 0.85 0.85 ! 0.9380 71:20 Intra 2.35, 2.47 A assign (resid 83 and name HB2) (resid 83 and name HA) 4.15 2.35 2.35 ! 0.9663 72:20 Intra 2.99, 3.02 A assign (resid 40 and name HG*) (resid 40 and name HA) 3.65 1.85 1.85 ! 0.0000 73:20 Intra 2.46, 2.85 A assign (resid 156 and name HB1) (resid 156 and name HA) 3.65 1.85 1.85 ! 0.9967 74:20 Intra 2.42, 2.45 A assign (resid 158 and name HB*) (resid 140 and name HA) 4.15 2.35 2.35 ! 0.9488 75:20 Long 2.48, 3.33 A assign (resid 70 and name HB1) (resid 71 and name HA) 4.15 2.35 2.35 ! 0.5847 76:20 Ambig 4.35, 4.56 A or (resid 150 and name HB1) (resid 151 and name HA) ! 0.1511 76:20 ----- 5.45, 5.64 A or (resid 41 and name HB) (resid 71 and name HA) ! 0.1201 76:20 ----- 5.66, 5.85 A or (resid 150 and name HG1) (resid 151 and name HA) ! 0.0944 76:20 ----- 5.89, 6.08 A assign (resid 40 and name HB1) (resid 40 and name HA) 3.15 1.35 1.35 ! 0.9898 77:20 Intra 2.39, 2.47 A assign (resid 40 and name HB2) (resid 40 and name HA) 2.65 0.85 0.85 ! 0.9148 78:20 Ambig 3.00, 3.02 A or (resid 71 and name HB2) (resid 40 and name HA) ! 0.0852 78:20 ----- 4.45, 5.52 A assign (resid 140 and name HG) (resid 140 and name HA) 3.65 1.85 1.85 ! 0.0000 79:20 Intra 3.04, 3.10 A assign (resid 140 and name HB2) (resid 140 and name HA) 4.15 2.35 2.35 ! 0.9215 80:20 Intra 3.00, 3.01 A assign (resid 71 and name HD*) (resid 71 and name HA) 2.30 0.50 0.50 ! 0.5255 81:20 Ambig 2.32, 3.95 A or (resid 71 and name HG1) (resid 71 and name HA) ! 0.4745 81:20 ----- 2.36, 2.79 A assign (resid 41 and name HG1*) (resid 40 and name HA) 3.65 1.85 1.85 ! 0.8754 82:20 Ambig 3.77, 4.95 A or (resid 43 and name HG2*) (resid 40 and name HA) ! 0.1246 82:20 ----- 5.22, 7.07 A assign (resid 140 and name HB1) (resid 156 and name HA) 3.15 1.35 1.35 ! 0.4446 83:20 Ambig 2.99, 3.47 A or (resid 140 and name HD2*) (resid 156 and name HA) ! 0.3338 83:20 ----- 3.13, 4.55 A or (resid 140 and name HD1*) (resid 156 and name HA) ! 0.2159 83:20 ----- 3.37, 4.85 A assign (resid 140 and name HD2*) (resid 140 and name HA) 2.30 0.50 0.50 ! 0.7316 84:20 Ambig 2.06, 2.92 A or (resid 140 and name HB1) (resid 140 and name HA) ! 0.2487 84:20 ----- 2.46, 2.49 A assign (resid 140 and name HD2*) (resid 158 and name HA) 3.15 1.35 1.35 ! 0.8495 85:20 Ambig 3.25, 4.79 A or (resid 140 and name HB1) (resid 158 and name HA) ! 0.0607 85:20 ----- 5.05, 5.59 A or (resid 136 and name HG1) (resid 158 and name HA) ! 0.0416 85:20 ----- 5.38, 7.19 A assign (resid 25 and name HN) (resid 24 and name HA) 2.30 0.50 0.50 ! 0.0000 86:20 Seq 1.98, 2.06 A assign (resid 30 and name HN) (resid 24 and name HA) 3.65 1.85 1.85 ! 0.0000 87:20 Long 3.22, 3.57 A assign (resid 24 and name HN) (resid 24 and name HA) 3.65 1.85 1.85 ! 0.0000 88:20 Intra 2.89, 2.92 A assign (resid 151 and name HN) (resid 149 and name HA) 4.15 2.35 2.35 ! 0.0000 89:20 Mid 3.85, 4.10 A assign (resid 29 and name HA) (resid 24 and name HA) 2.65 0.85 0.85 ! 0.9924 90:20 Long 2.06, 2.36 A assign (resid 24 and name HG1) (resid 24 and name HA) 3.15 1.35 1.35 ! 0.9771 91:20 Intra 2.56, 3.00 A assign (resid 24 and name HG2) (resid 24 and name HA) 4.15 2.35 2.35 ! 0.0000 92:20 Intra 2.38, 2.58 A assign (resid 24 and name HB2) (resid 24 and name HA) 2.65 0.85 0.85 ! 0.7268 93:20 Ambig 2.99, 3.02 A or (resid 29 and name HB*) (resid 24 and name HA) ! 0.2732 93:20 ----- 3.53, 4.33 A assign (resid 150 and name HG1) (resid 149 and name HA) 3.65 1.85 1.85 ! 0.7996 94:20 Ambig 4.61, 4.70 A or (resid 86 and name HG1) (resid 149 and name HA) ! 0.1429 94:20 ----- 6.14, 7.11 A assign (resid 30 and name HG1*) (resid 24 and name HA) 4.15 2.35 2.35 ! 0.0000 95:20 Long 6.75, 7.46 A assign (resid 149 and name HN) (resid 149 and name HA) 3.65 1.85 1.85 ! 0.0000 96:20 Intra 2.93, 2.94 A assign (resid 149 and name HB1) (resid 149 and name HA) 3.15 1.35 1.35 ! 0.9938 99:20 Intra 2.47, 2.61 A assign (resid 35 and name HN) (resid 34 and name HA) 3.15 1.35 1.35 ! 0.0000 104:20 Seq 2.12, 2.25 A assign (resid 21 and name HN) (resid 21 and name HA) 3.65 1.85 1.85 ! 0.9963 105:20 Intra 2.91, 2.92 A assign (resid 34 and name HN) (resid 34 and name HA) 4.15 2.35 2.35 ! 0.0000 106:20 Intra 2.82, 2.86 A assign (resid 23 and name HN) (resid 34 and name HA) 3.65 1.85 1.85 ! 0.9983 107:20 Long 2.19, 2.62 A assign (resid 35 and name HA) (resid 34 and name HA) 4.15 2.35 2.35 ! 0.0000 109:20 Seq 4.25, 4.31 A assign (resid 21 and name HB) (resid 21 and name HA) 2.65 0.85 0.85 ! 0.9639 111:20 Intra 2.52, 2.59 A assign (resid 22 and name HA) (resid 34 and name HA) 2.65 0.85 0.85 ! 0.0000 112:20 Long 2.27, 2.65 A assign (resid 34 and name HB1) (resid 34 and name HA) 3.15 1.35 1.35 ! 0.0000 115:20 Intra 2.44, 2.52 A assign (resid 22 and name HD*) (resid 21 and name HA) 2.30 0.50 0.50 ! 0.0000 116:20 Seq 2.15, 2.42 A assign (resid 34 and name HB2) (resid 34 and name HA) 3.65 1.85 1.85 ! 0.0000 117:20 Intra 2.37, 2.40 A assign (resid 23 and name HB) (resid 34 and name HA) 3.65 1.85 1.85 ! 0.5580 118:20 Ambig 4.00, 4.24 A or (resid 33 and name HB2) (resid 34 and name HA) ! 0.4067 118:20 ----- 4.22, 4.43 A assign (resid 21 and name HG2*) (resid 21 and name HA) 2.65 0.85 0.85 ! 0.0000 119:20 Intra 2.37, 2.99 A assign (resid 22 and name HG2) (resid 21 and name HA) 3.15 1.35 1.35 ! 0.4345 120:20 Ambig 4.32, 4.52 A or (resid 22 and name HG1) (resid 21 and name HA) ! 0.3336 120:20 ----- 4.52, 4.57 A or (resid 35 and name HB1) (resid 21 and name HA) ! 0.2319 120:20 ----- 4.80, 6.00 A assign (resid 23 and name HG2*) (resid 34 and name HA) 3.15 1.35 1.35 ! 0.9982 121:20 Long 1.97, 3.08 A assign (resid 151 and name HN) (resid 151 and name HA) 2.65 0.85 0.85 ! 0.0000 122:20 Intra 2.85, 2.91 A assign (resid 152 and name HN) (resid 151 and name HA) 3.65 1.85 1.85 ! 0.0000 123:20 Seq 3.23, 3.41 A assign (resid 175 and name HD*) (resid 170 and name HA) 3.65 1.85 1.85 ! 0.0000 124:20 Long 4.00, 5.92 A assign (resid 155 and name HA) (resid 170 and name HA) 4.15 2.35 2.35 ! 0.0000 126:20 Long 5.30, 5.66 A assign (resid 151 and name HB2) (resid 151 and name HA) 2.65 0.85 0.85 ! 0.0000 127:20 Intra 2.99, 3.02 A assign (resid 170 and name HB2) (resid 170 and name HA) 3.15 1.35 1.35 ! 0.9933 128:20 Intra 2.95, 2.99 A assign (resid 170 and name HB2) (resid 170 and name HA) 3.65 1.85 1.85 ! 0.9433 129:20 Intra 2.95, 2.99 A assign (resid 71 and name HG2) (resid 71 and name HA) 3.15 1.35 1.35 ! 0.0000 130:20 Intra 2.43, 3.21 A assign (resid 43 and name HG2*) (resid 71 and name HA) 3.15 1.35 1.35 ! 0.9603 131:20 Long 2.61, 4.24 A assign (resid 170 and name HB1) (resid 170 and name HA) 3.65 1.85 1.85 ! 0.0000 132:20 Intra 2.42, 2.50 A assign (resid 40 and name HN) (resid 39 and name HA) 2.30 0.50 0.50 ! 0.0000 134:20 Seq 2.11, 2.16 A assign (resid 40 and name HG*) (resid 39 and name HA) 3.15 1.35 1.35 ! 0.9903 135:20 Seq 3.40, 4.44 A assign (resid 39 and name HB*) (resid 39 and name HA) 2.30 0.50 0.50 ! 0.9853 136:20 Intra 2.43, 2.66 A assign (resid 149 and name HB2) (resid 149 and name HA) 4.15 2.35 2.35 ! 0.0000 137:20 Intra 2.61, 2.99 A assign (resid 148 and name HB2) (resid 149 and name HA) 4.15 2.35 2.35 ! 0.6625 138:20 Ambig 4.80, 5.01 A or (resid 150 and name HB2) (resid 149 and name HA) ! 0.2399 138:20 ----- 5.68, 5.76 A or (resid 148 and name HG1) (resid 149 and name HA) ! 0.0976 138:20 ----- 6.60, 6.66 A assign (resid 117 and name HN) (resid 119 and name HA) 4.90 3.10 3.10 ! 0.0000 146:20 Mid 6.53, 6.70 A assign (resid 105 and name HN) (resid 102 and name HA) 3.65 1.85 1.85 ! 0.0000 149:20 Mid 3.40, 3.59 A assign (resid 105 and name HN) (resid 105 and name HA) 3.15 1.35 1.35 ! 0.9937 150:20 Intra 2.78, 2.80 A assign (resid 9 and name HN) (resid 8 and name HG2*) 3.65 1.85 1.85 ! 0.0000 151:20 Seq 3.53, 4.36 A assign (resid 8 and name HN) (resid 8 and name HG2*) 3.15 1.35 1.35 ! 0.0000 152:20 Intra 4.39, 4.57 A assign (resid 35 and name HN) (resid 20 and name HG2*) 3.65 1.85 1.85 ! 0.0000 153:20 Long 4.12, 5.63 A assign (resid 21 and name HN) (resid 20 and name HG2*) 3.15 1.35 1.35 ! 0.9904 154:20 Seq 2.67, 3.78 A assign (resid 143 and name HN) (resid 155 and name HD1*) 4.15 2.35 2.35 ! 0.0000 155:20 Long 4.69, 5.56 A assign (resid 16 and name HN) (resid 15 and name HB2) 3.65 1.85 1.85 ! 0.9801 156:20 Seq 2.12, 2.37 A assign (resid 16 and name HN) (resid 15 and name HB2) 3.65 1.85 1.85 ! 0.9801 157:20 Seq 2.12, 2.37 A assign (resid 130 and name HN) (resid 127 and name HA) 4.15 2.35 2.35 ! 0.0000 158:20 Mid 3.43, 3.52 A assign (resid 130 and name HN) (resid 130 and name HA) 2.65 0.85 0.85 ! 0.8044 159:20 Ambig 2.75, 2.79 A or (resid 135 and name HN) (resid 134 and name HA) ! 0.1956 159:20 ----- 3.48, 3.52 A assign (resid 134 and name HN) (resid 134 and name HA) 2.65 0.85 0.85 ! 0.0000 160:20 Intra 2.82, 2.85 A assign (resid 120 and name HN) (resid 119 and name HA) 2.65 0.85 0.85 ! 0.6621 161:20 Ambig 3.47, 3.51 A or (resid 120 and name HN) (resid 116 and name HA) ! 0.2811 161:20 ----- 4.00, 4.27 A assign (resid 109 and name HN) (resid 105 and name HA) 4.15 2.35 2.35 ! 0.0000 162:20 Mid 3.98, 4.19 A assign (resid 157 and name HN) (resid 157 and name HB2) 3.15 1.35 1.35 ! 0.9937 163:20 Intra 2.79, 3.02 A assign (resid 158 and name HN) (resid 157 and name HB1) 2.65 0.85 0.85 ! 0.6715 164:20 Ambig 2.55, 3.09 A or (resid 157 and name HN) (resid 157 and name HB1) ! 0.3264 164:20 ----- 2.88, 3.64 A assign (resid 109 and name HN) (resid 108 and name HB*) 2.65 0.85 0.85 ! 0.9905 168:20 Seq 2.50, 3.44 A assign (resid 120 and name HN) (resid 119 and name HG2*) 3.15 1.35 1.35 ! 0.0000 169:20 Seq 3.46, 4.36 A assign (resid 3 and name HN) (resid 2 and name HG2*) 2.65 0.85 0.85 ! 0.8886 172:20 Ambig 2.52, 3.64 A or (resid 178 and name HN) (resid 2 and name HG2*) ! 0.0850 172:20 ----- 3.73, 5.01 A assign (resid 155 and name HN) (resid 155 and name HD1*) 2.65 0.85 0.85 ! 0.9925 173:20 Intra 2.12, 3.97 A assign (resid 129 and name HN) (resid 128 and name HB) 3.15 1.35 1.35 ! 0.0000 174:20 Seq 2.64, 2.77 A assign (resid 128 and name HN) (resid 128 and name HB) 2.65 0.85 0.85 ! 0.0000 175:20 Intra 2.47, 2.54 A assign (resid 129 and name HN) (resid 128 and name HA) 4.15 2.35 2.35 ! 0.9779 176:20 Seq 3.53, 3.56 A assign (resid 128 and name HN) (resid 128 and name HA) 3.15 1.35 1.35 ! 0.9957 177:20 Intra 2.78, 2.81 A assign (resid 128 and name HN) (resid 127 and name HA) 3.15 1.35 1.35 ! 0.0000 178:20 Seq 3.40, 3.45 A assign (resid 119 and name HN) (resid 119 and name HA) 2.65 0.85 0.85 ! 0.6781 180:20 Ambig 2.78, 2.80 A or (resid 119 and name HN) (resid 116 and name HA) ! 0.3219 180:20 ----- 3.14, 3.34 A assign (resid 118 and name HN) (resid 119 and name HA) 3.65 1.85 1.85 ! 0.7283 181:20 Ambig 4.99, 5.14 A or (resid 114 and name HN) (resid 119 and name HA) ! 0.2717 181:20 ----- 5.88, 6.15 A assign (resid 102 and name HN) (resid 102 and name HA) 2.65 0.85 0.85 ! 0.8620 182:20 Ambig 2.78, 2.82 A or (resid 106 and name HN) (resid 102 and name HA) ! 0.1380 182:20 ----- 3.78, 4.09 A assign (resid 108 and name HN) (resid 105 and name HA) 3.15 1.35 1.35 ! 0.6469 184:20 Ambig 3.13, 3.25 A or (resid 106 and name HN) (resid 105 and name HA) ! 0.3296 184:20 ----- 3.50, 3.54 A assign (resid 108 and name HN) (resid 108 and name HB*) 2.30 0.50 0.50 ! 0.9938 190:20 Intra 2.47, 2.91 A assign (resid 18 and name HN) (resid 17 and name HB*) 3.15 1.35 1.35 ! 0.0000 191:20 Seq 2.99, 3.88 A assign (resid 123 and name HN) (resid 119 and name HG2*) 3.65 1.85 1.85 ! 0.6965 193:20 Ambig 4.12, 4.92 A or (resid 110 and name HN) (resid 119 and name HG2*) ! 0.2574 193:20 ----- 4.86, 6.77 A assign (resid 119 and name HN) (resid 119 and name HG2*) 3.15 1.35 1.35 ! 0.0000 194:20 Intra 4.32, 4.57 A assign (resid 122 and name HD*) (resid 119 and name HG2*) 3.15 1.35 1.35 ! 0.9628 195:20 Mid 3.53, 6.36 A assign (resid 82 and name HN) (resid 82 and name HB*) 3.15 1.35 1.35 ! 0.6776 197:20 Ambig 3.01, 3.63 A or (resid 83 and name HN) (resid 82 and name HB*) ! 0.3224 197:20 ----- 3.41, 4.23 A assign (resid 10 and name HN) (resid 8 and name HG2*) 3.65 1.85 1.85 ! 0.6867 198:20 Ambig 5.56, 6.46 A or (resid 151 and name HN) (resid 8 and name HG2*) ! 0.3133 198:20 ----- 6.34, 7.11 A assign (resid 20 and name HN) (resid 20 and name HG2*) 3.15 1.35 1.35 ! 0.9599 199:20 Intra 4.26, 4.62 A assign (resid 145 and name HN) (resid 155 and name HD1*) 3.15 1.35 1.35 ! 0.9858 200:20 Long 2.62, 3.67 A assign (resid 4 and name HN) (resid 14 and name HG1*) 3.15 1.35 1.35 ! 0.0000 201:20 Long 3.06, 4.20 A assign (resid 143 and name HD*) (resid 157 and name HB2) 3.65 1.85 1.85 ! 0.0000 205:20 Long 2.08, 4.30 A assign (resid 143 and name HD*) (resid 157 and name HB1) 3.15 1.35 1.35 ! 0.0000 206:20 Long 2.19, 4.93 A assign (resid 152 and name HN) (resid 8 and name HG2*) 3.65 1.85 1.85 ! 0.0000 209:20 Long 4.73, 5.34 A assign (resid 4 and name HD*) (resid 2 and name HG2*) 3.65 1.85 1.85 ! 0.0000 210:20 Mid 3.40, 5.97 A assign (resid 4 and name HD*) (resid 2 and name HG2*) 3.65 1.85 1.85 ! 0.0000 211:20 Mid 3.40, 5.97 A assign (resid 143 and name HD*) (resid 155 and name HD1*) 3.65 1.85 1.85 ! 0.0000 213:20 Long 5.07, 6.69 A assign (resid 14 and name HN) (resid 14 and name HG1*) 2.65 0.85 0.85 ! 0.0000 214:20 Intra 2.53, 3.62 A assign (resid 15 and name HN) (resid 14 and name HG1*) 3.15 1.35 1.35 ! 0.0000 215:20 Seq 3.37, 4.47 A assign (resid 4 and name HD*) (resid 14 and name HG1*) 2.65 0.85 0.85 ! 0.0000 216:20 Long 2.20, 4.43 A assign (resid 157 and name HA) (resid 157 and name HB2) 3.15 1.35 1.35 ! 0.0000 218:20 Intra 2.48, 2.87 A assign (resid 157 and name HA) (resid 157 and name HB1) 2.65 0.85 0.85 ! 0.0000 219:20 Intra 2.42, 2.56 A assign (resid 4 and name HE*) (resid 2 and name HG2*) 3.65 1.85 1.85 ! 0.0000 222:20 Mid 2.86, 5.34 A assign (resid 4 and name HE*) (resid 20 and name HG2*) 3.15 1.35 1.35 ! 0.0000 224:20 Long 2.67, 5.34 A assign (resid 4 and name HE*) (resid 14 and name HG1*) 3.15 1.35 1.35 ! 0.0000 227:20 Long 3.76, 5.72 A assign (resid 38 and name HA) (resid 38 and name HB*) 3.65 1.85 1.85 ! 0.8894 228:20 Ambig 2.29, 2.63 A or (resid 73 and name HA) (resid 38 and name HB*) ! 0.0676 228:20 ----- 3.51, 4.95 A assign (resid 168 and name HA) (resid 157 and name HB1) 3.65 1.85 1.85 ! 0.9588 229:20 Long 2.51, 3.21 A assign (resid 168 and name HA) (resid 157 and name HB2) 4.15 2.35 2.35 ! 0.9301 230:20 Long 2.69, 3.85 A assign (resid 175 and name HA) (resid 7 and name HG1*) 3.65 1.85 1.85 ! 0.0000 234:20 Long 5.14, 5.85 A assign (resid 2 and name HA) (resid 2 and name HG2*) 2.65 0.85 0.85 ! 0.6248 236:20 Ambig 2.43, 3.13 A or (resid 179 and name HA) (resid 2 and name HG2*) ! 0.3592 236:20 ----- 2.67, 4.64 A assign (resid 21 and name HA) (resid 20 and name HG2*) 3.15 1.35 1.35 ! 0.9043 238:20 Ambig 3.45, 4.71 A or (resid 34 and name HA) (resid 20 and name HG2*) ! 0.0957 238:20 ----- 5.01, 5.99 A assign (resid 144 and name HA) (resid 155 and name HD1*) 3.15 1.35 1.35 ! 0.9783 239:20 Long 2.44, 3.57 A assign (resid 4 and name HA) (resid 14 and name HG1*) 3.65 1.85 1.85 ! 0.3514 241:20 Ambig 4.95, 5.80 A or (resid 13 and name HA) (resid 14 and name HG1*) ! 0.3445 241:20 ----- 4.97, 6.02 A or (resid 36 and name HA) (resid 14 and name HG1*) ! 0.1882 241:20 ----- 5.49, 7.24 A or (resid 12 and name HA) (resid 14 and name HG1*) ! 0.1158 241:20 ----- 5.96, 7.10 A assign (resid 3 and name HA) (resid 15 and name HB2) 3.15 1.35 1.35 ! 0.9840 242:20 Long 3.32, 3.80 A assign (resid 128 and name HB) (resid 128 and name HA) 3.15 1.35 1.35 ! 0.0000 246:20 Intra 3.02, 3.03 A assign (resid 167 and name HA) (resid 157 and name HB2) 4.90 3.10 3.10 ! 0.0000 248:20 Long 4.84, 6.47 A assign (resid 167 and name HA) (resid 157 and name HB1) 4.15 2.35 2.35 ! 0.0000 249:20 Long 4.73, 5.43 A assign (resid 17 and name HA) (resid 17 and name HB*) 2.30 0.50 0.50 ! 0.4961 252:20 Ambig 2.43, 2.64 A or (resid 108 and name HA) (resid 108 and name HB*) ! 0.4940 252:20 ----- 2.43, 2.65 A assign (resid 110 and name HA) (resid 119 and name HG2*) 3.15 1.35 1.35 ! 0.6762 255:20 Ambig 2.89, 4.74 A or (resid 120 and name HA) (resid 119 and name HG2*) ! 0.2801 255:20 ----- 3.35, 4.62 A assign (resid 78 and name HA) (resid 82 and name HB*) 2.30 0.50 0.50 ! 0.9977 256:20 Mid 2.03, 3.29 A assign (resid 8 and name HA) (resid 8 and name HG2*) 2.65 0.85 0.85 ! 0.0000 259:20 Intra 2.40, 3.03 A assign (resid 178 and name HA) (resid 2 and name HG2*) 3.65 1.85 1.85 ! 0.0000 260:20 Long 4.96, 6.37 A assign (resid 3 and name HA) (resid 2 and name HG2*) 3.65 1.85 1.85 ! 0.0000 261:20 Seq 3.48, 4.81 A assign (resid 20 and name HA) (resid 20 and name HG2*) 2.65 0.85 0.85 ! 0.9914 263:20 Intra 2.54, 3.20 A assign (resid 19 and name HA) (resid 20 and name HG2*) 4.15 2.35 2.35 ! 0.0000 264:20 Seq 6.29, 6.58 A assign (resid 3 and name HA) (resid 14 and name HG1*) 4.15 2.35 2.35 ! 0.5306 266:20 Ambig 4.26, 5.54 A or (resid 20 and name HA) (resid 14 and name HG1*) ! 0.4694 266:20 ----- 4.35, 5.97 A assign (resid 127 and name HD1) (resid 127 and name HA) 3.65 1.85 1.85 ! 0.0000 267:20 Intra 3.42, 3.51 A assign (resid 119 and name HA) (resid 119 and name HG2*) 2.65 0.85 0.85 ! 0.8749 270:20 Ambig 2.66, 3.31 A or (resid 116 and name HA) (resid 119 and name HG2*) ! 0.1251 270:20 ----- 3.68, 4.58 A assign (resid 122 and name HB2) (resid 119 and name HG2*) 3.15 1.35 1.35 ! 0.0000 271:20 Mid 4.28, 5.43 A assign (resid 82 and name HA) (resid 82 and name HB*) 2.30 0.50 0.50 ! 0.9756 272:20 Intra 2.39, 2.64 A assign (resid 34 and name HB1) (resid 20 and name HG2*) 3.15 1.35 1.35 ! 0.0000 273:20 Long 3.42, 4.45 A assign (resid 145 and name HB*) (resid 155 and name HD1*) 2.65 0.85 0.85 ! 0.6445 274:20 Ambig 2.97, 4.82 A or (resid 155 and name HA) (resid 155 and name HD1*) ! 0.3555 274:20 ----- 3.28, 4.44 A assign (resid 31 and name HG2) (resid 128 and name HB) 3.65 1.85 1.85 ! 0.9095 275:20 Ambig 2.92, 3.59 A or (resid 31 and name HG1) (resid 128 and name HB) ! 0.0759 275:20 ----- 4.42, 5.29 A assign (resid 127 and name HB2) (resid 128 and name HA) 3.65 1.85 1.85 ! 0.7777 276:20 Ambig 4.02, 4.11 A or (resid 31 and name HG2) (resid 128 and name HA) ! 0.1632 276:20 ----- 5.22, 5.58 A assign (resid 127 and name HB2) (resid 127 and name HA) 2.30 0.50 0.50 ! 0.0000 277:20 Intra 2.72, 2.74 A assign (resid 133 and name HB2) (resid 130 and name HA) 2.65 0.85 0.85 ! 0.6273 279:20 Ambig 2.70, 2.93 A or (resid 134 and name HB) (resid 134 and name HA) ! 0.3102 279:20 ----- 3.04, 3.05 A assign (resid 116 and name HB) (resid 116 and name HA) 2.65 0.85 0.85 ! 0.9861 280:20 Intra 3.02, 3.03 A assign (resid 7 and name HB) (resid 108 and name HB*) 3.15 1.35 1.35 ! 0.4183 281:20 Ambig 3.97, 5.05 A or (resid 1 and name HB2) (resid 17 and name HB*) ! 0.3312 281:20 ----- 4.13, 6.15 A or (resid 107 and name HB2) (resid 108 and name HB*) ! 0.2311 281:20 ----- 4.38, 5.41 A assign (resid 123 and name HG1) (resid 119 and name HG2*) 3.15 1.35 1.35 ! 0.9964 282:20 Mid 2.59, 3.30 A assign (resid 123 and name HG2) (resid 119 and name HG2*) 3.65 1.85 1.85 ! 0.9636 283:20 Mid 3.77, 4.61 A assign (resid 151 and name HB2) (resid 8 and name HG2*) 4.15 2.35 2.35 ! 0.0000 284:20 Long 5.06, 6.24 A assign (resid 151 and name HB1) (resid 8 and name HG2*) 3.65 1.85 1.85 ! 0.4715 285:20 Ambig 4.74, 5.61 A or (resid 104 and name HB1) (resid 8 and name HG2*) ! 0.4137 285:20 ----- 4.85, 6.29 A or (resid 149 and name HB1) (resid 8 and name HG2*) ! 0.1148 285:20 ----- 6.00, 7.87 A assign (resid 8 and name HB) (resid 8 and name HG2*) 2.65 0.85 0.85 ! 0.9938 286:20 Intra 2.43, 2.64 A assign (resid 34 and name HB2) (resid 20 and name HG2*) 3.15 1.35 1.35 ! 0.0000 287:20 Long 2.59, 3.66 A assign (resid 143 and name HB1) (resid 155 and name HD1*) 2.65 0.85 0.85 ! 0.8333 288:20 Ambig 2.94, 4.45 A or (resid 148 and name HG2) (resid 155 and name HD1*) ! 0.0612 288:20 ----- 4.55, 6.10 A or (resid 144 and name HB*) (resid 155 and name HD1*) ! 0.0475 288:20 ----- 4.75, 6.03 A assign (resid 13 and name HB) (resid 155 and name HD1*) 3.15 1.35 1.35 ! 0.7668 289:20 Ambig 3.53, 4.83 A or (resid 148 and name HB1) (resid 155 and name HD1*) ! 0.2332 289:20 ----- 4.31, 5.71 A assign (resid 14 and name HA) (resid 14 and name HG1*) 3.15 1.35 1.35 ! 0.8723 290:20 Ambig 3.68, 3.94 A or (resid 168 and name HB1) (resid 14 and name HG1*) ! 0.0677 290:20 ----- 5.64, 7.18 A assign (resid 4 and name HB2) (resid 14 and name HG1*) 2.65 0.85 0.85 ! 0.0000 291:20 Long 2.20, 2.96 A assign (resid 127 and name HB1) (resid 127 and name HA) 2.30 0.50 0.50 ! 0.9645 292:20 Intra 2.29, 2.31 A assign (resid 127 and name HB1) (resid 128 and name HA) 4.15 2.35 2.35 ! 0.0000 293:20 Seq 5.52, 5.58 A assign (resid 128 and name HG2*) (resid 128 and name HA) 2.65 0.85 0.85 ! 0.9881 294:20 Intra 2.41, 3.05 A assign (resid 130 and name HB) (resid 130 and name HA) 3.15 1.35 1.35 ! 0.9684 295:20 Intra 3.01, 3.03 A assign (resid 119 and name HB) (resid 116 and name HA) 2.65 0.85 0.85 ! 0.8932 298:20 Ambig 2.09, 2.39 A or (resid 119 and name HB) (resid 119 and name HA) ! 0.1003 298:20 ----- 3.01, 3.03 A assign (resid 119 and name HG12) (resid 119 and name HA) 2.65 0.85 0.85 ! 0.7333 299:20 Ambig 2.25, 2.98 A or (resid 119 and name HG12) (resid 116 and name HA) ! 0.2667 299:20 ----- 2.67, 3.15 A assign (resid 102 and name HB) (resid 102 and name HA) 2.65 0.85 0.85 ! 0.9746 300:20 Intra 3.04, 3.04 A assign (resid 105 and name HB) (resid 102 and name HA) 3.65 1.85 1.85 ! 0.9339 301:20 Mid 2.30, 2.50 A assign (resid 105 and name HB) (resid 105 and name HA) 3.65 1.85 1.85 ! 0.0000 302:20 Intra 3.02, 3.04 A assign (resid 108 and name HB*) (resid 105 and name HA) 2.65 0.85 0.85 ! 0.9966 303:20 Mid 2.40, 3.38 A assign (resid 119 and name HB) (resid 119 and name HG2*) 2.30 0.50 0.50 ! 0.9523 305:20 Intra 2.40, 2.63 A assign (resid 146 and name HB1) (resid 82 and name HB*) 3.15 1.35 1.35 ! 0.7539 307:20 Ambig 2.93, 4.76 A or (resid 78 and name HG1) (resid 82 and name HB*) ! 0.1373 307:20 ----- 3.89, 5.69 A or (resid 78 and name HB2) (resid 82 and name HB*) ! 0.0860 307:20 ----- 4.20, 5.65 A assign (resid 152 and name HB*) (resid 8 and name HG2*) 2.65 0.85 0.85 ! 0.9977 312:20 Long 2.29, 4.02 A assign (resid 179 and name HB1) (resid 2 and name HG2*) 3.15 1.35 1.35 ! 0.9324 314:20 Long 3.12, 5.08 A assign (resid 13 and name HG1*) (resid 155 and name HD1*) 2.65 0.85 0.85 ! 0.0000 317:20 Long 2.23, 4.98 A assign (resid 14 and name HB) (resid 14 and name HG1*) 2.65 0.85 0.85 ! 0.9974 318:20 Intra 2.37, 2.60 A assign (resid 13 and name HG1*) (resid 14 and name HG1*) 3.65 1.85 1.85 ! 0.0000 319:20 Seq 5.33, 6.80 A assign (resid 20 and name HB) (resid 14 and name HG1*) 4.15 2.35 2.35 ! 0.0000 320:20 Long 5.39, 6.60 A assign (resid 3 and name HG2*) (resid 15 and name HB2) 2.65 0.85 0.85 ! 0.8933 321:20 Ambig 3.07, 4.53 A or (resid 18 and name HD1*) (resid 15 and name HB2) ! 0.0495 321:20 ----- 4.98, 6.05 A assign (resid 130 and name HG2*) (resid 128 and name HA) 4.15 2.35 2.35 ! 0.7203 322:20 Ambig 5.73, 6.86 A or (resid 130 and name HG1*) (resid 128 and name HA) ! 0.2797 322:20 ----- 6.71, 7.55 A assign (resid 130 and name HG2*) (resid 127 and name HA) 2.65 0.85 0.85 ! 0.9467 323:20 Mid 2.68, 3.71 A assign (resid 133 and name HD1*) (resid 130 and name HA) 2.30 0.50 0.50 ! 0.5426 324:20 Ambig 2.16, 3.82 A or (resid 130 and name HG1*) (resid 130 and name HA) ! 0.2380 324:20 ----- 2.47, 3.11 A or (resid 130 and name HG2*) (resid 130 and name HA) ! 0.2056 324:20 ----- 2.54, 3.18 A assign (resid 134 and name HG2*) (resid 134 and name HA) 2.30 0.50 0.50 ! 0.5588 325:20 Ambig 2.45, 3.09 A or (resid 134 and name HG1*) (resid 134 and name HA) ! 0.4412 325:20 ----- 2.55, 3.20 A assign (resid 116 and name HG1*) (resid 116 and name HA) 2.30 0.50 0.50 ! 0.5333 326:20 Ambig 2.53, 3.16 A or (resid 119 and name HG2*) (resid 119 and name HA) ! 0.3892 326:20 ----- 2.66, 3.31 A assign (resid 119 and name HD1*) (resid 119 and name HA) 2.30 0.50 0.50 ! 0.6527 327:20 Ambig 2.04, 2.99 A or (resid 119 and name HD1*) (resid 116 and name HA) ! 0.1630 327:20 ----- 2.57, 5.22 A or (resid 119 and name HG11) (resid 116 and name HA) ! 0.1066 327:20 ----- 2.75, 3.13 A assign (resid 109 and name HD2*) (resid 119 and name HA) 3.65 1.85 1.85 ! 0.0000 328:20 Long 5.34, 7.09 A assign (resid 102 and name HG2*) (resid 102 and name HA) 2.65 0.85 0.85 ! 0.9850 329:20 Intra 2.50, 3.14 A assign (resid 102 and name HG1*) (resid 102 and name HA) 2.30 0.50 0.50 ! 0.9251 330:20 Intra 2.54, 3.17 A assign (resid 7 and name HG2*) (resid 105 and name HA) 2.65 0.85 0.85 ! 0.5192 331:20 Ambig 2.75, 4.14 A or (resid 7 and name HG1*) (resid 105 and name HA) ! 0.3881 331:20 ----- 2.89, 4.44 A or (resid 109 and name HD1*) (resid 105 and name HA) ! 0.0901 331:20 ----- 3.69, 4.61 A assign (resid 166 and name HB2) (resid 157 and name HB1) 4.15 2.35 2.35 ! 0.0000 332:20 Long 2.40, 3.20 A assign (resid 166 and name HB1) (resid 157 and name HB1) 4.15 2.35 2.35 ! 0.0000 333:20 Long 2.43, 3.32 A assign (resid 2 and name HD1*) (resid 2 and name HG2*) 2.65 0.85 0.85 ! 0.9916 335:20 Intra 2.01, 3.69 A assign (resid 155 and name HG1*) (resid 155 and name HD1*) 2.30 0.50 0.50 ! 0.5327 336:20 Ambig 2.40, 2.61 A or (resid 155 and name HB) (resid 155 and name HD1*) ! 0.4619 336:20 ----- 2.45, 3.08 A assign (resid 105 and name HG2*) (resid 102 and name HA) 3.65 1.85 1.85 ! 0.0000 339:20 Mid 3.12, 4.07 A assign (resid 105 and name HG1*) (resid 102 and name HA) 3.65 1.85 1.85 ! 0.0000 340:20 Mid 3.94, 4.68 A assign (resid 105 and name HG2*) (resid 105 and name HA) 2.65 0.85 0.85 ! 0.0000 341:20 Intra 2.41, 3.02 A assign (resid 105 and name HG1*) (resid 105 and name HA) 3.15 1.35 1.35 ! 0.0000 342:20 Intra 2.64, 3.28 A assign (resid 8 and name HN) (resid 8 and name HA) 3.15 1.35 1.35 ! 0.9922 346:20 Intra 2.86, 2.88 A assign (resid 9 and name HN) (resid 8 and name HA) 3.65 1.85 1.85 ! 0.0000 347:20 Seq 3.52, 3.55 A assign (resid 8 and name HN) (resid 7 and name HA) 3.65 1.85 1.85 ! 0.9699 349:20 Seq 3.43, 3.47 A assign (resid 9 and name HN) (resid 8 and name HD1*) 3.65 1.85 1.85 ! 0.0000 350:20 Seq 4.95, 5.55 A assign (resid 8 and name HN) (resid 8 and name HD1*) 3.15 1.35 1.35 ! 0.7498 351:20 Ambig 3.04, 3.90 A or (resid 105 and name HN) (resid 8 and name HD1*) ! 0.2502 351:20 ----- 3.65, 4.78 A assign (resid 21 and name HN) (resid 20 and name HD1*) 3.65 1.85 1.85 ! 0.0000 352:20 Seq 5.42, 6.36 A assign (resid 151 and name HN) (resid 150 and name HA) 3.65 1.85 1.85 ! 0.0000 353:20 Seq 3.35, 3.44 A assign (resid 32 and name HN) (resid 31 and name HA) 2.30 0.50 0.50 ! 0.9960 354:20 Seq 2.05, 2.10 A assign (resid 75 and name HN) (resid 75 and name HA) 3.65 1.85 1.85 ! 0.0000 356:20 Intra 2.84, 2.87 A assign (resid 149 and name HN) (resid 9 and name HB2) 4.15 2.35 2.35 ! 0.0000 357:20 Long 4.20, 4.59 A assign (resid 98 and name HN) (resid 98 and name HA) 3.15 1.35 1.35 ! 0.0000 358:20 Intra 2.77, 2.79 A assign (resid 101 and name HN) (resid 98 and name HA) 4.15 2.35 2.35 ! 0.0000 359:20 Mid 3.25, 3.50 A assign (resid 135 and name HN) (resid 137 and name HA) 4.15 2.35 2.35 ! 0.0000 360:20 Mid 6.09, 6.30 A assign (resid 174 and name HN) (resid 173 and name HB*) 4.15 2.35 2.35 ! 0.6627 361:20 Ambig 2.83, 3.83 A or (resid 138 and name HN) (resid 137 and name HA) ! 0.1963 361:20 ----- 3.46, 3.52 A or (resid 139 and name HN) (resid 137 and name HA) ! 0.1177 361:20 ----- 3.77, 3.97 A assign (resid 115 and name HN) (resid 114 and name HA) 2.65 0.85 0.85 ! 0.9980 362:20 Seq 2.22, 2.36 A assign (resid 24 and name HN) (resid 23 and name HA) 2.30 0.50 0.50 ! 0.9993 363:20 Seq 2.09, 2.15 A assign (resid 130 and name HN) (resid 126 and name HB*) 3.65 1.85 1.85 ! 0.0000 366:20 Mid 5.63, 6.29 A assign (resid 153 and name HN) (resid 8 and name HD1*) 3.65 1.85 1.85 ! 0.0000 367:20 Long 5.37, 5.98 A assign (resid 104 and name HD21) (resid 8 and name HD1*) 3.15 1.35 1.35 ! 0.9989 368:20 Long 1.96, 3.44 A assign (resid 115 and name HN) (resid 119 and name HD1*) 3.15 1.35 1.35 ! 0.5460 369:20 Ambig 4.96, 5.85 A or (resid 120 and name HN) (resid 119 and name HD1*) ! 0.4540 369:20 ----- 5.11, 5.85 A assign (resid 2 and name HN) (resid 2 and name HD1*) 3.15 1.35 1.35 ! 0.9525 370:20 Intra 3.24, 4.34 A assign (resid 3 and name HN) (resid 2 and name HD1*) 3.65 1.85 1.85 ! 0.8230 371:20 Ambig 4.06, 5.43 A or (resid 178 and name HN) (resid 2 and name HD1*) ! 0.1770 371:20 ----- 5.25, 7.22 A assign (resid 16 and name HN) (resid 20 and name HD1*) 3.65 1.85 1.85 ! 0.9004 372:20 Ambig 3.56, 4.60 A or (resid 2 and name HN) (resid 20 and name HD1*) ! 0.0996 372:20 ----- 5.14, 6.81 A assign (resid 82 and name HN) (resid 78 and name HA) 3.15 1.35 1.35 ! 0.7448 373:20 Ambig 2.68, 3.15 A or (resid 83 and name HN) (resid 78 and name HA) ! 0.2552 373:20 ----- 3.20, 3.95 A assign (resid 7 and name HN) (resid 7 and name HA) 3.15 1.35 1.35 ! 0.9952 374:20 Intra 2.85, 2.89 A assign (resid 76 and name HN) (resid 75 and name HA) 3.65 1.85 1.85 ! 0.8308 375:20 Ambig 3.52, 3.57 A or (resid 81 and name HN) (resid 75 and name HA) ! 0.0974 375:20 ----- 5.02, 6.25 A assign (resid 76 and name HN) (resid 75 and name HA) 3.65 1.85 1.85 ! 0.8553 376:20 Ambig 3.52, 3.57 A or (resid 73 and name HD22) (resid 75 and name HA) ! 0.1276 376:20 ----- 4.83, 5.23 A assign (resid 97 and name HN) (resid 97 and name HA) 3.15 1.35 1.35 ! 0.0000 377:20 Intra 2.76, 2.80 A assign (resid 97 and name HD1) (resid 97 and name HA) 3.15 1.35 1.35 ! 0.0000 380:20 Intra 3.02, 3.20 A assign (resid 132 and name HN) (resid 132 and name HA) 2.65 0.85 0.85 ! 0.0000 381:20 Intra 2.81, 2.84 A assign (resid 172 and name HN) (resid 171 and name HA) 2.65 0.85 0.85 ! 0.0000 382:20 Seq 2.10, 2.16 A assign (resid 97 and name HE3) (resid 98 and name HA) 3.15 1.35 1.35 ! 0.0000 384:20 Seq 2.53, 2.83 A assign (resid 102 and name HN) (resid 98 and name HA) 4.15 2.35 2.35 ! 0.0000 385:20 Mid 3.62, 4.04 A assign (resid 137 and name HN) (resid 137 and name HA) 2.65 0.85 0.85 ! 0.5512 386:20 Ambig 2.68, 2.74 A or (resid 122 and name HD*) (resid 173 and name HB*) ! 0.4190 386:20 ----- 2.80, 4.84 A assign (resid 114 and name HN) (resid 114 and name HA) 3.15 1.35 1.35 ! 0.9927 388:20 Intra 2.80, 2.88 A assign (resid 77 and name HN) (resid 76 and name HB2) 4.15 2.35 2.35 ! 0.9752 389:20 Seq 2.98, 3.50 A assign (resid 125 and name HN) (resid 126 and name HB*) 3.15 1.35 1.35 ! 0.5178 390:20 Ambig 4.53, 5.25 A or (resid 123 and name HN) (resid 126 and name HB*) ! 0.3895 390:20 ----- 4.75, 5.87 A or (resid 106 and name HN) (resid 126 and name HB*) ! 0.0927 390:20 ----- 6.03, 7.50 A assign (resid 126 and name HN) (resid 126 and name HB*) 2.65 0.85 0.85 ! 0.9891 391:20 Intra 2.41, 2.95 A assign (resid 110 and name HN) (resid 119 and name HD1*) 3.65 1.85 1.85 ! 0.0000 393:20 Long 4.23, 6.01 A assign (resid 119 and name HN) (resid 119 and name HD1*) 3.15 1.35 1.35 ! 0.0000 394:20 Intra 3.36, 4.27 A assign (resid 114 and name HN) (resid 119 and name HD1*) 3.65 1.85 1.85 ! 0.9936 395:20 Long 2.38, 3.76 A assign (resid 20 and name HN) (resid 20 and name HD1*) 3.15 1.35 1.35 ! 0.8196 396:20 Ambig 2.89, 4.82 A or (resid 19 and name HN) (resid 20 and name HD1*) ! 0.1804 396:20 ----- 3.72, 6.85 A assign (resid 18 and name HN) (resid 20 and name HD1*) 3.65 1.85 1.85 ! 0.0000 397:20 Mid 3.86, 5.13 A assign (resid 33 and name HN) (resid 31 and name HA) 3.65 1.85 1.85 ! 0.0000 398:20 Mid 3.29, 3.47 A assign (resid 81 and name HD*) (resid 75 and name HA) 3.15 1.35 1.35 ! 0.9193 399:20 Ambig 2.94, 5.78 A or (resid 74 and name HD21) (resid 75 and name HA) ! 0.0807 399:20 ----- 4.41, 5.24 A assign (resid 74 and name HD22) (resid 75 and name HA) 3.65 1.85 1.85 ! 0.0000 400:20 Seq 4.71, 5.13 A assign (resid 132 and name HD1) (resid 132 and name HA) 2.65 0.85 0.85 ! 0.0000 401:20 Intra 2.58, 2.81 A assign (resid 100 and name HN) (resid 97 and name HA) 3.15 1.35 1.35 ! 0.8400 403:20 Ambig 3.23, 3.44 A or (resid 99 and name HN) (resid 97 and name HA) ! 0.1478 403:20 ----- 4.32, 4.41 A assign (resid 97 and name HZ3) (resid 98 and name HA) 3.15 1.35 1.35 ! 0.4658 404:20 Ambig 3.43, 3.68 A or (resid 99 and name HN) (resid 98 and name HA) ! 0.4313 404:20 ----- 3.47, 3.52 A or (resid 100 and name HN) (resid 98 and name HA) ! 0.1029 404:20 ----- 4.41, 4.61 A assign (resid 101 and name HD*) (resid 98 and name HA) 3.65 1.85 1.85 ! 0.9600 406:20 Mid 3.50, 4.78 A assign (resid 140 and name HN) (resid 137 and name HA) 4.15 2.35 2.35 ! 0.0000 407:20 Mid 3.28, 3.61 A assign (resid 137 and name HD*) (resid 137 and name HA) 3.65 1.85 1.85 ! 0.9929 408:20 Intra 2.51, 3.55 A assign (resid 129 and name HD*) (resid 126 and name HB*) 3.15 1.35 1.35 ! 0.7572 410:20 Ambig 3.48, 5.79 A or (resid 122 and name HD*) (resid 126 and name HB*) ! 0.2428 410:20 ----- 4.20, 7.33 A assign (resid 101 and name HD*) (resid 8 and name HD1*) 3.15 1.35 1.35 ! 0.9945 412:20 Long 2.33, 5.09 A assign (resid 4 and name HD*) (resid 20 and name HD1*) 3.15 1.35 1.35 ! 0.0000 414:20 Long 2.69, 5.46 A assign (resid 33 and name HA) (resid 171 and name HA) 3.65 1.85 1.85 ! 0.0000 415:20 Long 2.36, 2.57 A assign (resid 4 and name HE*) (resid 20 and name HD1*) 2.65 0.85 0.85 ! 0.0000 417:20 Long 2.02, 4.89 A assign (resid 2 and name HA) (resid 2 and name HD1*) 2.65 0.85 0.85 ! 0.7553 422:20 Ambig 2.14, 3.56 A or (resid 179 and name HA) (resid 2 and name HD1*) ! 0.2447 422:20 ----- 2.58, 4.37 A assign (resid 21 and name HA) (resid 20 and name HD1*) 4.15 2.35 2.35 ! 0.0000 423:20 Seq 6.97, 7.57 A assign (resid 16 and name HA) (resid 20 and name HD1*) 2.65 0.85 0.85 ! 0.0000 424:20 Mid 2.01, 3.11 A assign (resid 32 and name HA1) (resid 31 and name HA) 3.65 1.85 1.85 ! 0.0000 425:20 Seq 4.31, 4.36 A assign (resid 89 and name HA) (resid 89 and name HB2) 2.65 0.85 0.85 ! 0.9927 429:20 Intra 2.49, 2.55 A assign (resid 89 and name HA) (resid 89 and name HB1) 2.65 0.85 0.85 ! 0.9948 430:20 Intra 2.33, 2.38 A assign (resid 97 and name HA) (resid 98 and name HA) 3.65 1.85 1.85 ! 0.5502 433:20 Ambig 4.78, 4.84 A or (resid 101 and name HA) (resid 98 and name HA) ! 0.4498 433:20 ----- 4.94, 5.22 A assign (resid 9 and name HA) (resid 9 and name HB2) 3.65 1.85 1.85 ! 0.9911 434:20 Intra 2.49, 2.51 A assign (resid 6 and name HA) (resid 7 and name HA) 3.65 1.85 1.85 ! 0.9524 437:20 Seq 4.23, 4.27 A assign (resid 123 and name HA) (resid 126 and name HB*) 2.65 0.85 0.85 ! 0.9861 443:20 Mid 2.17, 3.12 A assign (resid 8 and name HA) (resid 8 and name HD1*) 3.15 1.35 1.35 ! 0.9988 444:20 Intra 2.20, 3.12 A assign (resid 110 and name HA) (resid 119 and name HD1*) 2.65 0.85 0.85 ! 0.9807 445:20 Long 2.19, 3.94 A assign (resid 19 and name HA) (resid 20 and name HD1*) 3.65 1.85 1.85 ! 0.0000 447:20 Seq 3.49, 6.24 A assign (resid 20 and name HA) (resid 20 and name HD1*) 3.15 1.35 1.35 ! 0.7138 449:20 Ambig 3.39, 4.64 A or (resid 3 and name HA) (resid 20 and name HD1*) ! 0.1935 449:20 ----- 4.21, 5.54 A or (resid 18 and name HA) (resid 20 and name HD1*) ! 0.0927 449:20 ----- 4.76, 7.21 A assign (resid 82 and name HA) (resid 78 and name HA) 2.65 0.85 0.85 ! 0.0000 450:20 Mid 1.92, 2.15 A assign (resid 80 and name HB*) (resid 75 and name HA) 4.15 2.35 2.35 ! 0.0000 451:20 Long 4.80, 6.46 A assign (resid 132 and name HB1) (resid 132 and name HA) 3.15 1.35 1.35 ! 0.9940 452:20 Intra 3.01, 3.02 A assign (resid 97 and name HB*) (resid 97 and name HA) 2.30 0.50 0.50 ! 0.9825 453:20 Intra 2.44, 2.75 A assign (resid 127 and name HD2) (resid 126 and name HB*) 2.30 0.50 0.50 ! 0.0000 455:20 Seq 2.66, 3.63 A assign (resid 105 and name HA) (resid 8 and name HD1*) 3.65 1.85 1.85 ! 0.0000 457:20 Long 4.84, 6.07 A assign (resid 104 and name HB2) (resid 8 and name HD1*) 2.65 0.85 0.85 ! 0.0000 458:20 Long 2.17, 2.68 A assign (resid 119 and name HA) (resid 119 and name HD1*) 2.65 0.85 0.85 ! 0.8001 459:20 Ambig 2.04, 2.99 A or (resid 116 and name HA) (resid 119 and name HD1*) ! 0.1999 459:20 ----- 2.57, 5.22 A assign (resid 16 and name HB2) (resid 20 and name HD1*) 3.65 1.85 1.85 ! 0.0000 460:20 Mid 3.26, 4.85 A assign (resid 150 and name HB2) (resid 150 and name HA) 2.30 0.50 0.50 ! 0.9936 461:20 Intra 2.71, 2.74 A assign (resid 150 and name HB1) (resid 150 and name HA) 2.65 0.85 0.85 ! 0.9874 462:20 Intra 2.27, 2.30 A assign (resid 31 and name HB1) (resid 31 and name HA) 2.30 0.50 0.50 ! 0.9965 463:20 Intra 2.25, 2.28 A assign (resid 78 and name HB1) (resid 78 and name HA) 2.65 0.85 0.85 ! 0.0000 464:20 Intra 2.29, 2.31 A assign (resid 7 and name HB) (resid 7 and name HA) 2.65 0.85 0.85 ! 0.9832 465:20 Intra 3.03, 3.04 A assign (resid 8 and name HB) (resid 8 and name HA) 3.15 1.35 1.35 ! 0.8077 466:20 Ambig 3.02, 3.03 A or (resid 7 and name HB) (resid 8 and name HA) ! 0.1290 466:20 ----- 4.10, 4.25 A assign (resid 135 and name HB1) (resid 132 and name HA) 3.15 1.35 1.35 ! 0.8549 468:20 Ambig 3.67, 4.06 A or (resid 25 and name HG*) (resid 132 and name HA) ! 0.0840 468:20 ----- 5.41, 7.22 A assign (resid 135 and name HB2) (resid 132 and name HA) 3.15 1.35 1.35 ! 0.0000 469:20 Mid 2.05, 2.46 A assign (resid 100 and name HB2) (resid 97 and name HA) 3.15 1.35 1.35 ! 0.0000 470:20 Mid 2.18, 2.73 A assign (resid 100 and name HB1) (resid 97 and name HA) 3.65 1.85 1.85 ! 0.8858 471:20 Ambig 3.64, 4.29 A or (resid 93 and name HG*) (resid 97 and name HA) ! 0.0822 471:20 ----- 5.40, 7.82 A assign (resid 171 and name HB) (resid 171 and name HA) 3.65 1.85 1.85 ! 0.0000 472:20 Intra 3.03, 3.04 A assign (resid 101 and name HB2) (resid 98 and name HA) 3.15 1.35 1.35 ! 0.9979 473:20 Mid 2.58, 3.11 A assign (resid 137 and name HB2) (resid 137 and name HA) 3.65 1.85 1.85 ! 0.9810 474:20 Intra 2.36, 2.45 A assign (resid 83 and name HB2) (resid 76 and name HB2) 2.65 0.85 0.85 ! 0.6178 476:20 Ambig 2.34, 3.08 A or (resid 76 and name HA) (resid 76 and name HB2) ! 0.3797 476:20 ----- 2.54, 2.60 A assign (resid 83 and name HB2) (resid 76 and name HB1) 3.65 1.85 1.85 ! 0.9010 477:20 Ambig 2.67, 3.34 A or (resid 165 and name HB2) (resid 76 and name HB1) ! 0.0757 477:20 ----- 4.03, 6.53 A assign (resid 126 and name HA) (resid 126 and name HB*) 2.30 0.50 0.50 ! 0.8975 478:20 Ambig 2.38, 2.63 A or (resid 123 and name HG2) (resid 126 and name HB*) ! 0.1025 478:20 ----- 3.42, 4.44 A assign (resid 104 and name HB1) (resid 8 and name HD1*) 2.65 0.85 0.85 ! 0.9387 479:20 Long 2.57, 3.52 A assign (resid 7 and name HB) (resid 8 and name HD1*) 2.65 0.85 0.85 ! 0.7923 480:20 Ambig 2.98, 3.94 A or (resid 8 and name HB) (resid 8 and name HD1*) ! 0.2019 480:20 ----- 3.75, 3.96 A assign (resid 16 and name HB1) (resid 20 and name HD1*) 3.65 1.85 1.85 ! 0.9289 481:20 Mid 3.12, 4.93 A assign (resid 31 and name HB2) (resid 31 and name HA) 2.65 0.85 0.85 ! 0.9944 482:20 Intra 2.67, 2.71 A assign (resid 82 and name HB*) (resid 78 and name HA) 2.65 0.85 0.85 ! 0.0000 483:20 Mid 2.03, 3.29 A assign (resid 78 and name HG1) (resid 78 and name HA) 2.65 0.85 0.85 ! 0.5311 484:20 Ambig 2.80, 2.94 A or (resid 78 and name HB2) (resid 78 and name HA) ! 0.3789 484:20 ----- 2.96, 2.97 A or (resid 78 and name HG2) (resid 78 and name HA) ! 0.0804 484:20 ----- 3.83, 3.92 A assign (resid 75 and name HB) (resid 75 and name HA) 3.65 1.85 1.85 ! 0.9374 485:20 Intra 2.97, 3.02 A assign (resid 176 and name HD*) (resid 7 and name HA) 3.15 1.35 1.35 ! 0.9099 487:20 Ambig 2.86, 4.40 A or (resid 176 and name HB*) (resid 7 and name HA) ! 0.0803 487:20 ----- 4.28, 5.45 A assign (resid 176 and name HG*) (resid 7 and name HA) 3.15 1.35 1.35 ! 0.9732 488:20 Long 2.62, 4.18 A assign (resid 8 and name HG12) (resid 8 and name HA) 2.65 0.85 0.85 ! 0.0000 489:20 Intra 3.22, 3.29 A assign (resid 99 and name HD*) (resid 96 and name HB*) 4.15 2.35 2.35 ! 0.0000 490:20 Mid 4.02, 6.06 A assign (resid 172 and name HB2) (resid 171 and name HA) 3.15 1.35 1.35 ! 0.3934 492:20 Ambig 4.38, 4.45 A or (resid 178 and name HB) (resid 177 and name HA) ! 0.3102 492:20 ----- 4.56, 4.68 A or (resid 170 and name HB2) (resid 171 and name HA) ! 0.2964 492:20 ----- 4.59, 4.88 A assign (resid 71 and name HD*) (resid 69 and name HA) 3.65 1.85 1.85 ! 0.3867 493:20 Ambig 3.92, 6.41 A or (resid 71 and name HG1) (resid 69 and name HA) ! 0.2735 493:20 ----- 4.15, 6.05 A or (resid 68 and name HB*) (resid 69 and name HA) ! 0.2275 493:20 ----- 4.28, 5.16 A or (resid 160 and name HG*) (resid 167 and name HA) ! 0.0947 493:20 ----- 4.96, 6.99 A assign (resid 42 and name HB*) (resid 43 and name HA) 4.15 2.35 2.35 ! 0.0000 495:20 Seq 4.76, 5.29 A assign (resid 69 and name HG2*) (resid 69 and name HA) 2.65 0.85 0.85 ! 0.5023 496:20 Ambig 2.40, 3.13 A or (resid 167 and name HG2*) (resid 167 and name HA) ! 0.4977 496:20 ----- 2.40, 3.03 A assign (resid 98 and name HB) (resid 98 and name HA) 2.65 0.85 0.85 ! 0.9677 498:20 Intra 3.04, 3.05 A assign (resid 140 and name HG) (resid 137 and name HA) 3.65 1.85 1.85 ! 0.9935 500:20 Mid 2.08, 2.60 A assign (resid 140 and name HB2) (resid 137 and name HA) 3.65 1.85 1.85 ! 0.9543 501:20 Mid 2.34, 2.91 A assign (resid 35 and name HB1) (resid 23 and name HA) 4.15 2.35 2.35 ! 0.9845 502:20 Long 2.28, 2.97 A assign (resid 114 and name HB) (resid 114 and name HA) 2.65 0.85 0.85 ! 0.9331 503:20 Intra 3.04, 3.06 A assign (resid 115 and name HB*) (resid 114 and name HA) 3.15 1.35 1.35 ! 0.0000 504:20 Seq 4.40, 5.10 A assign (resid 24 and name HB2) (resid 23 and name HA) 3.65 1.85 1.85 ! 0.7329 505:20 Ambig 4.49, 4.61 A or (resid 29 and name HB*) (resid 23 and name HA) ! 0.2671 505:20 ----- 5.31, 6.19 A assign (resid 23 and name HB) (resid 23 and name HA) 3.15 1.35 1.35 ! 0.9698 506:20 Intra 3.01, 3.03 A assign (resid 109 and name HG) (resid 126 and name HB*) 3.15 1.35 1.35 ! 0.4272 507:20 Ambig 4.11, 5.38 A or (resid 125 and name HB2) (resid 126 and name HB*) ! 0.2715 507:20 ----- 4.43, 5.37 A or (resid 127 and name HG2) (resid 126 and name HB*) ! 0.1748 507:20 ----- 4.77, 5.69 A or (resid 123 and name HB2) (resid 126 and name HB*) ! 0.1266 507:20 ----- 5.03, 5.72 A assign (resid 101 and name HB1) (resid 8 and name HD1*) 3.15 1.35 1.35 ! 0.4900 508:20 Ambig 4.67, 5.68 A or (resid 105 and name HB) (resid 8 and name HD1*) ! 0.3939 508:20 ----- 4.85, 6.52 A or (resid 152 and name HB*) (resid 8 and name HD1*) ! 0.1160 508:20 ----- 5.94, 7.26 A assign (resid 8 and name HG12) (resid 8 and name HD1*) 2.65 0.85 0.85 ! 0.0000 509:20 Intra 2.35, 2.62 A assign (resid 114 and name HB) (resid 119 and name HD1*) 2.30 0.50 0.50 ! 0.6814 510:20 Ambig 2.07, 2.84 A or (resid 119 and name HG12) (resid 119 and name HD1*) ! 0.3186 510:20 ----- 2.35, 2.62 A assign (resid 2 and name HG11) (resid 2 and name HD1*) 2.30 0.50 0.50 ! 0.0000 511:20 Intra 2.40, 2.62 A assign (resid 20 and name HG11) (resid 20 and name HD1*) 2.30 0.50 0.50 ! 0.5090 512:20 Ambig 2.39, 2.63 A or (resid 20 and name HB) (resid 20 and name HD1*) ! 0.4871 512:20 ----- 2.41, 3.17 A assign (resid 154 and name HD1*) (resid 150 and name HA) 3.65 1.85 1.85 ! 0.0000 513:20 Mid 1.93, 3.18 A assign (resid 75 and name HG2*) (resid 75 and name HA) 2.30 0.50 0.50 ! 0.0000 514:20 Intra 2.44, 3.19 A assign (resid 7 and name HG1*) (resid 7 and name HA) 2.30 0.50 0.50 ! 0.5083 515:20 Ambig 2.48, 3.13 A or (resid 7 and name HG2*) (resid 7 and name HA) ! 0.4906 515:20 ----- 2.49, 3.15 A assign (resid 75 and name HG1*) (resid 75 and name HA) 2.65 0.85 0.85 ! 0.0000 516:20 Intra 2.40, 3.09 A assign (resid 114 and name HG2*) (resid 112 and name HB*) 3.15 1.35 1.35 ! 0.0000 517:20 Mid 2.10, 3.82 A assign (resid 8 and name HG2*) (resid 8 and name HA) 2.30 0.50 0.50 ! 0.9181 518:20 Ambig 2.40, 3.03 A or (resid 7 and name HG1*) (resid 8 and name HA) ! 0.0777 518:20 ----- 3.62, 4.83 A assign (resid 171 and name HG2*) (resid 171 and name HA) 2.65 0.85 0.85 ! 0.0000 520:20 Intra 2.56, 3.19 A assign (resid 3 and name HG1*) (resid 177 and name HA) 3.15 1.35 1.35 ! 0.6980 521:20 Ambig 4.76, 5.89 A or (resid 3 and name HG2*) (resid 177 and name HA) ! 0.2073 521:20 ----- 5.83, 6.98 A or (resid 13 and name HG2*) (resid 177 and name HA) ! 0.0947 521:20 ----- 6.64, 7.71 A assign (resid 33 and name HD2*) (resid 171 and name HA) 2.30 0.50 0.50 ! 0.9933 522:20 Long 1.87, 2.76 A assign (resid 98 and name HG1*) (resid 98 and name HA) 2.65 0.85 0.85 ! 0.9859 523:20 Intra 2.58, 3.20 A assign (resid 98 and name HG2*) (resid 98 and name HA) 2.65 0.85 0.85 ! 0.8980 524:20 Ambig 2.46, 3.11 A or (resid 102 and name HG2*) (resid 98 and name HA) ! 0.1020 524:20 ----- 3.54, 5.02 A assign (resid 140 and name HD1*) (resid 137 and name HA) 2.65 0.85 0.85 ! 0.9587 526:20 Mid 1.97, 2.94 A assign (resid 114 and name HG2*) (resid 114 and name HA) 2.30 0.50 0.50 ! 0.0000 527:20 Intra 2.46, 3.19 A assign (resid 23 and name HG2*) (resid 23 and name HA) 2.65 0.85 0.85 ! 0.0000 529:20 Intra 2.45, 3.16 A assign (resid 23 and name HG1*) (resid 23 and name HA) 2.65 0.85 0.85 ! 0.0000 531:20 Intra 2.47, 3.11 A assign (resid 105 and name HG2*) (resid 8 and name HD1*) 2.65 0.85 0.85 ! 0.0000 532:20 Long 2.73, 5.38 A assign (resid 173 and name HN) (resid 173 and name HA) 3.65 1.85 1.85 ! 0.0000 533:20 Intra 2.84, 2.87 A assign (resid 21 and name HN) (resid 20 and name HA) 2.65 0.85 0.85 ! 0.9956 535:20 Seq 2.10, 2.16 A assign (resid 147 and name HN) (resid 146 and name HA) 4.15 2.35 2.35 ! 0.8976 536:20 Ambig 3.47, 3.52 A or (resid 147 and name HN) (resid 81 and name HA) ! 0.1024 536:20 ----- 4.98, 5.94 A assign (resid 9 and name HN) (resid 9 and name HA) 3.65 1.85 1.85 ! 0.0000 537:20 Intra 2.87, 2.90 A assign (resid 8 and name HN) (resid 9 and name HA) 3.65 1.85 1.85 ! 0.0000 538:20 Seq 4.98, 5.16 A assign (resid 117 and name HN) (resid 117 and name HA) 3.65 1.85 1.85 ! 0.0000 539:20 Intra 2.77, 2.82 A assign (resid 79 and name HN) (resid 79 and name HB1) 3.65 1.85 1.85 ! 0.0000 540:20 Intra 2.47, 3.10 A assign (resid 146 and name HN) (resid 146 and name HA) 3.15 1.35 1.35 ! 0.8642 541:20 Ambig 2.74, 2.78 A or (resid 146 and name HN) (resid 81 and name HA) ! 0.1358 541:20 ----- 3.73, 4.83 A assign (resid 178 and name HN) (resid 177 and name HA) 2.30 0.50 0.50 ! 0.9869 542:20 Seq 2.10, 2.14 A assign (resid 43 and name HN) (resid 43 and name HA) 2.65 0.85 0.85 ! 0.9663 543:20 Intra 2.81, 2.89 A assign (resid 101 and name HN) (resid 101 and name HA) 2.65 0.85 0.85 ! 0.0000 545:20 Intra 2.75, 2.78 A assign (resid 30 and name HN) (resid 30 and name HA) 3.15 1.35 1.35 ! 0.0000 547:20 Intra 2.89, 2.91 A assign (resid 98 and name HN) (resid 99 and name HA) 4.15 2.35 2.35 ! 0.0000 548:20 Seq 5.29, 5.37 A assign (resid 104 and name HN) (resid 103 and name HA) 3.15 1.35 1.35 ! 0.6468 549:20 Ambig 3.53, 3.56 A or (resid 135 and name HN) (resid 131 and name HA) ! 0.2920 549:20 ----- 4.03, 4.28 A assign (resid 120 and name HN) (resid 120 and name HA) 3.15 1.35 1.35 ! 0.7569 550:20 Ambig 2.79, 2.81 A or (resid 111 and name HN) (resid 110 and name HA) ! 0.2431 550:20 ----- 3.37, 3.47 A assign (resid 109 and name HN) (resid 106 and name HA) 4.15 2.35 2.35 ! 0.0000 551:20 Mid 2.98, 3.32 A assign (resid 167 and name HN) (resid 166 and name HA) 2.65 0.85 0.85 ! 0.9973 552:20 Seq 2.06, 2.12 A assign (resid 95 and name HN) (resid 95 and name HA) 3.15 1.35 1.35 ! 0.0000 553:20 Intra 2.83, 2.85 A assign (resid 20 and name HN) (resid 20 and name HA) 3.65 1.85 1.85 ! 0.9662 555:20 Intra 2.91, 2.94 A assign (resid 82 and name HN) (resid 81 and name HA) 3.65 1.85 1.85 ! 0.9039 556:20 Ambig 3.41, 3.51 A or (resid 83 and name HN) (resid 81 and name HA) ! 0.0477 556:20 ----- 5.57, 6.22 A assign (resid 81 and name HN) (resid 81 and name HA) 3.65 1.85 1.85 ! 0.0000 557:20 Intra 2.88, 2.90 A assign (resid 118 and name HN) (resid 117 and name HA) 3.65 1.85 1.85 ! 0.0000 558:20 Seq 3.42, 3.48 A assign (resid 110 and name HN) (resid 110 and name HA) 2.65 0.85 0.85 ! 0.7101 559:20 Ambig 2.86, 2.88 A or (resid 123 and name HN) (resid 120 and name HA) ! 0.2337 559:20 ----- 3.44, 3.58 A assign (resid 121 and name HN) (resid 120 and name HA) 3.15 1.35 1.35 ! 0.5432 561:20 Ambig 3.47, 3.52 A or (resid 112 and name HN) (resid 110 and name HA) ! 0.4568 561:20 ----- 3.58, 3.85 A assign (resid 114 and name HN) (resid 110 and name HA) 3.65 1.85 1.85 ! 0.9078 562:20 Ambig 4.54, 5.31 A or (resid 118 and name HN) (resid 120 and name HA) ! 0.0922 562:20 ----- 6.65, 6.78 A assign (resid 107 and name HE22) (resid 103 and name HA) 3.65 1.85 1.85 ! 0.0000 563:20 Mid 3.15, 3.93 A assign (resid 106 and name HN) (resid 103 and name HA) 3.15 1.35 1.35 ! 0.5497 564:20 Ambig 3.20, 3.54 A or (resid 102 and name HN) (resid 99 and name HA) ! 0.4197 564:20 ----- 3.35, 3.74 A assign (resid 121 and name HN) (resid 121 and name HA) 2.65 0.85 0.85 ! 0.0000 565:20 Intra 2.82, 2.85 A assign (resid 94 and name HN) (resid 93 and name HA) 3.65 1.85 1.85 ! 0.0000 566:20 Seq 3.39, 3.49 A assign (resid 172 and name HN) (resid 172 and name HA) 3.65 1.85 1.85 ! 0.0000 567:20 Intra 2.75, 2.85 A assign (resid 156 and name HN) (resid 155 and name HA) 3.15 1.35 1.35 ! 0.9990 568:20 Seq 2.10, 2.14 A assign (resid 106 and name HN) (resid 106 and name HA) 2.65 0.85 0.85 ! 0.7832 569:20 Ambig 2.77, 2.81 A or (resid 110 and name HN) (resid 106 and name HA) ! 0.1141 569:20 ----- 3.82, 4.33 A or (resid 108 and name HN) (resid 106 and name HA) ! 0.1027 569:20 ----- 3.89, 4.18 A assign (resid 97 and name HN) (resid 94 and name HA) 3.65 1.85 1.85 ! 0.0000 570:20 Mid 2.93, 3.15 A assign (resid 94 and name HN) (resid 94 and name HA) 3.65 1.85 1.85 ! 0.8721 571:20 Ambig 2.80, 2.84 A or (resid 97 and name HE3) (resid 94 and name HA) ! 0.1279 571:20 ----- 3.85, 4.27 A assign (resid 81 and name HN) (resid 80 and name HB*) 2.65 0.85 0.85 ! 0.8659 572:20 Ambig 1.83, 2.58 A or (resid 80 and name HN) (resid 80 and name HB*) ! 0.1333 572:20 ----- 2.50, 3.19 A assign (resid 96 and name HN) (resid 95 and name HA) 3.65 1.85 1.85 ! 0.0000 573:20 Seq 3.45, 3.50 A assign (resid 81 and name HD*) (resid 81 and name HA) 2.65 0.85 0.85 ! 0.0000 574:20 Intra 2.85, 3.51 A assign (resid 101 and name HD*) (resid 101 and name HA) 2.65 0.85 0.85 ! 0.9675 575:20 Intra 2.43, 3.52 A assign (resid 131 and name HN) (resid 131 and name HA) 2.30 0.50 0.50 ! 0.4559 576:20 Ambig 2.74, 2.78 A or (resid 99 and name HN) (resid 99 and name HA) ! 0.4400 576:20 ----- 2.76, 2.82 A or (resid 100 and name HN) (resid 99 and name HA) ! 0.1005 576:20 ----- 3.53, 3.55 A assign (resid 103 and name HN) (resid 103 and name HA) 2.65 0.85 0.85 ! 0.7112 577:20 Ambig 2.78, 2.81 A or (resid 107 and name HE21) (resid 103 and name HA) ! 0.1937 577:20 ----- 3.45, 4.85 A or (resid 103 and name HN) (resid 99 and name HA) ! 0.0882 577:20 ----- 3.93, 4.20 A assign (resid 175 and name HD*) (resid 172 and name HA) 3.65 1.85 1.85 ! 0.9448 578:20 Mid 3.72, 5.89 A assign (resid 81 and name HD*) (resid 80 and name HB*) 3.65 1.85 1.85 ! 0.0000 582:20 Seq 2.40, 4.49 A assign (resid 14 and name HN) (resid 14 and name HA) 3.15 1.35 1.35 ! 0.0000 584:20 Intra 2.77, 2.81 A assign (resid 15 and name HN) (resid 14 and name HA) 3.15 1.35 1.35 ! 0.0000 585:20 Seq 2.20, 2.34 A assign (resid 35 and name HA) (resid 20 and name HA) 4.15 2.35 2.35 ! 0.0000 587:20 Long 6.03, 6.32 A assign (resid 4 and name HE*) (resid 172 and name HA) 2.65 0.85 0.85 ! 0.0000 588:20 Long 2.30, 4.43 A assign (resid 89 and name HB1) (resid 89 and name HA) 2.30 0.50 0.50 ! 0.5865 589:20 Ambig 2.33, 2.38 A or (resid 89 and name HB2) (resid 89 and name HA) ! 0.4008 589:20 ----- 2.49, 2.55 A assign (resid 79 and name HA) (resid 79 and name HB1) 2.65 0.85 0.85 ! 0.0000 593:20 Intra 2.30, 2.47 A assign (resid 79 and name HA) (resid 79 and name HB2) 2.65 0.85 0.85 ! 0.0000 594:20 Intra 2.45, 2.78 A assign (resid 80 and name HA) (resid 80 and name HB*) 2.65 0.85 0.85 ! 0.9771 597:20 Intra 2.41, 2.74 A assign (resid 173 and name HB*) (resid 173 and name HA) 2.65 0.85 0.85 ! 0.0000 598:20 Intra 2.38, 2.71 A assign (resid 146 and name HE*) (resid 146 and name HA) 4.15 2.35 2.35 ! 0.0000 599:20 Intra 1.90, 4.88 A assign (resid 80 and name HB*) (resid 81 and name HA) 3.15 1.35 1.35 ! 0.0000 600:20 Seq 4.27, 4.45 A assign (resid 9 and name HB2) (resid 9 and name HA) 2.65 0.85 0.85 ! 0.0000 601:20 Intra 2.49, 2.51 A assign (resid 106 and name HD*) (resid 106 and name HA) 3.65 1.85 1.85 ! 0.9987 602:20 Intra 2.12, 4.48 A assign (resid 81 and name HB*) (resid 81 and name HA) 3.65 1.85 1.85 ! 0.9930 603:20 Intra 2.45, 2.76 A assign (resid 146 and name HB2) (resid 146 and name HA) 2.30 0.50 0.50 ! 0.9227 604:20 Intra 2.39, 2.50 A assign (resid 101 and name HB2) (resid 101 and name HA) 2.65 0.85 0.85 ! 0.0000 605:20 Intra 2.42, 2.49 A assign (resid 117 and name HG1) (resid 117 and name HA) 2.65 0.85 0.85 ! 0.0000 606:20 Intra 2.47, 2.88 A assign (resid 106 and name HB*) (resid 103 and name HA) 2.30 0.50 0.50 ! 0.5917 607:20 Ambig 2.41, 3.53 A or (resid 134 and name HB) (resid 131 and name HA) ! 0.3996 607:20 ----- 2.57, 3.01 A assign (resid 93 and name HB2) (resid 93 and name HA) 2.30 0.50 0.50 ! 0.5522 608:20 Ambig 2.37, 2.74 A or (resid 93 and name HG*) (resid 93 and name HA) ! 0.4478 608:20 ----- 2.45, 3.20 A assign (resid 106 and name HB*) (resid 106 and name HA) 2.30 0.50 0.50 ! 0.9910 609:20 Intra 2.41, 2.75 A assign (resid 94 and name HB1) (resid 94 and name HA) 3.65 1.85 1.85 ! 0.0000 610:20 Intra 3.01, 3.03 A assign (resid 159 and name HB2) (resid 166 and name HA) 3.65 1.85 1.85 ! 0.9361 611:20 Long 4.91, 5.28 A assign (resid 20 and name HG11) (resid 20 and name HA) 2.65 0.85 0.85 ! 0.8164 612:20 Ambig 2.36, 3.03 A or (resid 20 and name HB) (resid 20 and name HA) ! 0.1836 612:20 ----- 3.03, 3.04 A assign (resid 146 and name HD*) (resid 146 and name HA) 3.15 1.35 1.35 ! 0.9962 613:20 Intra 2.05, 4.11 A assign (resid 146 and name HG*) (resid 146 and name HA) 3.15 1.35 1.35 ! 0.9451 614:20 Intra 2.47, 3.03 A assign (resid 82 and name HB*) (resid 146 and name HA) 3.15 1.35 1.35 ! 0.6809 615:20 Ambig 3.70, 5.40 A or (resid 82 and name HB*) (resid 81 and name HA) ! 0.1942 615:20 ----- 4.56, 5.26 A or (resid 84 and name HG2*) (resid 146 and name HA) ! 0.1250 615:20 ----- 4.91, 6.85 A assign (resid 43 and name HB) (resid 43 and name HA) 2.30 0.50 0.50 ! 0.4452 617:20 Ambig 3.03, 3.04 A or (resid 50 and name HB) (resid 50 and name HA) ! 0.4406 617:20 ----- 3.03, 3.05 A or (resid 72 and name HB*) (resid 43 and name HA) ! 0.0682 617:20 ----- 4.14, 6.19 A assign (resid 48 and name HB) (resid 48 and name HA) 3.15 1.35 1.35 ! 0.5959 618:20 Ambig 3.03, 3.05 A or (resid 146 and name HD*) (resid 147 and name HA) ! 0.4041 618:20 ----- 3.23, 5.62 A assign (resid 30 and name HB) (resid 30 and name HA) 3.15 1.35 1.35 ! 0.7033 619:20 Ambig 3.04, 3.05 A or (resid 128 and name HG2*) (resid 30 and name HA) ! 0.1986 619:20 ----- 3.76, 4.52 A or (resid 23 and name HB) (resid 30 and name HA) ! 0.0845 619:20 ----- 4.33, 4.63 A assign (resid 30 and name HB) (resid 30 and name HA) 2.65 0.85 0.85 ! 0.6823 620:20 Ambig 3.04, 3.05 A or (resid 128 and name HG2*) (resid 30 and name HA) ! 0.1927 620:20 ----- 3.76, 4.52 A or (resid 23 and name HB) (resid 30 and name HA) ! 0.0820 620:20 ----- 4.33, 4.63 A assign (resid 110 and name HB*) (resid 110 and name HA) 2.30 0.50 0.50 ! 0.5231 621:20 Ambig 2.38, 2.60 A or (resid 120 and name HB*) (resid 120 and name HA) ! 0.4636 621:20 ----- 2.43, 2.75 A assign (resid 99 and name HB*) (resid 99 and name HA) 2.30 0.50 0.50 ! 0.3421 622:20 Ambig 2.40, 2.77 A or (resid 103 and name HB2) (resid 103 and name HA) ! 0.3123 622:20 ----- 2.44, 2.79 A or (resid 131 and name HB1) (resid 131 and name HA) ! 0.3066 622:20 ----- 2.45, 2.88 A assign (resid 120 and name HD*) (resid 120 and name HA) 2.30 0.50 0.50 ! 0.7512 623:20 Ambig 1.97, 2.55 A or (resid 110 and name HG*) (resid 110 and name HA) ! 0.1698 623:20 ----- 2.52, 3.25 A assign (resid 99 and name HG1) (resid 99 and name HA) 2.30 0.50 0.50 ! 0.5062 624:20 Ambig 2.45, 2.91 A or (resid 103 and name HG1) (resid 103 and name HA) ! 0.4565 624:20 ----- 2.49, 2.77 A assign (resid 121 and name HB*) (resid 121 and name HA) 2.30 0.50 0.50 ! 0.9953 625:20 Intra 2.37, 2.75 A assign (resid 121 and name HG1) (resid 121 and name HA) 3.15 1.35 1.35 ! 0.9800 626:20 Intra 3.31, 3.71 A assign (resid 172 and name HD*) (resid 172 and name HA) 3.65 1.85 1.85 ! 0.9611 627:20 Intra 4.17, 4.62 A assign (resid 172 and name HG*) (resid 172 and name HA) 2.65 0.85 0.85 ! 0.0000 628:20 Intra 2.52, 2.83 A assign (resid 109 and name HB2) (resid 106 and name HA) 3.15 1.35 1.35 ! 0.9950 629:20 Mid 2.19, 2.51 A assign (resid 95 and name HB*) (resid 95 and name HA) 2.30 0.50 0.50 ! 0.5657 630:20 Ambig 2.44, 2.75 A or (resid 98 and name HB) (resid 95 and name HA) ! 0.4343 630:20 ----- 2.55, 2.80 A assign (resid 95 and name HD*) (resid 95 and name HA) 2.65 0.85 0.85 ! 0.9125 631:20 Ambig 1.96, 2.59 A or (resid 95 and name HG2) (resid 95 and name HA) ! 0.0785 631:20 ----- 2.95, 3.12 A assign (resid 95 and name HG1) (resid 95 and name HA) 3.15 1.35 1.35 ! 0.0000 632:20 Intra 3.72, 3.77 A assign (resid 14 and name HB) (resid 14 and name HA) 3.15 1.35 1.35 ! 0.9945 633:20 Intra 2.40, 2.53 A assign (resid 20 and name HG12) (resid 20 and name HA) 3.65 1.85 1.85 ! 0.0000 634:20 Intra 2.45, 2.62 A assign (resid 36 and name HG1*) (resid 20 and name HA) 2.30 0.50 0.50 ! 0.4993 635:20 Ambig 2.78, 4.57 A or (resid 36 and name HG2*) (resid 20 and name HA) ! 0.4785 635:20 ----- 2.80, 4.19 A assign (resid 18 and name HD1*) (resid 81 and name HA) 4.15 2.35 2.35 ! 0.0000 637:20 Long 5.93, 7.58 A assign (resid 50 and name HD1*) (resid 50 and name HA) 2.30 0.50 0.50 ! 0.5415 638:20 Ambig 2.12, 3.95 A or (resid 43 and name HG1*) (resid 43 and name HA) ! 0.2206 638:20 ----- 2.46, 3.13 A or (resid 43 and name HG2*) (resid 43 and name HA) ! 0.2180 638:20 ----- 2.46, 3.20 A assign (resid 177 and name HG2*) (resid 177 and name HA) 2.30 0.50 0.50 ! 0.9916 639:20 Intra 2.59, 3.22 A assign (resid 177 and name HG1*) (resid 177 and name HA) 2.65 0.85 0.85 ! 0.9444 640:20 Intra 2.46, 3.10 A assign (resid 8 and name HG2*) (resid 101 and name HA) 3.15 1.35 1.35 ! 0.8377 641:20 Ambig 3.96, 5.27 A or (resid 7 and name HG1*) (resid 101 and name HA) ! 0.0674 641:20 ----- 6.02, 7.09 A or (resid 7 and name HG2*) (resid 101 and name HA) ! 0.0354 641:20 ----- 6.70, 7.84 A assign (resid 30 and name HG2*) (resid 30 and name HA) 2.65 0.85 0.85 ! 0.0000 642:20 Intra 2.51, 3.18 A assign (resid 30 and name HG1*) (resid 30 and name HA) 2.65 0.85 0.85 ! 0.9806 643:20 Intra 2.47, 3.10 A assign (resid 102 and name HG2*) (resid 99 and name HA) 3.15 1.35 1.35 ! 0.5310 644:20 Ambig 3.21, 4.51 A or (resid 134 and name HG2*) (resid 131 and name HA) ! 0.4597 644:20 ----- 3.29, 4.27 A assign (resid 119 and name HG2*) (resid 110 and name HA) 2.65 0.85 0.85 ! 0.5896 645:20 Ambig 2.89, 4.74 A or (resid 119 and name HG2*) (resid 120 and name HA) ! 0.2442 645:20 ----- 3.35, 4.62 A or (resid 109 and name HB1) (resid 110 and name HA) ! 0.1393 645:20 ----- 3.68, 3.89 A assign (resid 134 and name HG2*) (resid 131 and name HA) 3.15 1.35 1.35 ! 0.0000 646:20 Mid 3.29, 4.27 A assign (resid 130 and name HG1*) (resid 131 and name HA) 2.65 0.85 0.85 ! 0.3323 647:20 Ambig 3.44, 4.67 A or (resid 98 and name HG1*) (resid 99 and name HA) ! 0.3096 647:20 ----- 3.48, 4.65 A or (resid 102 and name HG1*) (resid 103 and name HA) ! 0.2754 647:20 ----- 3.55, 4.80 A or (resid 102 and name HG1*) (resid 99 and name HA) ! 0.0532 647:20 ----- 4.66, 5.71 A assign (resid 119 and name HD1*) (resid 110 and name HA) 3.15 1.35 1.35 ! 0.9438 648:20 Long 2.19, 3.94 A assign (resid 43 and name HG1*) (resid 79 and name HB1) 3.15 1.35 1.35 ! 0.9489 649:20 Long 2.00, 4.51 A assign (resid 43 and name HG1*) (resid 79 and name HB2) 2.65 0.85 0.85 ! 0.5430 650:20 Ambig 2.28, 4.72 A or (resid 155 and name HG1*) (resid 155 and name HA) ! 0.4418 650:20 ----- 2.36, 2.81 A assign (resid 109 and name HB1) (resid 106 and name HA) 3.15 1.35 1.35 ! 0.0000 651:20 Mid 3.73, 4.08 A assign (resid 109 and name HD2*) (resid 106 and name HA) 3.15 1.35 1.35 ! 0.0000 652:20 Mid 2.29, 3.62 A assign (resid 155 and name HG2*) (resid 155 and name HA) 2.65 0.85 0.85 ! 0.0000 653:20 Intra 2.61, 3.25 A assign (resid 166 and name HB2) (resid 166 and name HA) 3.15 1.35 1.35 ! 0.0000 654:20 Intra 2.68, 2.86 A assign (resid 166 and name HB1) (resid 166 and name HA) 3.65 1.85 1.85 ! 0.0000 655:20 Intra 2.26, 2.29 A assign (resid 18 and name HD1*) (resid 80 and name HB*) 3.65 1.85 1.85 ! 0.5449 656:20 Ambig 3.86, 6.67 A or (resid 18 and name HD2*) (resid 80 and name HB*) ! 0.4551 656:20 ----- 3.97, 6.08 A assign (resid 98 and name HG1*) (resid 95 and name HA) 3.15 1.35 1.35 ! 0.0000 658:20 Mid 4.28, 5.08 A assign (resid 14 and name HG2*) (resid 14 and name HA) 2.65 0.85 0.85 ! 0.9506 659:20 Intra 2.49, 3.10 A assign (resid 20 and name HG2*) (resid 20 and name HA) 2.65 0.85 0.85 ! 0.8501 660:20 Ambig 2.54, 3.20 A or (resid 20 and name HD1*) (resid 20 and name HA) ! 0.1499 660:20 ----- 3.39, 4.64 A assign (resid 155 and name HD1*) (resid 155 and name HA) 3.65 1.85 1.85 ! 0.0000 661:20 Intra 3.28, 4.44 A assign (resid 105 and name HG1*) (resid 106 and name HA) 3.65 1.85 1.85 ! 0.0000 662:20 Seq 3.23, 4.53 A assign (resid 14 and name HG1*) (resid 14 and name HA) 3.65 1.85 1.85 ! 0.0000 663:20 Intra 3.68, 3.94 A assign (resid 79 and name HN) (resid 79 and name HA) 3.15 1.35 1.35 ! 0.0000 666:20 Intra 2.78, 2.84 A assign (resid 135 and name HN) (resid 135 and name HA) 2.65 0.85 0.85 ! 0.8208 667:20 Ambig 2.79, 2.83 A or (resid 104 and name HN) (resid 100 and name HA) ! 0.1792 667:20 ----- 3.60, 3.74 A assign (resid 138 and name HN) (resid 138 and name HA) 2.65 0.85 0.85 ! 0.6861 668:20 Ambig 2.80, 2.85 A or (resid 139 and name HN) (resid 138 and name HA) ! 0.3115 668:20 ----- 3.20, 3.37 A assign (resid 149 and name HN) (resid 148 and name HA) 3.15 1.35 1.35 ! 0.0000 669:20 Seq 2.39, 2.56 A assign (resid 148 and name HN) (resid 148 and name HA) 3.15 1.35 1.35 ! 0.9891 671:20 Intra 2.89, 2.91 A assign (resid 109 and name HN) (resid 109 and name HA) 3.15 1.35 1.35 ! 0.0000 673:20 Intra 2.77, 2.79 A assign (resid 10 and name HN) (resid 9 and name HA) 3.15 1.35 1.35 ! 0.7574 674:20 Ambig 3.45, 3.52 A or (resid 11 and name HN) (resid 9 and name HA) ! 0.2347 674:20 ----- 4.20, 4.39 A assign (resid 80 and name HN) (resid 79 and name HA) 3.15 1.35 1.35 ! 0.0000 675:20 Seq 3.24, 3.42 A assign (resid 136 and name HN) (resid 135 and name HA) 3.15 1.35 1.35 ! 0.6255 676:20 Ambig 3.33, 3.48 A or (resid 137 and name HN) (resid 135 and name HA) ! 0.3472 676:20 ----- 3.68, 3.95 A assign (resid 110 and name HN) (resid 107 and name HA) 2.65 0.85 0.85 ! 0.5741 677:20 Ambig 3.18, 3.45 A or (resid 108 and name HN) (resid 107 and name HA) ! 0.3881 677:20 ----- 3.39, 3.48 A assign (resid 107 and name HN) (resid 107 and name HA) 3.15 1.35 1.35 ! 0.0000 678:20 Intra 2.82, 2.84 A assign (resid 125 and name HN) (resid 125 and name HA) 2.65 0.85 0.85 ! 0.9618 679:20 Intra 2.79, 2.83 A assign (resid 124 and name HN) (resid 124 and name HA) 2.65 0.85 0.85 ! 0.7254 680:20 Ambig 2.86, 2.88 A or (resid 125 and name HN) (resid 124 and name HA) ! 0.2514 680:20 ----- 3.41, 3.45 A assign (resid 128 and name HN) (resid 125 and name HA) 3.15 1.35 1.35 ! 0.9385 681:20 Mid 3.47, 3.68 A assign (resid 110 and name HN) (resid 109 and name HA) 3.65 1.85 1.85 ! 0.8923 682:20 Ambig 3.48, 3.52 A or (resid 108 and name HN) (resid 109 and name HA) ! 0.0952 682:20 ----- 5.06, 5.18 A assign (resid 123 and name HN) (resid 123 and name HA) 2.65 0.85 0.85 ! 0.6309 683:20 Ambig 2.84, 2.86 A or (resid 124 and name HN) (resid 123 and name HA) ! 0.2338 683:20 ----- 3.35, 3.40 A or (resid 125 and name HN) (resid 123 and name HA) ! 0.1326 683:20 ----- 3.69, 3.88 A assign (resid 20 and name HN) (resid 19 and name HA) 2.30 0.50 0.50 ! 0.8926 684:20 Ambig 2.01, 2.10 A or (resid 19 and name HN) (resid 19 and name HA) ! 0.1074 684:20 ----- 2.86, 2.89 A assign (resid 126 and name HN) (resid 123 and name HA) 3.65 1.85 1.85 ! 0.0000 685:20 Mid 2.64, 2.86 A assign (resid 122 and name HD*) (resid 123 and name HA) 4.15 2.35 2.35 ! 0.0000 686:20 Seq 3.60, 5.57 A assign (resid 133 and name HN) (resid 133 and name HA) 3.65 1.85 1.85 ! 0.0000 687:20 Intra 2.81, 2.83 A assign (resid 83 and name HN) (resid 76 and name HA) 3.65 1.85 1.85 ! 0.6671 689:20 Ambig 2.81, 3.97 A or (resid 77 and name HN) (resid 76 and name HA) ! 0.2366 689:20 ----- 3.34, 3.46 A or (resid 82 and name HN) (resid 76 and name HA) ! 0.0810 689:20 ----- 3.99, 4.54 A assign (resid 100 and name HN) (resid 100 and name HA) 2.65 0.85 0.85 ! 0.9609 690:20 Intra 2.80, 2.83 A assign (resid 103 and name HN) (resid 100 and name HA) 4.15 2.35 2.35 ! 0.8037 691:20 Ambig 3.00, 3.33 A or (resid 104 and name HD22) (resid 100 and name HA) ! 0.1844 691:20 ----- 3.83, 4.31 A assign (resid 137 and name HD*) (resid 138 and name HA) 3.15 1.35 1.35 ! 0.0000 692:20 Seq 2.78, 4.90 A assign (resid 140 and name HN) (resid 138 and name HA) 3.65 1.85 1.85 ! 0.0000 693:20 Mid 3.46, 3.82 A assign (resid 129 and name HD*) (resid 123 and name HA) 4.15 2.35 2.35 ! 0.0000 694:20 Long 6.38, 7.62 A assign (resid 156 and name HD*) (resid 133 and name HA) 3.65 1.85 1.85 ! 0.6508 695:20 Ambig 5.20, 6.27 A or (resid 132 and name HD1) (resid 133 and name HA) ! 0.2291 695:20 ----- 6.19, 6.37 A or (resid 131 and name HN) (resid 133 and name HA) ! 0.1202 695:20 ----- 6.89, 6.97 A assign (resid 79 and name HB1) (resid 79 and name HA) 2.30 0.50 0.50 ! 0.5951 703:20 Ambig 2.30, 2.47 A or (resid 79 and name HB2) (resid 79 and name HA) ! 0.4049 703:20 ----- 2.45, 2.78 A assign (resid 103 and name HD*) (resid 100 and name HA) 3.15 1.35 1.35 ! 0.9997 704:20 Mid 1.95, 3.49 A assign (resid 76 and name HB2) (resid 76 and name HA) 3.65 1.85 1.85 ! 0.9311 706:20 Intra 2.54, 2.60 A assign (resid 135 and name HB2) (resid 135 and name HA) 2.65 0.85 0.85 ! 0.9797 707:20 Intra 2.96, 2.99 A assign (resid 135 and name HB1) (resid 135 and name HA) 2.30 0.50 0.50 ! 0.5072 708:20 Ambig 2.49, 2.61 A or (resid 100 and name HB1) (resid 100 and name HA) ! 0.4920 708:20 ----- 2.51, 2.61 A assign (resid 107 and name HG1) (resid 107 and name HA) 3.15 1.35 1.35 ! 0.6576 709:20 Ambig 2.40, 2.65 A or (resid 107 and name HG2) (resid 107 and name HA) ! 0.3424 709:20 ----- 2.68, 3.58 A assign (resid 125 and name HG1) (resid 125 and name HA) 2.65 0.85 0.85 ! 0.0000 710:20 Intra 2.69, 3.08 A assign (resid 124 and name HB2) (resid 124 and name HA) 2.65 0.85 0.85 ! 0.8918 711:20 Ambig 2.99, 3.02 A or (resid 123 and name HB1) (resid 124 and name HA) ! 0.0789 711:20 ----- 4.48, 4.62 A assign (resid 138 and name HB2) (resid 138 and name HA) 2.65 0.85 0.85 ! 0.0000 712:20 Intra 2.99, 3.02 A assign (resid 138 and name HB1) (resid 138 and name HA) 2.65 0.85 0.85 ! 0.9970 713:20 Intra 2.43, 2.51 A assign (resid 148 and name HG1) (resid 148 and name HA) 2.65 0.85 0.85 ! 0.6635 714:20 Ambig 2.66, 2.78 A or (resid 148 and name HB2) (resid 148 and name HA) ! 0.3365 714:20 ----- 2.98, 2.99 A assign (resid 123 and name HG1) (resid 123 and name HA) 3.65 1.85 1.85 ! 0.9764 715:20 Intra 2.85, 3.00 A assign (resid 123 and name HG2) (resid 123 and name HA) 2.65 0.85 0.85 ! 0.0000 716:20 Intra 2.42, 2.48 A assign (resid 133 and name HB2) (resid 133 and name HA) 2.65 0.85 0.85 ! 0.5320 718:20 Ambig 3.02, 3.02 A or (resid 133 and name HG) (resid 133 and name HA) ! 0.4680 718:20 ----- 3.08, 3.15 A assign (resid 152 and name HB*) (resid 9 and name HA) 2.65 0.85 0.85 ! 0.0000 720:20 Long 1.90, 2.99 A assign (resid 160 and name HG*) (resid 160 and name HA) 2.65 0.85 0.85 ! 0.9674 721:20 Intra 2.39, 3.25 A assign (resid 160 and name HB*) (resid 160 and name HA) 2.30 0.50 0.50 ! 0.9664 722:20 Intra 2.39, 2.66 A assign (resid 125 and name HB2) (resid 125 and name HA) 2.65 0.85 0.85 ! 0.9054 723:20 Ambig 3.01, 3.03 A or (resid 127 and name HG2) (resid 125 and name HA) ! 0.0867 723:20 ----- 4.44, 4.88 A assign (resid 109 and name HG) (resid 109 and name HA) 2.65 0.85 0.85 ! 0.7065 724:20 Ambig 2.54, 2.60 A or (resid 109 and name HB2) (resid 109 and name HA) ! 0.2876 724:20 ----- 2.95, 2.97 A assign (resid 123 and name HB2) (resid 123 and name HA) 2.65 0.85 0.85 ! 0.8511 725:20 Ambig 3.00, 3.01 A or (resid 109 and name HG) (resid 123 and name HA) ! 0.1340 725:20 ----- 4.08, 4.72 A assign (resid 19 and name HB1) (resid 19 and name HA) 2.30 0.50 0.50 ! 0.5288 726:20 Ambig 2.43, 2.76 A or (resid 19 and name HB2) (resid 19 and name HA) ! 0.4712 726:20 ----- 2.48, 2.78 A assign (resid 20 and name HG11) (resid 19 and name HA) 3.15 1.35 1.35 ! 0.6892 728:20 Ambig 3.69, 4.01 A or (resid 20 and name HB) (resid 19 and name HA) ! 0.2406 728:20 ----- 4.40, 4.57 A assign (resid 133 and name HB1) (resid 133 and name HA) 3.15 1.35 1.35 ! 0.6805 730:20 Ambig 2.44, 2.50 A or (resid 136 and name HB2) (resid 133 and name HA) ! 0.3091 730:20 ----- 2.79, 3.40 A assign (resid 43 and name HG1*) (resid 79 and name HA) 3.65 1.85 1.85 ! 0.8877 733:20 Ambig 3.64, 5.64 A or (resid 43 and name HG2*) (resid 79 and name HA) ! 0.1123 733:20 ----- 5.13, 7.50 A assign (resid 8 and name HD1*) (resid 100 and name HA) 3.65 1.85 1.85 ! 0.0000 735:20 Long 5.12, 6.25 A assign (resid 109 and name HB1) (resid 109 and name HA) 2.65 0.85 0.85 ! 0.9458 738:20 Intra 2.65, 2.68 A assign (resid 109 and name HD1*) (resid 109 and name HA) 2.30 0.50 0.50 ! 0.9770 739:20 Intra 2.25, 3.33 A assign (resid 109 and name HD2*) (resid 109 and name HA) 3.65 1.85 1.85 ! 0.0000 740:20 Intra 4.35, 4.61 A assign (resid 126 and name HB*) (resid 123 and name HA) 2.65 0.85 0.85 ! 0.9947 743:20 Mid 2.17, 3.12 A assign (resid 136 and name HB1) (resid 133 and name HA) 3.65 1.85 1.85 ! 0.9006 744:20 Ambig 3.06, 4.53 A or (resid 133 and name HD1*) (resid 133 and name HA) ! 0.0994 744:20 ----- 4.42, 4.70 A assign (resid 133 and name HD2*) (resid 133 and name HA) 2.65 0.85 0.85 ! 0.9972 745:20 Intra 2.11, 2.97 A assign (resid 176 and name HN) (resid 6 and name HA) 4.15 2.35 2.35 ! 0.0000 748:20 Long 3.54, 3.94 A assign (resid 74 and name HN) (resid 74 and name HA) 3.65 1.85 1.85 ! 0.0000 749:20 Intra 2.70, 2.77 A assign (resid 41 and name HN) (resid 74 and name HA) 4.15 2.35 2.35 ! 0.0000 750:20 Long 4.14, 4.44 A assign (resid 144 and name HN) (resid 85 and name HA) 3.65 1.85 1.85 ! 0.0000 751:20 Long 3.68, 4.11 A assign (resid 104 and name HN) (resid 104 and name HA) 3.65 1.85 1.85 ! 0.0000 752:20 Intra 2.79, 2.83 A assign (resid 2 and name HN) (resid 1 and name HA) 2.30 0.50 0.50 ! 0.9754 754:20 Seq 2.04, 2.16 A assign (resid 141 and name HN) (resid 141 and name HA) 3.65 1.85 1.85 ! 0.9650 755:20 Intra 2.85, 2.91 A assign (resid 139 and name HN) (resid 136 and name HA) 4.15 2.35 2.35 ! 0.5403 756:20 Ambig 3.49, 3.74 A or (resid 138 and name HN) (resid 136 and name HA) ! 0.4597 756:20 ----- 3.59, 4.00 A assign (resid 86 and name HN) (resid 85 and name HA) 2.65 0.85 0.85 ! 0.9994 757:20 Seq 2.09, 2.16 A assign (resid 71 and name HN) (resid 70 and name HA) 2.65 0.85 0.85 ! 0.9891 759:20 Seq 2.08, 2.20 A assign (resid 7 and name HN) (resid 6 and name HA) 2.65 0.85 0.85 ! 0.9625 760:20 Seq 2.07, 2.19 A assign (resid 107 and name HN) (resid 104 and name HA) 3.65 1.85 1.85 ! 0.0000 761:20 Mid 3.06, 3.27 A assign (resid 142 and name HN) (resid 141 and name HA) 2.65 0.85 0.85 ! 0.0000 763:20 Seq 2.22, 2.40 A assign (resid 80 and name HN) (resid 80 and name HA) 3.15 1.35 1.35 ! 0.6520 764:20 Ambig 2.88, 2.92 A or (resid 81 and name HN) (resid 80 and name HA) ! 0.1846 764:20 ----- 3.55, 3.58 A or (resid 88 and name HN) (resid 141 and name HA) ! 0.1634 764:20 ----- 3.63, 4.65 A assign (resid 136 and name HN) (resid 136 and name HA) 2.65 0.85 0.85 ! 0.6513 766:20 Ambig 2.86, 2.91 A or (resid 137 and name HN) (resid 136 and name HA) ! 0.3487 766:20 ----- 3.17, 3.28 A assign (resid 18 and name HN) (resid 17 and name HA) 3.15 1.35 1.35 ! 0.0000 767:20 Seq 3.25, 3.35 A assign (resid 126 and name HN) (resid 126 and name HA) 3.15 1.35 1.35 ! 0.7790 768:20 Ambig 2.72, 2.75 A or (resid 129 and name HN) (resid 126 and name HA) ! 0.2210 768:20 ----- 3.35, 3.46 A assign (resid 175 and name HD*) (resid 6 and name HA) 2.65 0.85 0.85 ! 0.9730 769:20 Long 1.90, 3.72 A assign (resid 142 and name HD*) (resid 141 and name HA) 3.15 1.35 1.35 ! 0.0000 770:20 Seq 3.30, 4.54 A assign (resid 143 and name HD*) (resid 85 and name HA) 3.65 1.85 1.85 ! 0.0000 771:20 Long 2.45, 3.83 A assign (resid 129 and name HD*) (resid 126 and name HA) 2.65 0.85 0.85 ! 0.9590 772:20 Mid 2.29, 3.59 A assign (resid 143 and name HA) (resid 85 and name HA) 3.15 1.35 1.35 ! 0.9920 773:20 Long 2.29, 2.62 A assign (resid 80 and name HB*) (resid 80 and name HA) 2.65 0.85 0.85 ! 0.9888 777:20 Intra 2.41, 2.74 A assign (resid 74 and name HB2) (resid 74 and name HA) 2.30 0.50 0.50 ! 0.0000 778:20 Intra 2.39, 2.42 A assign (resid 127 and name HD2) (resid 126 and name HA) 3.65 1.85 1.85 ! 0.9682 779:20 Seq 3.88, 3.94 A assign (resid 70 and name HG*) (resid 70 and name HA) 2.65 0.85 0.85 ! 0.0000 780:20 Intra 2.50, 3.09 A assign (resid 107 and name HB2) (resid 104 and name HA) 2.65 0.85 0.85 ! 0.9574 781:20 Mid 2.37, 2.77 A assign (resid 70 and name HB1) (resid 70 and name HA) 2.65 0.85 0.85 ! 0.0000 782:20 Intra 2.41, 2.47 A assign (resid 107 and name HG2) (resid 104 and name HA) 2.30 0.50 0.50 ! 0.6767 783:20 Ambig 2.24, 4.00 A or (resid 104 and name HB1) (resid 104 and name HA) ! 0.3229 783:20 ----- 2.53, 2.58 A assign (resid 16 and name HB1) (resid 1 and name HA) 2.65 0.85 0.85 ! 0.8297 784:20 Ambig 2.38, 4.25 A or (resid 1 and name HG2) (resid 1 and name HA) ! 0.1703 784:20 ----- 3.10, 3.34 A assign (resid 141 and name HG1) (resid 141 and name HA) 2.65 0.85 0.85 ! 0.9946 785:20 Intra 2.37, 2.95 A assign (resid 1 and name HB2) (resid 1 and name HA) 2.65 0.85 0.85 ! 0.0000 786:20 Intra 2.41, 2.46 A assign (resid 74 and name HB1) (resid 74 and name HA) 2.65 0.85 0.85 ! 0.9947 787:20 Intra 2.44, 2.47 A assign (resid 135 and name HB1) (resid 136 and name HA) 4.15 2.35 2.35 ! 0.7458 788:20 Ambig 3.89, 4.19 A or (resid 139 and name HB1) (resid 136 and name HA) ! 0.2542 788:20 ----- 4.65, 5.21 A assign (resid 70 and name HB2) (resid 70 and name HA) 2.65 0.85 0.85 ! 0.8741 790:20 Ambig 3.00, 3.02 A or (resid 43 and name HB) (resid 70 and name HA) ! 0.0720 790:20 ----- 4.54, 5.19 A assign (resid 71 and name HB2) (resid 70 and name HA) 3.65 1.85 1.85 ! 0.0000 791:20 Seq 4.39, 4.60 A assign (resid 71 and name HG1) (resid 70 and name HA) 3.65 1.85 1.85 ! 0.8483 792:20 Ambig 3.61, 4.85 A or (resid 68 and name HB*) (resid 70 and name HA) ! 0.1517 792:20 ----- 4.81, 7.17 A assign (resid 141 and name HB*) (resid 141 and name HA) 2.65 0.85 0.85 ! 0.0000 794:20 Intra 2.49, 2.78 A assign (resid 136 and name HB2) (resid 136 and name HA) 2.65 0.85 0.85 ! 0.9853 795:20 Intra 2.55, 2.93 A assign (resid 17 and name HB*) (resid 17 and name HA) 2.30 0.50 0.50 ! 0.4888 796:20 Ambig 2.43, 2.64 A or (resid 108 and name HB*) (resid 108 and name HA) ! 0.4867 796:20 ----- 2.43, 2.65 A assign (resid 85 and name HB*) (resid 85 and name HA) 2.65 0.85 0.85 ! 0.0000 797:20 Intra 2.41, 2.63 A assign (resid 7 and name HG2*) (resid 6 and name HA) 2.65 0.85 0.85 ! 0.5784 799:20 Ambig 3.36, 4.44 A or (resid 7 and name HG1*) (resid 104 and name HA) ! 0.3666 799:20 ----- 3.63, 4.82 A assign (resid 140 and name HB1) (resid 141 and name HA) 3.65 1.85 1.85 ! 0.8741 801:20 Ambig 3.92, 4.33 A or (resid 140 and name HD2*) (resid 141 and name HA) ! 0.0722 801:20 ----- 5.95, 6.69 A assign (resid 2 and name HG2*) (resid 1 and name HA) 3.65 1.85 1.85 ! 0.0000 802:20 Seq 6.24, 6.57 A assign (resid 136 and name HB1) (resid 136 and name HA) 2.65 0.85 0.85 ! 0.0000 803:20 Intra 2.43, 2.61 A assign (resid 136 and name HD*) (resid 136 and name HA) 2.30 0.50 0.50 ! 0.7476 805:20 Ambig 2.01, 2.78 A or (resid 136 and name HG1) (resid 136 and name HA) ! 0.2427 805:20 ----- 2.42, 3.36 A assign (resid 126 and name HB*) (resid 126 and name HA) 2.30 0.50 0.50 ! 0.9707 807:20 Intra 2.38, 2.63 A assign (resid 116 and name HN) (resid 115 and name HA) 2.65 0.85 0.85 ! 0.7768 809:20 Ambig 2.22, 2.29 A or (resid 115 and name HN) (resid 115 and name HA) ! 0.2232 809:20 ----- 2.73, 2.78 A assign (resid 83 and name HN) (resid 82 and name HA) 2.65 0.85 0.85 ! 0.6230 811:20 Ambig 2.01, 2.13 A or (resid 82 and name HN) (resid 82 and name HA) ! 0.3770 811:20 ----- 2.19, 2.22 A assign (resid 77 and name HN) (resid 78 and name HD*) 4.15 2.35 2.35 ! 0.0000 812:20 Seq 2.74, 4.00 A assign (resid 126 and name HN) (resid 127 and name HD2) 3.65 1.85 1.85 ! 0.9758 813:20 Seq 2.48, 2.62 A assign (resid 126 and name HN) (resid 127 and name HD2) 3.65 1.85 1.85 ! 0.9758 814:20 Seq 2.48, 2.62 A assign (resid 128 and name HN) (resid 127 and name HD1) 3.65 1.85 1.85 ! 0.9536 818:20 Seq 3.78, 3.87 A assign (resid 149 and name HA) (resid 150 and name HD1) 2.65 0.85 0.85 ! 0.9974 822:20 Seq 2.36, 2.57 A assign (resid 86 and name HA) (resid 87 and name HD2) 2.30 0.50 0.50 ! 0.0000 823:20 Seq 2.13, 2.37 A assign (resid 86 and name HA) (resid 87 and name HD1) 2.65 0.85 0.85 ! 0.0000 826:20 Seq 1.92, 2.18 A assign (resid 78 and name HA) (resid 82 and name HA) 3.15 1.35 1.35 ! 0.9994 827:20 Mid 1.92, 2.15 A assign (resid 21 and name HB) (resid 22 and name HD*) 2.65 0.85 0.85 ! 0.9984 833:20 Seq 2.15, 3.18 A assign (resid 150 and name HA) (resid 150 and name HD1) 2.65 0.85 0.85 ! 0.5183 834:20 Ambig 3.34, 3.54 A or (resid 31 and name HA) (resid 31 and name HD1) ! 0.4532 834:20 ----- 3.42, 3.56 A assign (resid 127 and name HA) (resid 127 and name HD1) 4.15 2.35 2.35 ! 0.6278 837:20 Ambig 3.42, 3.51 A or (resid 123 and name HA) (resid 127 and name HD1) ! 0.2733 837:20 ----- 3.93, 4.55 A or (resid 85 and name HA) (resid 87 and name HD1) ! 0.0862 837:20 ----- 4.77, 5.76 A assign (resid 31 and name HB1) (resid 31 and name HD2) 3.15 1.35 1.35 ! 0.0000 846:20 Intra 3.79, 3.87 A assign (resid 31 and name HG1) (resid 31 and name HD2) 2.65 0.85 0.85 ! 0.9514 848:20 Intra 2.67, 2.70 A assign (resid 31 and name HB1) (resid 31 and name HD1) 3.15 1.35 1.35 ! 0.8600 850:20 Ambig 2.81, 2.97 A or (resid 150 and name HB2) (resid 150 and name HD1) ! 0.1306 850:20 ----- 3.85, 3.92 A assign (resid 87 and name HB2) (resid 87 and name HD2) 3.65 1.85 1.85 ! 0.9933 851:20 Intra 2.90, 3.75 A assign (resid 126 and name HA) (resid 127 and name HD2) 4.15 2.35 2.35 ! 0.9245 855:20 Seq 3.88, 3.94 A assign (resid 127 and name HB2) (resid 127 and name HD2) 3.15 1.35 1.35 ! 0.5911 856:20 Ambig 4.03, 4.05 A or (resid 123 and name HB1) (resid 127 and name HD2) ! 0.2231 856:20 ----- 4.74, 5.13 A or (resid 124 and name HB2) (resid 127 and name HD2) ! 0.1495 856:20 ----- 5.07, 5.29 A assign (resid 87 and name HB2) (resid 87 and name HD1) 3.15 1.35 1.35 ! 0.0000 857:20 Intra 3.86, 3.96 A assign (resid 68 and name HB*) (resid 68 and name HA) 2.30 0.50 0.50 ! 0.4740 860:20 Ambig 2.40, 2.64 A or (resid 65 and name HB*) (resid 65 and name HA) ! 0.4684 860:20 ----- 2.41, 2.64 A assign (resid 163 and name HB*) (resid 163 and name HA) 2.65 0.85 0.85 ! 0.0000 861:20 Intra 2.43, 2.64 A assign (resid 115 and name HB*) (resid 115 and name HA) 2.30 0.50 0.50 ! 0.0000 862:20 Intra 2.41, 2.63 A assign (resid 55 and name HB*) (resid 55 and name HA) 3.15 1.35 1.35 ! 0.0000 863:20 Intra 2.40, 2.65 A assign (resid 128 and name HG2*) (resid 31 and name HD2) 2.65 0.85 0.85 ! 0.9929 865:20 Long 2.05, 3.11 A assign (resid 82 and name HB*) (resid 82 and name HA) 2.65 0.85 0.85 ! 0.0000 866:20 Intra 2.39, 2.64 A assign (resid 128 and name HG2*) (resid 31 and name HD1) 3.15 1.35 1.35 ! 0.8848 868:20 Ambig 3.73, 4.80 A or (resid 23 and name HB) (resid 31 and name HD1) ! 0.0505 868:20 ----- 6.02, 6.46 A assign (resid 22 and name HG1) (resid 22 and name HD*) 2.30 0.50 0.50 ! 0.5031 870:20 Ambig 2.28, 2.51 A or (resid 22 and name HG2) (resid 22 and name HD*) ! 0.4931 870:20 ----- 2.29, 2.64 A assign (resid 150 and name HG2) (resid 150 and name HD1) 2.65 0.85 0.85 ! 0.7865 871:20 Ambig 2.96, 2.99 A or (resid 31 and name HB2) (resid 31 and name HD1) ! 0.1615 871:20 ----- 3.86, 3.91 A assign (resid 152 and name HB*) (resid 150 and name HD1) 4.15 2.35 2.35 ! 0.0000 873:20 Mid 6.89, 7.98 A assign (resid 87 and name HG*) (resid 87 and name HD2) 2.30 0.50 0.50 ! 0.9852 875:20 Intra 2.25, 2.55 A assign (resid 86 and name HB1) (resid 87 and name HD2) 4.15 2.35 2.35 ! 0.0000 876:20 Seq 2.44, 3.17 A assign (resid 87 and name HG*) (resid 87 and name HD1) 2.30 0.50 0.50 ! 0.9943 879:20 Intra 2.24, 2.58 A assign (resid 127 and name HG1) (resid 127 and name HD2) 2.65 0.85 0.85 ! 0.0000 880:20 Intra 2.66, 2.68 A assign (resid 85 and name HB*) (resid 87 and name HD1) 3.65 1.85 1.85 ! 0.0000 881:20 Mid 3.69, 5.46 A assign (resid 18 and name HD2*) (resid 18 and name HA) 2.65 0.85 0.85 ! 0.9353 882:20 Intra 2.13, 2.99 A assign (resid 30 and name HG2*) (resid 31 and name HD2) 3.15 1.35 1.35 ! 0.0000 883:20 Seq 3.87, 4.86 A assign (resid 30 and name HG1*) (resid 31 and name HD2) 3.15 1.35 1.35 ! 0.9754 884:20 Seq 2.53, 3.35 A assign (resid 30 and name HG2*) (resid 31 and name HD1) 3.15 1.35 1.35 ! 0.5558 885:20 Ambig 4.61, 5.43 A or (resid 154 and name HD1*) (resid 150 and name HD1) ! 0.4442 885:20 ----- 4.79, 6.13 A assign (resid 30 and name HG1*) (resid 31 and name HD1) 3.65 1.85 1.85 ! 0.9210 886:20 Seq 4.02, 4.72 A assign (resid 95 and name HN) (resid 92 and name HA2) 4.15 2.35 2.35 ! 0.0000 887:20 Mid 3.01, 3.23 A assign (resid 154 and name HN) (resid 153 and name HA1) 3.65 1.85 1.85 ! 0.8708 889:20 Ambig 3.51, 3.54 A or (resid 149 and name HD21) (resid 153 and name HA1) ! 0.1292 889:20 ----- 4.83, 6.29 A assign (resid 126 and name HN) (resid 127 and name HD1) 3.65 1.85 1.85 ! 0.9263 890:20 Seq 3.58, 3.70 A assign (resid 33 and name HN) (resid 33 and name HB1) 3.65 1.85 1.85 ! 0.8760 892:20 Ambig 3.67, 3.72 A or (resid 132 and name HZ2) (resid 33 and name HB1) ! 0.1240 892:20 ----- 5.08, 5.57 A assign (resid 124 and name HA) (resid 127 and name HD1) 3.65 1.85 1.85 ! 0.9361 896:20 Mid 3.62, 4.03 A assign (resid 127 and name HA) (resid 127 and name HD1) 3.65 1.85 1.85 ! 0.6847 897:20 Ambig 3.42, 3.51 A or (resid 123 and name HA) (resid 127 and name HD1) ! 0.2980 897:20 ----- 3.93, 4.55 A assign (resid 119 and name HG12) (resid 113 and name HA1) 4.90 3.10 3.10 ! 0.0000 900:20 Long 6.95, 7.38 A assign (resid 95 and name HB*) (resid 92 and name HA2) 3.65 1.85 1.85 ! 0.0000 901:20 Mid 2.21, 3.57 A assign (resid 95 and name HD*) (resid 92 and name HA2) 3.65 1.85 1.85 ! 0.0000 903:20 Mid 4.72, 5.37 A assign (resid 126 and name HB*) (resid 127 and name HD2) 2.65 0.85 0.85 ! 0.0000 905:20 Seq 2.66, 3.63 A assign (resid 126 and name HB*) (resid 127 and name HD1) 3.15 1.35 1.35 ! 0.0000 906:20 Seq 2.14, 3.25 A assign (resid 33 and name HD1*) (resid 33 and name HB2) 3.65 1.85 1.85 ! 0.7897 907:20 Ambig 2.34, 2.92 A or (resid 30 and name HG1*) (resid 33 and name HB2) ! 0.2089 907:20 ----- 2.92, 4.03 A assign (resid 33 and name HD1*) (resid 33 and name HB1) 3.65 1.85 1.85 ! 0.9613 908:20 Intra 2.49, 3.22 A assign (resid 6 and name HN) (resid 6 and name HB1) 3.65 1.85 1.85 ! 0.9981 910:20 Intra 2.29, 2.37 A assign (resid 32 and name HN) (resid 32 and name HA2) 3.15 1.35 1.35 ! 0.9885 912:20 Intra 2.24, 2.36 A assign (resid 32 and name HN) (resid 32 and name HA1) 3.15 1.35 1.35 ! 0.9735 913:20 Intra 2.82, 2.89 A assign (resid 172 and name HN) (resid 32 and name HA1) 3.65 1.85 1.85 ! 0.9539 914:20 Long 4.62, 4.87 A assign (resid 174 and name HN) (resid 174 and name HA2) 3.65 1.85 1.85 ! 0.0000 916:20 Intra 2.88, 2.92 A assign (resid 174 and name HN) (resid 174 and name HA1) 3.15 1.35 1.35 ! 0.0000 917:20 Intra 2.29, 2.39 A assign (resid 141 and name HN) (resid 140 and name HB2) 3.65 1.85 1.85 ! 0.6426 918:20 Ambig 3.69, 4.15 A or (resid 139 and name HN) (resid 140 and name HB2) ! 0.3574 918:20 ----- 4.07, 4.33 A assign (resid 77 and name HN) (resid 77 and name HA1) 3.15 1.35 1.35 ! 0.8983 921:20 Ambig 2.20, 2.52 A or (resid 80 and name HN) (resid 77 and name HA1) ! 0.1017 921:20 ----- 3.17, 3.53 A assign (resid 28 and name HN) (resid 27 and name HA1) 3.65 1.85 1.85 ! 0.0000 923:20 Seq 2.80, 3.10 A assign (resid 28 and name HN) (resid 27 and name HA2) 3.65 1.85 1.85 ! 0.0000 924:20 Seq 3.21, 3.40 A assign (resid 11 and name HN) (resid 6 and name HB1) 3.15 1.35 1.35 ! 0.5210 925:20 Ambig 2.52, 2.93 A or (resid 10 and name HN) (resid 6 and name HB1) ! 0.4790 925:20 ----- 2.56, 2.90 A assign (resid 106 and name HN) (resid 106 and name HD*) 3.65 1.85 1.85 ! 0.7488 926:20 Ambig 3.68, 4.70 A or (resid 110 and name HN) (resid 106 and name HD*) ! 0.2012 926:20 ----- 4.58, 7.50 A assign (resid 11 and name HN) (resid 6 and name HB2) 4.15 2.35 2.35 ! 0.5247 927:20 Ambig 4.15, 4.60 A or (resid 10 and name HN) (resid 6 and name HB2) ! 0.4753 927:20 ----- 4.22, 4.53 A assign (resid 129 and name HD*) (resid 32 and name HA2) 3.65 1.85 1.85 ! 0.9526 928:20 Long 4.17, 6.22 A assign (resid 129 and name HD*) (resid 32 and name HA1) 3.65 1.85 1.85 ! 0.9965 929:20 Long 2.85, 4.97 A assign (resid 129 and name HD*) (resid 32 and name HA1) 3.65 1.85 1.85 ! 0.9796 930:20 Long 2.85, 4.97 A assign (resid 140 and name HN) (resid 140 and name HB2) 3.65 1.85 1.85 ! 0.7454 931:20 Ambig 2.43, 2.47 A or (resid 156 and name HD*) (resid 140 and name HB2) ! 0.2546 931:20 ----- 2.91, 5.86 A assign (resid 140 and name HA) (resid 140 and name HB1) 4.15 2.35 2.35 ! 0.7611 932:20 Ambig 2.46, 2.49 A or (resid 156 and name HA) (resid 140 and name HB1) ! 0.2379 932:20 ----- 2.99, 3.47 A assign (resid 154 and name HA) (resid 154 and name HB1) 4.15 2.35 2.35 ! 0.9866 933:20 Intra 2.63, 2.99 A assign (resid 76 and name HB2) (resid 77 and name HA2) 3.65 1.85 1.85 ! 0.0000 940:20 Seq 4.54, 4.82 A assign (resid 137 and name HA) (resid 140 and name HB2) 4.15 2.35 2.35 ! 0.0000 945:20 Mid 2.34, 2.91 A assign (resid 78 and name HG1) (resid 77 and name HA2) 3.15 1.35 1.35 ! 0.5991 946:20 Ambig 4.00, 4.35 A or (resid 78 and name HG2) (resid 77 and name HA2) ! 0.4009 946:20 ----- 4.28, 4.50 A assign (resid 28 and name HG2) (resid 27 and name HA1) 4.15 2.35 2.35 ! 0.8336 948:20 Ambig 4.22, 4.67 A or (resid 28 and name HG1) (resid 27 and name HA1) ! 0.1664 948:20 ----- 5.51, 5.98 A assign (resid 106 and name HB*) (resid 106 and name HD*) 3.15 1.35 1.35 ! 0.9942 950:20 Intra 2.39, 3.01 A assign (resid 172 and name HB1) (resid 32 and name HA2) 3.65 1.85 1.85 ! 0.0000 953:20 Long 2.70, 3.00 A assign (resid 33 and name HG) (resid 32 and name HA2) 4.15 2.35 2.35 ! 0.8932 954:20 Ambig 4.18, 4.47 A or (resid 128 and name HG2*) (resid 32 and name HA2) ! 0.0781 954:20 ----- 6.27, 7.31 A assign (resid 24 and name HB2) (resid 27 and name HA2) 3.65 1.85 1.85 ! 0.6559 956:20 Ambig 4.50, 5.92 A or (resid 28 and name HB1) (resid 27 and name HA2) ! 0.3441 956:20 ----- 5.02, 5.45 A assign (resid 106 and name HG*) (resid 106 and name HD*) 2.30 0.50 0.50 ! 0.7873 957:20 Ambig 2.38, 2.66 A or (resid 110 and name HD*) (resid 106 and name HD*) ! 0.2067 957:20 ----- 2.97, 6.58 A assign (resid 109 and name HD1*) (resid 174 and name HA2) 3.65 1.85 1.85 ! 0.9856 962:20 Long 2.22, 3.06 A assign (resid 109 and name HD1*) (resid 174 and name HA2) 3.65 1.85 1.85 ! 0.9856 963:20 Long 2.22, 3.06 A assign (resid 109 and name HD1*) (resid 174 and name HA1) 3.65 1.85 1.85 ! 0.8908 964:20 Ambig 3.28, 4.29 A or (resid 7 and name HG2*) (resid 174 and name HA1) ! 0.0966 964:20 ----- 4.75, 5.66 A assign (resid 23 and name HG2*) (resid 33 and name HB2) 3.15 1.35 1.35 ! 0.9182 967:20 Ambig 2.31, 3.36 A or (resid 33 and name HD2*) (resid 33 and name HB2) ! 0.0711 967:20 ----- 3.53, 3.85 A assign (resid 154 and name HD1*) (resid 154 and name HB2) 3.65 1.85 1.85 ! 0.0000 969:20 Intra 2.37, 3.07 A assign (resid 154 and name HD1*) (resid 154 and name HB1) 4.15 2.35 2.35 ! 0.9755 973:20 Intra 3.59, 3.88 A assign (resid 105 and name HG1*) (resid 174 and name HA2) 4.15 2.35 2.35 ! 0.0000 974:20 Long 2.05, 3.22 A assign (resid 154 and name HD2*) (resid 154 and name HB2) 3.65 1.85 1.85 ! 0.0000 976:20 Intra 2.44, 3.11 A assign (resid 154 and name HD2*) (resid 154 and name HB1) 3.65 1.85 1.85 ! 0.0000 977:20 Intra 2.39, 3.01 A assign (resid 143 and name HN) (resid 143 and name HB2) 3.65 1.85 1.85 ! 0.6053 984:20 Ambig 2.42, 2.64 A or (resid 143 and name HN) (resid 142 and name HB1) ! 0.3303 984:20 ----- 2.68, 2.92 A assign (resid 144 and name HN) (resid 143 and name HB1) 4.15 2.35 2.35 ! 0.9503 985:20 Seq 2.22, 2.52 A assign (resid 104 and name HN) (resid 103 and name HD*) 3.65 1.85 1.85 ! 0.0000 989:20 Seq 3.99, 5.27 A assign (resid 159 and name HN) (resid 139 and name HB2) 4.15 2.35 2.35 ! 0.0000 990:20 Long 3.75, 5.03 A assign (resid 159 and name HN) (resid 158 and name HB*) 3.65 1.85 1.85 ! 0.0000 992:20 Seq 2.20, 3.11 A assign (resid 180 and name HN) (resid 180 and name HB2) 3.15 1.35 1.35 ! 0.9989 993:20 Intra 2.33, 2.47 A assign (resid 157 and name HN) (resid 156 and name HB1) 3.15 1.35 1.35 ! 0.6793 994:20 Ambig 3.00, 3.25 A or (resid 180 and name HN) (resid 180 and name HB1) ! 0.2373 994:20 ----- 3.57, 3.65 A or (resid 134 and name HN) (resid 137 and name HB2) ! 0.0740 994:20 ----- 4.34, 4.65 A assign (resid 158 and name HN) (resid 158 and name HB*) 4.15 2.35 2.35 ! 0.8541 995:20 Ambig 3.12, 3.64 A or (resid 157 and name HN) (resid 158 and name HB*) ! 0.0908 995:20 ----- 4.53, 5.51 A assign (resid 146 and name HN) (resid 143 and name HB1) 4.90 3.10 3.10 ! 0.0000 996:20 Mid 7.11, 7.55 A assign (resid 139 and name HN) (resid 139 and name HB1) 3.15 1.35 1.35 ! 0.8616 997:20 Ambig 3.65, 3.69 A or (resid 141 and name HN) (resid 139 and name HB1) ! 0.0876 997:20 ----- 5.34, 5.72 A assign (resid 138 and name HN) (resid 138 and name HB2) 2.65 0.85 0.85 ! 0.7137 998:20 Ambig 2.34, 2.47 A or (resid 139 and name HN) (resid 138 and name HB2) ! 0.2576 998:20 ----- 2.77, 3.26 A assign (resid 138 and name HN) (resid 138 and name HB1) 2.65 0.85 0.85 ! 0.5344 999:20 Ambig 3.57, 3.62 A or (resid 139 and name HN) (resid 138 and name HB1) ! 0.4656 999:20 ----- 3.65, 4.03 A assign (resid 37 and name HN) (resid 37 and name HB1) 2.65 0.85 0.85 ! 0.5140 1000:20 Ambig 2.30, 2.49 A or (resid 73 and name HN) (resid 73 and name HB*) ! 0.4817 1000:20 ----- 2.33, 2.55 A assign (resid 137 and name HN) (resid 137 and name HB1) 3.65 1.85 1.85 ! 0.9748 1001:20 Intra 2.45, 2.61 A assign (resid 156 and name HN) (resid 156 and name HB1) 4.15 2.35 2.35 ! 0.9837 1002:20 Intra 3.59, 3.62 A assign (resid 73 and name HD22) (resid 73 and name HB*) 3.65 1.85 1.85 ! 0.5120 1003:20 Ambig 3.47, 3.61 A or (resid 77 and name HN) (resid 73 and name HB*) ! 0.4727 1003:20 ----- 3.52, 4.75 A assign (resid 119 and name HN) (resid 118 and name HB1) 4.15 2.35 2.35 ! 0.0000 1005:20 Seq 3.36, 3.56 A assign (resid 121 and name HN) (resid 118 and name HB1) 4.15 2.35 2.35 ! 0.0000 1006:20 Mid 5.05, 5.22 A assign (resid 88 and name HN) (resid 88 and name HB*) 3.65 1.85 1.85 ! 0.0000 1007:20 Intra 2.37, 3.11 A assign (resid 88 and name HN) (resid 88 and name HB*) 4.15 2.35 2.35 ! 0.0000 1009:20 Intra 2.37, 3.11 A assign (resid 151 and name HN) (resid 151 and name HB1) 3.15 1.35 1.35 ! 0.0000 1010:20 Intra 3.57, 3.64 A assign (resid 119 and name HN) (resid 118 and name HB2) 3.65 1.85 1.85 ! 0.0000 1011:20 Seq 2.46, 2.72 A assign (resid 18 and name HN) (resid 18 and name HB1) 3.65 1.85 1.85 ! 0.0000 1013:20 Intra 3.60, 3.65 A assign (resid 18 and name HN) (resid 18 and name HB2) 4.15 2.35 2.35 ! 0.0000 1014:20 Intra 2.46, 2.52 A assign (resid 19 and name HN) (resid 18 and name HB2) 4.15 2.35 2.35 ! 0.9200 1015:20 Seq 2.73, 3.27 A assign (resid 110 and name HN) (resid 109 and name HB1) 4.15 2.35 2.35 ! 0.9472 1016:20 Seq 2.81, 3.00 A assign (resid 103 and name HN) (resid 103 and name HD*) 3.65 1.85 1.85 ! 0.8343 1017:20 Ambig 3.67, 4.68 A or (resid 107 and name HE21) (resid 103 and name HD*) ! 0.1657 1017:20 ----- 4.81, 7.34 A assign (resid 137 and name HD*) (resid 137 and name HB1) 3.65 1.85 1.85 ! 0.0000 1019:20 Intra 2.30, 3.05 A assign (resid 137 and name HD*) (resid 137 and name HB1) 3.65 1.85 1.85 ! 0.0000 1020:20 Intra 2.30, 3.05 A assign (resid 156 and name HD*) (resid 156 and name HB1) 2.65 0.85 0.85 ! 0.9808 1021:20 Intra 2.40, 3.05 A assign (resid 142 and name HD*) (resid 142 and name HB1) 3.15 1.35 1.35 ! 0.9865 1023:20 Intra 2.40, 3.06 A assign (resid 158 and name HD*) (resid 136 and name HE2) 4.15 2.35 2.35 ! 0.0000 1024:20 Long 5.63, 6.63 A assign (resid 132 and name HZ2) (resid 136 and name HE1) 2.65 0.85 0.85 ! 0.0000 1025:20 Mid 2.37, 2.98 A assign (resid 97 and name HZ3) (resid 133 and name HB1) 4.15 2.35 2.35 ! 0.0000 1027:20 Long 5.97, 6.43 A assign (resid 157 and name HA) (resid 143 and name HB1) 4.90 3.10 3.10 ! 0.0000 1028:20 Long 7.35, 7.70 A assign (resid 132 and name HH2) (resid 136 and name HE1) 4.15 2.35 2.35 ! 0.0000 1029:20 Mid 4.23, 5.02 A assign (resid 132 and name HH2) (resid 170 and name HB2) 4.15 2.35 2.35 ! 0.0000 1030:20 Long 6.05, 6.47 A assign (resid 132 and name HH2) (resid 170 and name HB1) 4.90 3.10 3.10 ! 0.0000 1031:20 Long 7.26, 7.65 A assign (resid 142 and name HA) (resid 142 and name HB2) 3.65 1.85 1.85 ! 0.9195 1033:20 Ambig 3.01, 3.02 A or (resid 143 and name HA) (resid 142 and name HB2) ! 0.0747 1033:20 ----- 4.57, 4.71 A assign (resid 140 and name HA) (resid 139 and name HB2) 3.65 1.85 1.85 ! 0.0000 1034:20 Seq 4.05, 4.35 A assign (resid 34 and name HA) (resid 34 and name HB1) 3.65 1.85 1.85 ! 0.9929 1035:20 Intra 2.44, 2.52 A assign (resid 158 and name HA) (resid 158 and name HB*) 3.15 1.35 1.35 ! 0.0000 1036:20 Intra 2.35, 2.47 A assign (resid 156 and name HA) (resid 156 and name HB2) 4.15 2.35 2.35 ! 0.9422 1037:20 Intra 3.01, 3.02 A assign (resid 73 and name HA) (resid 73 and name HB*) 3.65 1.85 1.85 ! 0.9627 1038:20 Intra 2.39, 2.74 A assign (resid 40 and name HA) (resid 73 and name HB*) 4.15 2.35 2.35 ! 0.0000 1039:20 Long 4.08, 4.88 A assign (resid 139 and name HA) (resid 139 and name HB1) 3.65 1.85 1.85 ! 0.0000 1040:20 Intra 2.45, 2.51 A assign (resid 139 and name HA) (resid 139 and name HB1) 3.15 1.35 1.35 ! 0.0000 1041:20 Intra 2.45, 2.51 A assign (resid 142 and name HA) (resid 142 and name HB1) 2.65 0.85 0.85 ! 0.7545 1042:20 Ambig 2.37, 2.44 A or (resid 143 and name HA) (resid 143 and name HB2) ! 0.1832 1042:20 ----- 3.00, 3.02 A assign (resid 143 and name HA) (resid 143 and name HB1) 3.65 1.85 1.85 ! 0.9174 1043:20 Ambig 2.54, 2.57 A or (resid 144 and name HA) (resid 143 and name HB1) ! 0.0737 1043:20 ----- 3.87, 4.21 A assign (resid 151 and name HA) (resid 151 and name HB1) 3.15 1.35 1.35 ! 0.9983 1044:20 Intra 2.39, 2.49 A assign (resid 34 and name HA) (resid 34 and name HB2) 3.15 1.35 1.35 ! 0.9771 1045:20 Intra 2.37, 2.40 A assign (resid 122 and name HA) (resid 118 and name HB2) 4.90 3.10 3.10 ! 0.0000 1046:20 Mid 7.06, 7.32 A assign (resid 167 and name HA) (resid 168 and name HB2) 4.15 2.35 2.35 ! 0.8813 1051:20 Ambig 4.51, 4.66 A or (resid 167 and name HB) (resid 168 and name HB2) ! 0.1187 1051:20 ----- 6.30, 6.48 A assign (resid 67 and name HA) (resid 67 and name HB*) 2.30 0.50 0.50 ! 0.7594 1055:20 Ambig 2.41, 2.74 A or (resid 47 and name HA) (resid 47 and name HB2) ! 0.2104 1055:20 ----- 2.98, 3.02 A assign (resid 138 and name HA) (resid 138 and name HB1) 3.15 1.35 1.35 ! 0.0000 1056:20 Intra 2.43, 2.51 A assign (resid 138 and name HA) (resid 138 and name HB2) 2.65 0.85 0.85 ! 0.9017 1057:20 Ambig 2.99, 3.02 A or (resid 19 and name HA) (resid 37 and name HB1) ! 0.0800 1057:20 ----- 4.47, 5.50 A assign (resid 18 and name HA) (resid 18 and name HB1) 3.15 1.35 1.35 ! 0.9951 1059:20 Intra 2.42, 2.44 A assign (resid 109 and name HA) (resid 109 and name HB2) 3.65 1.85 1.85 ! 0.9831 1061:20 Intra 2.95, 2.97 A assign (resid 109 and name HA) (resid 109 and name HB1) 3.65 1.85 1.85 ! 0.9871 1066:20 Intra 2.65, 2.68 A assign (resid 134 and name HA) (resid 137 and name HB2) 3.15 1.35 1.35 ! 0.7378 1068:20 Ambig 1.97, 2.31 A or (resid 137 and name HA) (resid 137 and name HB2) ! 0.2432 1068:20 ----- 2.36, 2.45 A assign (resid 130 and name HA) (resid 133 and name HB2) 4.15 2.35 2.35 ! 0.6258 1072:20 Ambig 2.70, 2.93 A or (resid 133 and name HA) (resid 133 and name HB2) ! 0.3215 1072:20 ----- 3.02, 3.02 A assign (resid 133 and name HA) (resid 133 and name HB1) 3.65 1.85 1.85 ! 0.9253 1073:20 Intra 2.44, 2.50 A assign (resid 103 and name HB1) (resid 103 and name HD*) 2.65 0.85 0.85 ! 0.0000 1083:20 Intra 2.34, 3.13 A assign (resid 103 and name HG2) (resid 103 and name HD*) 2.30 0.50 0.50 ! 0.7558 1084:20 Ambig 2.30, 2.71 A or (resid 99 and name HB*) (resid 103 and name HD*) ! 0.2442 1084:20 ----- 2.78, 5.40 A assign (resid 103 and name HG1) (resid 103 and name HD*) 2.30 0.50 0.50 ! 0.9912 1085:20 Intra 2.29, 2.59 A assign (resid 95 and name HB*) (resid 95 and name HE*) 2.30 0.50 0.50 ! 0.4532 1086:20 Ambig 2.16, 4.58 A or (resid 121 and name HD*) (resid 121 and name HE*) ! 0.2707 1086:20 ----- 2.35, 2.67 A or (resid 146 and name HD*) (resid 146 and name HE*) ! 0.2640 1086:20 ----- 2.36, 2.69 A assign (resid 160 and name HD*) (resid 160 and name HE*) 2.30 0.50 0.50 ! 0.0000 1087:20 Intra 2.34, 2.68 A assign (resid 5 and name HB2) (resid 176 and name HE*) 2.30 0.50 0.50 ! 0.3961 1088:20 Ambig 2.38, 4.73 A or (resid 176 and name HD*) (resid 176 and name HE*) ! 0.3950 1088:20 ----- 2.38, 2.69 A or (resid 5 and name HD*) (resid 176 and name HE*) ! 0.2089 1088:20 ----- 2.65, 6.54 A assign (resid 71 and name HG1) (resid 71 and name HE*) 2.30 0.50 0.50 ! 0.5514 1089:20 Ambig 2.29, 3.08 A or (resid 71 and name HD*) (resid 71 and name HE*) ! 0.4446 1089:20 ----- 2.37, 2.67 A assign (resid 179 and name HB2) (resid 179 and name HE*) 2.30 0.50 0.50 ! 0.3313 1090:20 Ambig 2.01, 4.00 A or (resid 71 and name HB2) (resid 71 and name HE*) ! 0.3123 1090:20 ----- 2.03, 4.24 A or (resid 71 and name HB1) (resid 71 and name HE*) ! 0.1775 1090:20 ----- 2.23, 4.48 A or (resid 179 and name HD*) (resid 179 and name HE*) ! 0.1173 1090:20 ----- 2.39, 2.67 A assign (resid 136 and name HB2) (resid 136 and name HE2) 4.15 2.35 2.35 ! 0.9981 1093:20 Intra 2.00, 4.22 A assign (resid 136 and name HD*) (resid 139 and name HB2) 3.65 1.85 1.85 ! 0.5012 1098:20 Ambig 2.37, 4.42 A or (resid 136 and name HG1) (resid 139 and name HB2) ! 0.4569 1098:20 ----- 2.41, 4.82 A assign (resid 140 and name HD2*) (resid 158 and name HB*) 2.65 0.85 0.85 ! 0.8747 1100:20 Ambig 1.93, 3.85 A or (resid 136 and name HG1) (resid 158 and name HB*) ! 0.0735 1100:20 ----- 2.91, 5.17 A assign (resid 140 and name HD2*) (resid 156 and name HB2) 3.65 1.85 1.85 ! 0.4755 1101:20 Ambig 3.14, 4.36 A or (resid 140 and name HD1*) (resid 156 and name HB2) ! 0.4255 1101:20 ----- 3.20, 4.68 A or (resid 140 and name HB1) (resid 156 and name HB2) ! 0.0927 1101:20 ----- 4.12, 5.00 A assign (resid 136 and name HG1) (resid 156 and name HB1) 4.90 3.10 3.10 ! 0.0000 1102:20 Long 5.36, 6.62 A assign (resid 169 and name HG1*) (resid 156 and name HB2) 3.65 1.85 1.85 ! 0.9939 1103:20 Long 2.28, 3.27 A assign (resid 3 and name HG1*) (resid 180 and name HB2) 3.65 1.85 1.85 ! 0.8979 1104:20 Ambig 3.59, 4.95 A or (resid 3 and name HG2*) (resid 180 and name HB2) ! 0.0560 1104:20 ----- 5.69, 6.99 A assign (resid 134 and name HG1*) (resid 137 and name HB2) 3.15 1.35 1.35 ! 0.6282 1105:20 Ambig 3.91, 4.92 A or (resid 136 and name HB1) (resid 137 and name HB2) ! 0.1273 1105:20 ----- 5.11, 5.94 A or (resid 136 and name HB1) (resid 156 and name HB1) ! 0.1213 1105:20 ----- 5.15, 5.63 A or (resid 3 and name HG1*) (resid 180 and name HB1) ! 0.1027 1105:20 ----- 5.29, 6.28 A assign (resid 133 and name HD2*) (resid 156 and name HB1) 4.15 2.35 2.35 ! 0.8916 1107:20 Ambig 3.80, 4.84 A or (resid 155 and name HG2*) (resid 156 and name HB1) ! 0.1084 1107:20 ----- 5.40, 6.19 A assign (resid 136 and name HD*) (resid 139 and name HB1) 3.15 1.35 1.35 ! 0.4929 1108:20 Ambig 3.56, 5.67 A or (resid 136 and name HG1) (resid 139 and name HB1) ! 0.3599 1108:20 ----- 3.75, 6.12 A or (resid 140 and name HD2*) (resid 139 and name HB1) ! 0.1256 1108:20 ----- 4.47, 5.75 A assign (resid 36 and name HG2*) (resid 168 and name HB1) 3.65 1.85 1.85 ! 0.6841 1110:20 Ambig 3.30, 4.39 A or (resid 36 and name HG1*) (resid 168 and name HB1) ! 0.1340 1110:20 ----- 4.33, 5.62 A or (resid 36 and name HG2*) (resid 34 and name HB2) ! 0.0718 1110:20 ----- 4.80, 5.77 A or (resid 155 and name HB) (resid 168 and name HB1) ! 0.0469 1110:20 ----- 5.15, 5.87 A assign (resid 48 and name HD1*) (resid 47 and name HB1) 4.15 2.35 2.35 ! 0.9876 1111:20 Seq 2.19, 5.59 A assign (resid 21 and name HG2*) (resid 37 and name HB2) 3.65 1.85 1.85 ! 0.9453 1112:20 Long 2.20, 3.89 A assign (resid 114 and name HG1*) (resid 118 and name HB2) 3.15 1.35 1.35 ! 0.9993 1113:20 Mid 1.99, 2.89 A assign (resid 133 and name HD1*) (resid 133 and name HB2) 3.15 1.35 1.35 ! 0.9301 1114:20 Intra 2.41, 3.05 A assign (resid 133 and name HD2*) (resid 133 and name HB2) 3.65 1.85 1.85 ! 0.9409 1115:20 Intra 3.69, 3.90 A assign (resid 136 and name HG2) (resid 136 and name HE2) 3.15 1.35 1.35 ! 0.0000 1116:20 Intra 2.40, 2.81 A assign (resid 136 and name HD*) (resid 136 and name HE2) 2.65 0.85 0.85 ! 0.5966 1117:20 Ambig 2.36, 2.69 A or (resid 136 and name HG1) (resid 136 and name HE2) ! 0.3935 1117:20 ----- 2.53, 3.27 A assign (resid 75 and name HG2*) (resid 18 and name HB1) 2.65 0.85 0.85 ! 0.6618 1118:20 Ambig 1.91, 3.21 A or (resid 18 and name HD1*) (resid 18 and name HB1) ! 0.1565 1118:20 ----- 2.43, 3.10 A or (resid 18 and name HD2*) (resid 18 and name HB1) ! 0.1318 1118:20 ----- 2.50, 3.14 A assign (resid 136 and name HG2) (resid 136 and name HE1) 3.65 1.85 1.85 ! 0.0000 1119:20 Intra 2.44, 2.87 A assign (resid 136 and name HD*) (resid 136 and name HE1) 2.65 0.85 0.85 ! 0.5001 1120:20 Ambig 2.38, 2.71 A or (resid 136 and name HG1) (resid 136 and name HE1) ! 0.4914 1120:20 ----- 2.38, 2.86 A assign (resid 109 and name HD1*) (resid 109 and name HB2) 2.65 0.85 0.85 ! 0.9596 1123:20 Intra 2.58, 3.19 A assign (resid 109 and name HD2*) (resid 109 and name HB2) 3.65 1.85 1.85 ! 0.0000 1124:20 Intra 2.38, 3.05 A assign (resid 133 and name HD1*) (resid 133 and name HB1) 2.65 0.85 0.85 ! 0.9580 1125:20 Intra 2.47, 3.10 A assign (resid 133 and name HD2*) (resid 133 and name HB1) 3.65 1.85 1.85 ! 0.9976 1127:20 Intra 2.49, 3.12 A assign (resid 18 and name HD1*) (resid 18 and name HB2) 2.65 0.85 0.85 ! 0.6592 1128:20 Ambig 2.45, 3.07 A or (resid 75 and name HG2*) (resid 18 and name HB2) ! 0.1666 1128:20 ----- 3.08, 4.63 A or (resid 36 and name HG1*) (resid 18 and name HB2) ! 0.1110 1128:20 ----- 3.30, 5.33 A assign (resid 119 and name HD1*) (resid 109 and name HB1) 2.65 0.85 0.85 ! 0.5440 1131:20 Ambig 3.53, 5.10 A or (resid 109 and name HD1*) (resid 109 and name HB1) ! 0.4330 1131:20 ----- 3.67, 3.92 A assign (resid 109 and name HD2*) (resid 109 and name HB1) 3.65 1.85 1.85 ! 0.0000 1132:20 Intra 2.35, 3.06 A assign (resid 20 and name HG2*) (resid 34 and name HB1) 3.65 1.85 1.85 ! 0.9393 1133:20 Long 3.42, 4.45 A assign (resid 20 and name HG2*) (resid 34 and name HB2) 3.65 1.85 1.85 ! 0.9761 1134:20 Long 2.59, 3.66 A assign (resid 8 and name HN) (resid 8 and name HB) 3.65 1.85 1.85 ! 0.0000 1142:20 Intra 2.64, 2.69 A assign (resid 21 and name HN) (resid 20 and name HB) 4.15 2.35 2.35 ! 0.0000 1144:20 Seq 4.17, 4.29 A assign (resid 2 and name HN) (resid 16 and name HB2) 3.65 1.85 1.85 ! 0.5963 1145:20 Ambig 2.04, 3.65 A or (resid 16 and name HN) (resid 16 and name HB2) ! 0.4037 1145:20 ----- 2.18, 3.21 A assign (resid 138 and name HN) (resid 137 and name HB2) 3.65 1.85 1.85 ! 0.8950 1146:20 Ambig 3.73, 3.95 A or (resid 120 and name HN) (resid 118 and name HB1) ! 0.1050 1146:20 ----- 5.33, 5.45 A assign (resid 138 and name HN) (resid 137 and name HB2) 3.65 1.85 1.85 ! 0.7534 1147:20 Ambig 3.73, 3.95 A or (resid 141 and name HN) (resid 156 and name HB1) ! 0.1445 1147:20 ----- 4.91, 5.34 A or (resid 120 and name HN) (resid 118 and name HB1) ! 0.0884 1147:20 ----- 5.33, 5.45 A assign (resid 149 and name HN) (resid 149 and name HB2) 3.65 1.85 1.85 ! 0.0000 1148:20 Intra 2.49, 2.62 A assign (resid 16 and name HN) (resid 16 and name HB1) 4.15 2.35 2.35 ! 0.0000 1149:20 Intra 2.32, 2.57 A assign (resid 101 and name HN) (resid 100 and name HB2) 3.65 1.85 1.85 ! 0.9864 1151:20 Seq 2.41, 2.95 A assign (resid 2 and name HN) (resid 16 and name HB1) 4.15 2.35 2.35 ! 0.7154 1152:20 Ambig 1.99, 3.00 A or (resid 16 and name HN) (resid 16 and name HB1) ! 0.2846 1152:20 ----- 2.32, 2.57 A assign (resid 135 and name HN) (resid 135 and name HB2) 2.65 0.85 0.85 ! 0.9956 1153:20 Intra 2.26, 2.39 A assign (resid 104 and name HN) (resid 100 and name HB2) 4.15 2.35 2.35 ! 0.0000 1154:20 Mid 5.45, 5.65 A assign (resid 135 and name HN) (resid 135 and name HB1) 3.15 1.35 1.35 ! 0.7469 1155:20 Ambig 3.54, 3.62 A or (resid 104 and name HN) (resid 100 and name HB1) ! 0.2531 1155:20 ----- 4.24, 4.54 A assign (resid 149 and name HN) (resid 149 and name HB1) 3.65 1.85 1.85 ! 0.0000 1158:20 Intra 2.61, 3.61 A assign (resid 141 and name HN) (resid 141 and name HG1) 3.65 1.85 1.85 ! 0.7569 1160:20 Ambig 2.77, 3.44 A or (resid 86 and name HN) (resid 141 and name HG1) ! 0.1749 1160:20 ----- 3.54, 6.33 A assign (resid 101 and name HN) (resid 101 and name HB2) 3.65 1.85 1.85 ! 0.9942 1161:20 Intra 2.30, 2.45 A assign (resid 101 and name HN) (resid 101 and name HB1) 3.65 1.85 1.85 ! 0.9955 1162:20 Intra 2.40, 2.54 A assign (resid 120 and name HN) (resid 119 and name HB) 2.65 0.85 0.85 ! 0.9932 1163:20 Seq 2.67, 2.84 A assign (resid 2 and name HN) (resid 2 and name HB) 2.65 0.85 0.85 ! 0.8378 1164:20 Ambig 2.37, 2.53 A or (resid 16 and name HN) (resid 2 and name HB) ! 0.1622 1164:20 ----- 3.12, 3.54 A assign (resid 101 and name HN) (resid 101 and name HB1) 3.15 1.35 1.35 ! 0.9955 1165:20 Intra 2.40, 2.54 A assign (resid 155 and name HN) (resid 155 and name HB) 3.65 1.85 1.85 ! 0.9945 1166:20 Intra 2.21, 2.32 A assign (resid 122 and name HN) (resid 122 and name HB2) 2.65 0.85 0.85 ! 0.0000 1169:20 Intra 2.04, 2.12 A assign (resid 122 and name HN) (resid 122 and name HB1) 3.15 1.35 1.35 ! 0.9970 1170:20 Intra 2.61, 2.65 A assign (resid 122 and name HD*) (resid 122 and name HB1) 4.15 2.35 2.35 ! 0.9977 1172:20 Intra 2.59, 3.07 A assign (resid 122 and name HD*) (resid 122 and name HB2) 3.15 1.35 1.35 ! 0.0000 1173:20 Intra 2.22, 3.01 A assign (resid 122 and name HD*) (resid 122 and name HB1) 3.15 1.35 1.35 ! 0.0000 1174:20 Intra 2.59, 3.07 A assign (resid 137 and name HN) (resid 137 and name HB2) 2.65 0.85 0.85 ! 0.9238 1175:20 Intra 2.17, 2.44 A assign (resid 149 and name HD21) (resid 149 and name HB2) 3.65 1.85 1.85 ! 0.9968 1176:20 Intra 2.20, 2.51 A assign (resid 118 and name HN) (resid 118 and name HB2) 3.65 1.85 1.85 ! 0.9960 1177:20 Intra 2.30, 2.37 A assign (resid 11 and name HN) (resid 11 and name HB*) 3.65 1.85 1.85 ! 0.9570 1178:20 Intra 2.25, 2.80 A assign (resid 136 and name HN) (resid 135 and name HB1) 3.65 1.85 1.85 ! 0.9111 1179:20 Ambig 3.21, 3.56 A or (resid 18 and name HN) (resid 16 and name HB1) ! 0.0810 1179:20 ----- 4.80, 5.26 A assign (resid 149 and name HD21) (resid 149 and name HB1) 3.65 1.85 1.85 ! 0.5781 1180:20 Ambig 2.19, 3.21 A or (resid 83 and name HN) (resid 83 and name HB2) ! 0.4170 1180:20 ----- 2.31, 2.47 A assign (resid 94 and name HN) (resid 94 and name HB1) 2.65 0.85 0.85 ! 0.5033 1181:20 Ambig 2.32, 2.43 A or (resid 81 and name HD*) (resid 81 and name HB*) ! 0.4939 1181:20 ----- 2.33, 3.04 A assign (resid 94 and name HN) (resid 94 and name HB2) 3.65 1.85 1.85 ! 0.6123 1182:20 Ambig 2.58, 2.69 A or (resid 90 and name HN) (resid 94 and name HB2) ! 0.3791 1182:20 ----- 2.79, 4.59 A assign (resid 142 and name HN) (resid 141 and name HG2) 4.15 2.35 2.35 ! 0.0000 1183:20 Seq 2.55, 3.85 A assign (resid 118 and name HN) (resid 119 and name HB) 3.65 1.85 1.85 ! 0.6941 1184:20 Ambig 4.43, 4.61 A or (resid 122 and name HN) (resid 119 and name HB) ! 0.2154 1184:20 ----- 5.38, 5.44 A or (resid 114 and name HN) (resid 119 and name HB) ! 0.0905 1184:20 ----- 6.22, 6.62 A assign (resid 119 and name HN) (resid 119 and name HB) 3.15 1.35 1.35 ! 0.0000 1185:20 Intra 2.39, 2.48 A assign (resid 20 and name HN) (resid 20 and name HB) 2.65 0.85 0.85 ! 0.9957 1186:20 Intra 2.43, 2.57 A assign (resid 56 and name HD*) (resid 56 and name HB2) 3.65 1.85 1.85 ! 0.0000 1187:20 Intra 2.27, 3.02 A assign (resid 56 and name HD*) (resid 56 and name HB1) 3.15 1.35 1.35 ! 0.0000 1188:20 Intra 2.36, 3.05 A assign (resid 100 and name HN) (resid 100 and name HB2) 2.65 0.85 0.85 ! 0.0000 1189:20 Intra 2.19, 2.36 A assign (resid 100 and name HN) (resid 100 and name HB1) 3.15 1.35 1.35 ! 0.9639 1190:20 Intra 3.48, 3.60 A assign (resid 175 and name HD*) (resid 4 and name HB1) 3.65 1.85 1.85 ! 0.9691 1192:20 Long 2.26, 4.34 A assign (resid 4 and name HD*) (resid 4 and name HB1) 3.65 1.85 1.85 ! 0.0000 1194:20 Intra 2.31, 3.04 A assign (resid 101 and name HD*) (resid 101 and name HB2) 3.65 1.85 1.85 ! 0.0000 1195:20 Intra 2.40, 3.06 A assign (resid 142 and name HD*) (resid 141 and name HG1) 4.15 2.35 2.35 ! 0.0000 1196:20 Seq 4.59, 6.96 A assign (resid 175 and name HD*) (resid 4 and name HB1) 3.65 1.85 1.85 ! 0.9794 1197:20 Long 2.26, 4.34 A assign (resid 101 and name HD*) (resid 101 and name HB1) 3.65 1.85 1.85 ! 0.0000 1198:20 Intra 2.30, 3.03 A assign (resid 16 and name HA) (resid 16 and name HB2) 2.65 0.85 0.85 ! 0.0000 1201:20 Intra 2.36, 2.44 A assign (resid 122 and name HA) (resid 122 and name HB2) 3.65 1.85 1.85 ! 0.0000 1202:20 Intra 2.58, 2.62 A assign (resid 122 and name HA) (resid 122 and name HB2) 3.65 1.85 1.85 ! 0.0000 1203:20 Intra 2.58, 2.62 A assign (resid 122 and name HA) (resid 122 and name HB1) 4.15 2.35 2.35 ! 0.0000 1204:20 Intra 2.99, 3.01 A assign (resid 16 and name HA) (resid 16 and name HB1) 2.65 0.85 0.85 ! 0.0000 1205:20 Intra 2.29, 2.68 A assign (resid 2 and name HA) (resid 16 and name HB1) 4.15 2.35 2.35 ! 0.7955 1206:20 Ambig 4.62, 5.03 A or (resid 152 and name HA) (resid 100 and name HB1) ! 0.1131 1206:20 ----- 6.40, 7.61 A or (resid 179 and name HA) (resid 16 and name HB1) ! 0.0914 1206:20 ----- 6.63, 7.18 A assign (resid 149 and name HA) (resid 149 and name HB1) 3.65 1.85 1.85 ! 0.9825 1207:20 Intra 2.47, 2.61 A assign (resid 2 and name HA) (resid 2 and name HB) 3.15 1.35 1.35 ! 0.9202 1208:20 Intra 3.03, 3.04 A assign (resid 125 and name HA) (resid 125 and name HG1) 3.15 1.35 1.35 ! 0.9300 1213:20 Intra 2.69, 3.08 A assign (resid 135 and name HA) (resid 135 and name HB2) 3.15 1.35 1.35 ! 0.9346 1215:20 Intra 2.96, 2.99 A assign (resid 147 and name HB*) (resid 11 and name HB*) 2.65 0.85 0.85 ! 0.5692 1216:20 Ambig 2.77, 5.38 A or (resid 100 and name HA) (resid 100 and name HB2) ! 0.4090 1216:20 ----- 2.93, 2.99 A assign (resid 135 and name HA) (resid 135 and name HB1) 2.30 0.50 0.50 ! 0.5055 1217:20 Ambig 2.49, 2.61 A or (resid 100 and name HA) (resid 100 and name HB1) ! 0.4904 1217:20 ----- 2.51, 2.61 A assign (resid 97 and name HA) (resid 100 and name HB2) 3.65 1.85 1.85 ! 0.9765 1218:20 Mid 2.18, 2.73 A assign (resid 148 and name HA) (resid 149 and name HB1) 4.15 2.35 2.35 ! 0.8319 1220:20 Ambig 4.51, 5.46 A or (resid 85 and name HA) (resid 83 and name HB2) ! 0.1681 1220:20 ----- 5.89, 6.28 A assign (resid 8 and name HA) (resid 8 and name HB) 4.15 2.35 2.35 ! 0.0000 1222:20 Intra 3.02, 3.03 A assign (resid 101 and name HA) (resid 101 and name HB2) 4.15 2.35 2.35 ! 0.0000 1223:20 Intra 2.42, 2.49 A assign (resid 141 and name HA) (resid 141 and name HG2) 2.65 0.85 0.85 ! 0.0000 1224:20 Intra 2.36, 2.76 A assign (resid 48 and name HA) (resid 48 and name HB) 3.15 1.35 1.35 ! 0.8876 1227:20 Ambig 3.03, 3.05 A or (resid 50 and name HA) (resid 48 and name HB) ! 0.1124 1227:20 ----- 4.28, 7.00 A assign (resid 50 and name HA) (resid 50 and name HB) 3.15 1.35 1.35 ! 0.9733 1228:20 Intra 3.03, 3.05 A assign (resid 101 and name HA) (resid 101 and name HB1) 3.65 1.85 1.85 ! 0.0000 1229:20 Intra 3.02, 3.03 A assign (resid 19 and name HA) (resid 20 and name HB) 3.65 1.85 1.85 ! 0.0000 1231:20 Seq 4.40, 4.57 A assign (resid 20 and name HA) (resid 20 and name HB) 3.65 1.85 1.85 ! 0.9934 1232:20 Intra 3.03, 3.04 A assign (resid 20 and name HA) (resid 20 and name HB) 3.65 1.85 1.85 ! 0.9863 1233:20 Intra 3.03, 3.04 A assign (resid 134 and name HA) (resid 137 and name HB1) 3.65 1.85 1.85 ! 0.5699 1234:20 Ambig 2.85, 3.27 A or (resid 137 and name HA) (resid 137 and name HB1) ! 0.4240 1234:20 ----- 3.00, 3.02 A assign (resid 119 and name HA) (resid 122 and name HB2) 4.15 2.35 2.35 ! 0.9941 1235:20 Mid 2.13, 2.42 A assign (resid 6 and name HB1) (resid 11 and name HB*) 3.15 1.35 1.35 ! 0.7924 1238:20 Ambig 3.58, 4.71 A or (resid 103 and name HD*) (resid 100 and name HB2) ! 0.2076 1238:20 ----- 4.48, 6.09 A assign (resid 157 and name HB1) (resid 83 and name HB2) 4.90 3.10 3.10 ! 0.0000 1240:20 Long 7.56, 7.81 A assign (resid 94 and name HA) (resid 94 and name HB2) 3.65 1.85 1.85 ! 0.0000 1243:20 Intra 2.38, 2.43 A assign (resid 116 and name HA) (resid 119 and name HB) 2.65 0.85 0.85 ! 0.8991 1244:20 Ambig 2.09, 2.39 A or (resid 119 and name HA) (resid 119 and name HB) ! 0.1009 1244:20 ----- 3.01, 3.03 A assign (resid 16 and name HB1) (resid 2 and name HB) 3.65 1.85 1.85 ! 0.9969 1252:20 Long 1.91, 2.75 A assign (resid 143 and name HB1) (resid 155 and name HB) 3.65 1.85 1.85 ! 0.9176 1253:20 Ambig 3.05, 3.30 A or (resid 142 and name HB1) (resid 155 and name HB) ! 0.0543 1253:20 ----- 4.89, 5.27 A assign (resid 2 and name HB) (resid 16 and name HB2) 3.65 1.85 1.85 ! 0.9673 1256:20 Long 2.01, 3.29 A assign (resid 2 and name HB) (resid 16 and name HB2) 4.15 2.35 2.35 ! 0.0000 1257:20 Long 2.01, 3.29 A assign (resid 117 and name HB*) (resid 118 and name HB2) 3.65 1.85 1.85 ! 0.2553 1259:20 Ambig 4.42, 5.36 A or (resid 148 and name HB1) (resid 11 and name HB*) ! 0.2002 1259:20 ----- 4.61, 5.65 A or (resid 103 and name HB1) (resid 100 and name HB2) ! 0.1765 1259:20 ----- 4.70, 6.05 A or (resid 119 and name HB) (resid 118 and name HB2) ! 0.1644 1259:20 ----- 4.76, 5.08 A or (resid 35 and name HB2) (resid 37 and name HB2) ! 0.1025 1259:20 ----- 5.15, 6.75 A or (resid 121 and name HB*) (resid 118 and name HB2) ! 0.0842 1259:20 ----- 5.32, 6.42 A assign (resid 5 and name HB1) (resid 11 and name HB*) 4.15 2.35 2.35 ! 0.3678 1260:20 Ambig 5.36, 6.28 A or (resid 103 and name HG1) (resid 100 and name HB2) ! 0.2819 1260:20 ----- 5.60, 6.84 A or (resid 99 and name HG1) (resid 100 and name HB2) ! 0.1790 1260:20 ----- 6.04, 6.73 A or (resid 8 and name HG12) (resid 100 and name HB2) ! 0.0998 1260:20 ----- 6.66, 7.67 A assign (resid 2 and name HB) (resid 16 and name HB1) 3.65 1.85 1.85 ! 0.9453 1261:20 Long 1.91, 2.75 A assign (resid 99 and name HB*) (resid 100 and name HB2) 3.65 1.85 1.85 ! 0.9093 1263:20 Ambig 4.04, 5.14 A or (resid 98 and name HB) (resid 100 and name HB2) ! 0.0459 1263:20 ----- 6.64, 6.98 A assign (resid 131 and name HG*) (resid 135 and name HB2) 4.15 2.35 2.35 ! 0.8629 1264:20 Ambig 3.86, 6.02 A or (resid 163 and name HB*) (resid 159 and name HB2) ! 0.1190 1264:20 ----- 5.37, 6.70 A assign (resid 2 and name HB) (resid 16 and name HB1) 3.65 1.85 1.85 ! 0.9453 1266:20 Long 1.91, 2.75 A assign (resid 152 and name HB*) (resid 149 and name HB1) 3.65 1.85 1.85 ! 0.9855 1267:20 Mid 2.40, 4.75 A assign (resid 152 and name HB*) (resid 8 and name HB) 3.15 1.35 1.35 ! 0.9957 1269:20 Long 3.05, 4.29 A assign (resid 120 and name HD*) (resid 119 and name HB) 3.65 1.85 1.85 ! 0.0000 1271:20 Seq 4.05, 5.32 A assign (resid 98 and name HG2*) (resid 137 and name HB2) 4.15 2.35 2.35 ! 0.0000 1274:20 Long 6.30, 7.72 A assign (resid 2 and name HG12) (resid 16 and name HB1) 3.65 1.85 1.85 ! 0.6518 1275:20 Ambig 2.82, 4.24 A or (resid 8 and name HD1*) (resid 100 and name HB1) ! 0.3215 1275:20 ----- 3.17, 4.91 A assign (resid 8 and name HD1*) (resid 100 and name HB2) 4.15 2.35 2.35 ! 0.8899 1276:20 Ambig 4.06, 5.85 A or (resid 75 and name HG2*) (resid 37 and name HB2) ! 0.0603 1276:20 ----- 6.36, 7.81 A assign (resid 8 and name HG2*) (resid 8 and name HB) 2.30 0.50 0.50 ! 0.9284 1277:20 Intra 2.43, 2.64 A assign (resid 48 and name HG2*) (resid 48 and name HB) 2.65 0.85 0.85 ! 0.4136 1278:20 Ambig 2.40, 2.64 A or (resid 48 and name HD1*) (resid 48 and name HB) ! 0.3366 1278:20 ----- 2.49, 3.39 A or (resid 50 and name HD1*) (resid 48 and name HB) ! 0.2498 1278:20 ----- 2.61, 6.93 A assign (resid 50 and name HG2*) (resid 50 and name HB) 2.65 0.85 0.85 ! 0.5680 1279:20 Ambig 2.42, 2.64 A or (resid 50 and name HD1*) (resid 50 and name HB) ! 0.4081 1279:20 ----- 2.55, 3.43 A assign (resid 102 and name HG2*) (resid 101 and name HB1) 3.65 1.85 1.85 ! 0.9132 1280:20 Ambig 2.94, 4.09 A or (resid 98 and name HG2*) (resid 101 and name HB1) ! 0.0799 1280:20 ----- 4.41, 5.54 A assign (resid 119 and name HG2*) (resid 119 and name HB) 2.65 0.85 0.85 ! 0.8904 1281:20 Ambig 2.40, 2.63 A or (resid 116 and name HG1*) (resid 119 and name HB) ! 0.1077 1281:20 ----- 3.42, 4.47 A assign (resid 119 and name HG11) (resid 119 and name HB) 2.30 0.50 0.50 ! 0.6940 1282:20 Ambig 2.36, 2.45 A or (resid 119 and name HD1*) (resid 119 and name HB) ! 0.3060 1282:20 ----- 2.70, 3.91 A assign (resid 2 and name HG12) (resid 2 and name HB) 3.15 1.35 1.35 ! 0.9958 1283:20 Intra 2.44, 2.63 A assign (resid 2 and name HD1*) (resid 2 and name HB) 3.15 1.35 1.35 ! 0.9968 1284:20 Intra 2.57, 3.72 A assign (resid 2 and name HG2*) (resid 2 and name HB) 2.65 0.85 0.85 ! 0.9840 1285:20 Intra 2.40, 2.63 A assign (resid 155 and name HG2*) (resid 155 and name HB) 3.65 1.85 1.85 ! 0.0000 1287:20 Intra 2.34, 2.62 A assign (resid 20 and name HD1*) (resid 16 and name HB2) 3.65 1.85 1.85 ! 0.9453 1288:20 Mid 3.26, 4.85 A assign (resid 20 and name HG2*) (resid 20 and name HB) 2.30 0.50 0.50 ! 0.5194 1294:20 Ambig 2.38, 2.64 A or (resid 20 and name HD1*) (resid 20 and name HB) ! 0.4806 1294:20 ----- 2.41, 3.17 A assign (resid 155 and name HD1*) (resid 155 and name HB) 3.65 1.85 1.85 ! 0.0000 1295:20 Intra 2.45, 3.08 A assign (resid 132 and name HE1) (resid 25 and name HG*) 3.15 1.35 1.35 ! 0.0000 1296:20 Long 1.86, 3.07 A assign (resid 105 and name HN) (resid 104 and name HB2) 3.65 1.85 1.85 ! 0.9755 1298:20 Seq 2.77, 2.87 A assign (resid 105 and name HN) (resid 104 and name HB1) 4.15 2.35 2.35 ! 0.8759 1299:20 Ambig 3.37, 3.59 A or (resid 8 and name HN) (resid 104 and name HB1) ! 0.1241 1299:20 ----- 4.67, 5.26 A assign (resid 117 and name HN) (resid 117 and name HG2) 3.65 1.85 1.85 ! 0.0000 1300:20 Intra 3.22, 3.59 A assign (resid 12 and name HN) (resid 12 and name HG*) 3.15 1.35 1.35 ! 0.9896 1301:20 Intra 2.17, 3.34 A assign (resid 36 and name HN) (resid 36 and name HB) 3.65 1.85 1.85 ! 0.9783 1302:20 Intra 2.52, 2.62 A assign (resid 117 and name HN) (resid 117 and name HG1) 4.15 2.35 2.35 ! 0.0000 1303:20 Intra 2.06, 2.56 A assign (resid 176 and name HN) (resid 176 and name HB*) 3.15 1.35 1.35 ! 0.0000 1307:20 Intra 2.38, 3.14 A assign (resid 5 and name HN) (resid 176 and name HB*) 3.65 1.85 1.85 ! 0.8378 1308:20 Ambig 2.78, 4.35 A or (resid 143 and name HN) (resid 86 and name HB2) ! 0.1234 1308:20 ----- 3.82, 4.56 A assign (resid 5 and name HN) (resid 5 and name HB2) 3.15 1.35 1.35 ! 0.9468 1309:20 Intra 2.31, 2.47 A assign (resid 5 and name HN) (resid 5 and name HB1) 3.65 1.85 1.85 ! 0.7850 1310:20 Ambig 3.57, 3.65 A or (resid 12 and name HN) (resid 5 and name HB1) ! 0.1947 1310:20 ----- 4.50, 5.50 A assign (resid 104 and name HN) (resid 104 and name HB2) 3.65 1.85 1.85 ! 0.0000 1311:20 Intra 2.32, 2.41 A assign (resid 104 and name HD21) (resid 104 and name HB2) 3.65 1.85 1.85 ! 0.9922 1313:20 Intra 2.22, 2.28 A assign (resid 104 and name HN) (resid 104 and name HB1) 3.15 1.35 1.35 ! 0.0000 1314:20 Intra 3.58, 3.63 A assign (resid 104 and name HD21) (resid 104 and name HB1) 3.65 1.85 1.85 ! 0.9938 1315:20 Intra 2.88, 3.41 A assign (resid 168 and name HN) (resid 36 and name HB) 3.65 1.85 1.85 ! 0.9827 1317:20 Long 2.03, 2.51 A assign (resid 29 and name HN) (resid 29 and name HG1) 3.15 1.35 1.35 ! 0.0000 1319:20 Intra 2.92, 3.22 A assign (resid 29 and name HN) (resid 29 and name HG2) 2.65 0.85 0.85 ! 0.9896 1320:20 Intra 2.07, 2.27 A assign (resid 42 and name HN) (resid 41 and name HB) 3.15 1.35 1.35 ! 0.9859 1321:20 Seq 2.17, 2.61 A assign (resid 2 and name HN) (resid 1 and name HB1) 3.65 1.85 1.85 ! 0.8280 1324:20 Ambig 3.83, 4.24 A or (resid 16 and name HN) (resid 1 and name HB1) ! 0.1720 1324:20 ----- 4.97, 5.84 A assign (resid 3 and name HN) (resid 3 and name HB) 2.65 0.85 0.85 ! 0.8683 1325:20 Ambig 2.94, 3.11 A or (resid 180 and name HN) (resid 3 and name HB) ! 0.1038 1325:20 ----- 4.18, 4.84 A assign (resid 177 and name HN) (resid 176 and name HB*) 2.65 0.85 0.85 ! 0.0000 1326:20 Seq 3.06, 3.90 A assign (resid 179 and name HN) (resid 178 and name HB) 4.15 2.35 2.35 ! 0.9309 1327:20 Seq 3.88, 4.10 A assign (resid 72 and name HN) (resid 71 and name HB2) 3.65 1.85 1.85 ! 0.0000 1328:20 Seq 3.55, 4.14 A assign (resid 72 and name HN) (resid 71 and name HB1) 4.15 2.35 2.35 ! 0.0000 1329:20 Seq 2.29, 3.17 A assign (resid 86 and name HN) (resid 86 and name HB1) 3.65 1.85 1.85 ! 0.0000 1330:20 Intra 3.64, 3.73 A assign (resid 128 and name HN) (resid 129 and name HB1) 4.15 2.35 2.35 ! 0.0000 1331:20 Seq 6.12, 6.20 A assign (resid 125 and name HN) (resid 125 and name HG1) 3.15 1.35 1.35 ! 0.9574 1332:20 Intra 2.10, 2.23 A assign (resid 93 and name HN) (resid 93 and name HG*) 3.15 1.35 1.35 ! 0.0000 1333:20 Intra 1.81, 3.54 A assign (resid 94 and name HN) (resid 93 and name HG*) 3.15 1.35 1.35 ! 0.9892 1334:20 Seq 2.29, 4.30 A assign (resid 124 and name HN) (resid 124 and name HG*) 2.65 0.85 0.85 ! 0.9333 1335:20 Intra 2.19, 3.08 A assign (resid 4 and name HN) (resid 3 and name HB) 3.65 1.85 1.85 ! 0.0000 1337:20 Seq 4.02, 4.07 A assign (resid 129 and name HD*) (resid 129 and name HB2) 3.15 1.35 1.35 ! 0.9904 1338:20 Intra 2.24, 3.00 A assign (resid 74 and name HD21) (resid 74 and name HB2) 3.65 1.85 1.85 ! 0.0000 1340:20 Intra 3.47, 3.54 A assign (resid 104 and name HD22) (resid 104 and name HB1) 3.65 1.85 1.85 ! 0.9026 1341:20 Ambig 3.76, 4.02 A or (resid 107 and name HE21) (resid 104 and name HB1) ! 0.0532 1341:20 ----- 6.02, 7.38 A assign (resid 132 and name HD1) (resid 25 and name HG*) 3.15 1.35 1.35 ! 0.0000 1344:20 Long 2.77, 4.45 A assign (resid 156 and name HD*) (resid 169 and name HB) 3.65 1.85 1.85 ! 0.0000 1347:20 Long 3.48, 4.58 A assign (resid 14 and name HN) (resid 13 and name HB) 3.65 1.85 1.85 ! 0.7394 1349:20 Ambig 3.65, 3.94 A or (resid 175 and name HD*) (resid 13 and name HB) ! 0.2606 1349:20 ----- 4.34, 6.43 A assign (resid 35 and name HA) (resid 36 and name HB) 4.15 2.35 2.35 ! 0.0000 1351:20 Seq 4.50, 4.69 A assign (resid 2 and name HA) (resid 3 and name HB) 3.15 1.35 1.35 ! 0.4701 1353:20 Ambig 4.26, 4.43 A or (resid 179 and name HA) (resid 3 and name HB) ! 0.3319 1353:20 ----- 4.51, 5.37 A or (resid 4 and name HA) (resid 3 and name HB) ! 0.0745 1353:20 ----- 5.79, 5.88 A or (resid 12 and name HA) (resid 3 and name HB) ! 0.0744 1353:20 ----- 5.79, 6.19 A assign (resid 175 and name HA) (resid 176 and name HB*) 3.65 1.85 1.85 ! 0.0000 1354:20 Seq 4.40, 5.17 A assign (resid 71 and name HA) (resid 71 and name HB2) 4.15 2.35 2.35 ! 0.0000 1355:20 Intra 2.99, 3.02 A assign (resid 71 and name HA) (resid 71 and name HB1) 4.15 2.35 2.35 ! 0.0000 1356:20 Intra 2.40, 2.51 A assign (resid 71 and name HA) (resid 71 and name HB1) 3.65 1.85 1.85 ! 0.0000 1357:20 Intra 2.40, 2.51 A assign (resid 5 and name HA) (resid 5 and name HB2) 3.65 1.85 1.85 ! 0.0000 1358:20 Intra 2.99, 3.02 A assign (resid 5 and name HA) (resid 5 and name HB1) 3.65 1.85 1.85 ! 0.0000 1359:20 Intra 2.44, 2.51 A assign (resid 175 and name HA) (resid 5 and name HB2) 4.15 2.35 2.35 ! 0.0000 1360:20 Long 5.56, 6.03 A assign (resid 4 and name HA) (resid 5 and name HB2) 3.65 1.85 1.85 ! 0.4200 1361:20 Ambig 4.33, 4.46 A or (resid 12 and name HA) (resid 5 and name HB2) ! 0.3124 1361:20 ----- 4.55, 4.98 A or (resid 176 and name HA) (resid 5 and name HB2) ! 0.2676 1361:20 ----- 4.66, 5.12 A assign (resid 86 and name HA) (resid 86 and name HB1) 3.15 1.35 1.35 ! 0.0000 1362:20 Intra 2.43, 2.53 A assign (resid 128 and name HB) (resid 129 and name HB1) 4.15 2.35 2.35 ! 0.7548 1365:20 Ambig 5.92, 6.02 A or (resid 32 and name HA2) (resid 129 and name HB1) ! 0.2452 1365:20 ----- 7.14, 7.64 A assign (resid 104 and name HA) (resid 104 and name HB2) 3.15 1.35 1.35 ! 0.0000 1366:20 Intra 2.99, 3.01 A assign (resid 101 and name HA) (resid 104 and name HB2) 3.65 1.85 1.85 ! 0.0000 1367:20 Mid 2.95, 3.24 A assign (resid 74 and name HA) (resid 74 and name HB2) 2.65 0.85 0.85 ! 0.9625 1368:20 Intra 2.39, 2.42 A assign (resid 104 and name HA) (resid 104 and name HB1) 2.65 0.85 0.85 ! 0.0000 1370:20 Intra 2.53, 2.58 A assign (resid 101 and name HA) (resid 104 and name HB1) 3.65 1.85 1.85 ! 0.8729 1371:20 Ambig 4.57, 4.89 A or (resid 108 and name HA) (resid 104 and name HB1) ! 0.1271 1371:20 ----- 6.30, 6.64 A assign (resid 121 and name HA) (resid 124 and name HG*) 2.30 0.50 0.50 ! 0.5634 1372:20 Ambig 2.12, 3.28 A or (resid 93 and name HA) (resid 93 and name HG*) ! 0.2355 1372:20 ----- 2.45, 3.20 A or (resid 125 and name HA) (resid 125 and name HG2) ! 0.1925 1372:20 ----- 2.54, 2.60 A assign (resid 74 and name HA) (resid 74 and name HB1) 3.15 1.35 1.35 ! 0.9856 1373:20 Intra 2.44, 2.47 A assign (resid 8 and name HA) (resid 104 and name HB1) 4.15 2.35 2.35 ! 0.0000 1374:20 Long 3.71, 4.32 A assign (resid 85 and name HA) (resid 144 and name HB*) 4.15 2.35 2.35 ! 0.0000 1375:20 Long 5.48, 6.76 A assign (resid 1 and name HA) (resid 1 and name HB2) 3.15 1.35 1.35 ! 0.9919 1379:20 Intra 2.41, 2.46 A assign (resid 15 and name HB2) (resid 1 and name HB2) 4.15 2.35 2.35 ! 0.0000 1380:20 Long 2.58, 4.86 A assign (resid 3 and name HA) (resid 3 and name HB) 3.15 1.35 1.35 ! 0.0000 1382:20 Intra 2.44, 2.49 A assign (resid 1 and name HA) (resid 1 and name HB1) 2.65 0.85 0.85 ! 0.9954 1383:20 Intra 2.41, 2.89 A assign (resid 85 and name HA) (resid 86 and name HB2) 3.65 1.85 1.85 ! 0.5747 1385:20 Ambig 4.12, 4.39 A or (resid 89 and name HB1) (resid 86 and name HB2) ! 0.2892 1385:20 ----- 4.62, 7.49 A or (resid 112 and name HB*) (resid 176 and name HB*) ! 0.1361 1385:20 ----- 5.24, 7.59 A assign (resid 174 and name HA1) (resid 129 and name HB1) 4.15 2.35 2.35 ! 0.5384 1389:20 Ambig 5.23, 5.63 A or (resid 102 and name HA) (resid 129 and name HB1) ! 0.4616 1389:20 ----- 5.37, 6.17 A assign (resid 132 and name HB2) (resid 25 and name HG*) 4.15 2.35 2.35 ! 0.0000 1393:20 Long 5.12, 6.65 A assign (resid 156 and name HB2) (resid 169 and name HB) 3.65 1.85 1.85 ! 0.5364 1394:20 Ambig 1.90, 2.01 A or (resid 180 and name HB2) (resid 1 and name HB1) ! 0.4636 1394:20 ----- 1.95, 3.27 A assign (resid 124 and name HB2) (resid 125 and name HG1) 2.65 0.85 0.85 ! 0.8970 1400:20 Ambig 2.65, 3.32 A or (resid 31 and name HG2) (resid 125 and name HG1) ! 0.1006 1400:20 ----- 3.82, 4.88 A assign (resid 117 and name HB*) (resid 117 and name HG2) 2.30 0.50 0.50 ! 0.9914 1402:20 Intra 2.29, 2.61 A assign (resid 156 and name HB1) (resid 169 and name HB) 3.15 1.35 1.35 ! 0.8935 1404:20 Ambig 2.25, 2.72 A or (resid 180 and name HB1) (resid 1 and name HB1) ! 0.1042 1404:20 ----- 3.22, 4.45 A assign (resid 165 and name HB1) (resid 72 and name HB*) 4.15 2.35 2.35 ! 0.9291 1405:20 Long 3.51, 6.90 A assign (resid 1 and name HG1) (resid 1 and name HB1) 2.65 0.85 0.85 ! 0.8995 1407:20 Ambig 2.43, 2.83 A or (resid 16 and name HB1) (resid 1 and name HB1) ! 0.1005 1407:20 ----- 3.50, 6.32 A assign (resid 120 and name HG*) (resid 117 and name HG1) 3.15 1.35 1.35 ! 0.4994 1410:20 Ambig 3.91, 5.25 A or (resid 115 and name HB*) (resid 117 and name HG1) ! 0.4669 1410:20 ----- 3.96, 5.99 A assign (resid 42 and name HB*) (resid 41 and name HB) 3.65 1.85 1.85 ! 0.8744 1411:20 Ambig 4.20, 5.23 A or (resid 39 and name HB*) (resid 41 and name HB) ! 0.1256 1411:20 ----- 5.80, 7.47 A assign (resid 176 and name HG*) (resid 176 and name HB*) 2.30 0.50 0.50 ! 0.8883 1412:20 Ambig 2.35, 2.73 A or (resid 108 and name HB*) (resid 176 and name HB*) ! 0.0544 1412:20 ----- 3.74, 6.44 A assign (resid 178 and name HB) (resid 5 and name HB2) 3.65 1.85 1.85 ! 0.9540 1413:20 Long 3.82, 4.55 A assign (resid 40 and name HB1) (resid 71 and name HB1) 3.65 1.85 1.85 ! 0.9962 1414:20 Long 1.87, 2.14 A assign (resid 178 and name HB) (resid 5 and name HB1) 4.15 2.35 2.35 ! 0.7213 1415:20 Ambig 4.75, 5.71 A or (resid 12 and name HB1) (resid 5 and name HB1) ! 0.2787 1415:20 ----- 5.57, 6.36 A assign (resid 86 and name HG1) (resid 86 and name HB1) 2.30 0.50 0.50 ! 0.5672 1416:20 Ambig 2.38, 2.48 A or (resid 86 and name HG2) (resid 86 and name HB1) ! 0.4291 1416:20 ----- 2.49, 2.98 A assign (resid 33 and name HD2*) (resid 129 and name HB2) 3.65 1.85 1.85 ! 0.0000 1420:20 Long 4.03, 5.29 A assign (resid 33 and name HD2*) (resid 129 and name HB1) 4.15 2.35 2.35 ! 0.0000 1421:20 Long 2.59, 3.85 A assign (resid 33 and name HD2*) (resid 129 and name HB1) 4.15 2.35 2.35 ! 0.0000 1422:20 Long 2.59, 3.85 A assign (resid 33 and name HD1*) (resid 129 and name HB1) 4.15 2.35 2.35 ! 0.5614 1423:20 Ambig 4.23, 5.27 A or (resid 133 and name HD2*) (resid 129 and name HB1) ! 0.4386 1423:20 ----- 4.40, 5.61 A assign (resid 8 and name HD1*) (resid 104 and name HB2) 3.65 1.85 1.85 ! 0.0000 1424:20 Long 2.17, 2.68 A assign (resid 18 and name HD2*) (resid 74 and name HB2) 2.65 0.85 0.85 ! 0.7551 1425:20 Ambig 2.21, 3.85 A or (resid 41 and name HG2*) (resid 74 and name HB2) ! 0.1152 1425:20 ----- 3.02, 4.22 A or (resid 41 and name HG1*) (resid 74 and name HB2) ! 0.1145 1425:20 ----- 3.02, 4.09 A assign (resid 8 and name HD1*) (resid 104 and name HB1) 2.65 0.85 0.85 ! 0.0000 1426:20 Long 2.57, 3.52 A assign (resid 3 and name HG2*) (resid 12 and name HG*) 2.65 0.85 0.85 ! 0.7763 1427:20 Ambig 1.99, 3.64 A or (resid 3 and name HG1*) (resid 12 and name HG*) ! 0.2237 1427:20 ----- 2.45, 4.63 A assign (resid 155 and name HB) (resid 144 and name HB*) 4.15 2.35 2.35 ! 0.0000 1428:20 Long 5.92, 6.26 A assign (resid 30 and name HG1*) (resid 25 and name HG*) 3.65 1.85 1.85 ! 0.9167 1429:20 Ambig 4.19, 6.31 A or (resid 33 and name HD1*) (resid 25 and name HG*) ! 0.0833 1429:20 ----- 6.25, 7.77 A assign (resid 36 and name HG2*) (resid 36 and name HB) 2.30 0.50 0.50 ! 0.4193 1430:20 Ambig 2.37, 2.63 A or (resid 36 and name HG1*) (resid 36 and name HB) ! 0.3817 1430:20 ----- 2.41, 2.63 A or (resid 75 and name HG2*) (resid 36 and name HB) ! 0.1967 1430:20 ----- 2.69, 4.96 A assign (resid 116 and name HG2*) (resid 117 and name HG1) 3.65 1.85 1.85 ! 0.0000 1431:20 Seq 5.28, 6.18 A assign (resid 41 and name HG1*) (resid 41 and name HB) 2.30 0.50 0.50 ! 0.5278 1433:20 Ambig 2.38, 2.63 A or (resid 41 and name HG2*) (resid 41 and name HB) ! 0.4632 1433:20 ----- 2.44, 2.65 A assign (resid 169 and name HG1*) (resid 169 and name HB) 2.65 0.85 0.85 ! 0.0000 1434:20 Intra 2.40, 2.64 A assign (resid 13 and name HG2*) (resid 13 and name HB) 2.65 0.85 0.85 ! 0.9833 1435:20 Intra 2.41, 2.64 A assign (resid 3 and name HG1*) (resid 3 and name HB) 2.30 0.50 0.50 ! 0.5123 1436:20 Ambig 2.37, 2.61 A or (resid 3 and name HG2*) (resid 3 and name HB) ! 0.4867 1436:20 ----- 2.39, 2.63 A assign (resid 178 and name HG2*) (resid 176 and name HB*) 2.30 0.50 0.50 ! 0.7525 1437:20 Ambig 2.36, 4.09 A or (resid 7 and name HG2*) (resid 176 and name HB*) ! 0.2178 1437:20 ----- 2.90, 5.33 A assign (resid 71 and name HG2) (resid 71 and name HB1) 2.65 0.85 0.85 ! 0.6283 1438:20 Ambig 2.27, 2.43 A or (resid 5 and name HG1) (resid 5 and name HB1) ! 0.3651 1438:20 ----- 2.49, 2.88 A assign (resid 5 and name HG1) (resid 5 and name HB2) 2.65 0.85 0.85 ! 0.9966 1439:20 Intra 2.26, 2.43 A assign (resid 178 and name HG2*) (resid 5 and name HB2) 3.15 1.35 1.35 ! 0.9455 1440:20 Long 2.86, 3.82 A assign (resid 178 and name HG2*) (resid 5 and name HB1) 3.15 1.35 1.35 ! 0.7917 1441:20 Ambig 4.01, 5.18 A or (resid 178 and name HG1*) (resid 5 and name HB1) ! 0.1182 1441:20 ----- 5.50, 7.35 A or (resid 7 and name HG2*) (resid 5 and name HB1) ! 0.0901 1441:20 ----- 5.76, 6.90 A assign (resid 35 and name HN) (resid 35 and name HB1) 4.15 2.35 2.35 ! 0.9334 1445:20 Intra 2.23, 2.55 A assign (resid 132 and name HE1) (resid 25 and name HB*) 3.15 1.35 1.35 ! 0.0000 1446:20 Long 3.77, 4.62 A assign (resid 117 and name HN) (resid 116 and name HB) 3.15 1.35 1.35 ! 0.0000 1447:20 Seq 2.39, 2.62 A assign (resid 105 and name HN) (resid 105 and name HB) 2.65 0.85 0.85 ! 0.0000 1448:20 Intra 2.36, 2.43 A assign (resid 40 and name HN) (resid 40 and name HG*) 3.15 1.35 1.35 ! 0.0000 1449:20 Intra 2.36, 3.19 A assign (resid 148 and name HN) (resid 148 and name HG2) 3.15 1.35 1.35 ! 0.8302 1451:20 Ambig 3.84, 4.08 A or (resid 153 and name HN) (resid 148 and name HG2) ! 0.1698 1451:20 ----- 5.00, 5.34 A assign (resid 24 and name HN) (resid 24 and name HG2) 3.15 1.35 1.35 ! 0.0000 1452:20 Intra 3.86, 4.05 A assign (resid 16 and name HN) (resid 1 and name HG2) 3.15 1.35 1.35 ! 0.5158 1453:20 Ambig 3.05, 4.32 A or (resid 2 and name HN) (resid 1 and name HG2) ! 0.4842 1453:20 ----- 3.08, 3.76 A assign (resid 146 and name HN) (resid 146 and name HB2) 2.65 0.85 0.85 ! 0.5304 1454:20 Ambig 2.18, 2.39 A or (resid 29 and name HN) (resid 28 and name HB2) ! 0.4696 1454:20 ----- 2.22, 2.46 A assign (resid 23 and name HN) (resid 22 and name HB2) 2.65 0.85 0.85 ! 0.8850 1455:20 Ambig 2.61, 2.98 A or (resid 32 and name HN) (resid 31 and name HB1) ! 0.1104 1455:20 ----- 3.70, 3.82 A assign (resid 148 and name HN) (resid 148 and name HG1) 2.65 0.85 0.85 ! 0.6177 1456:20 Ambig 2.58, 2.91 A or (resid 24 and name HN) (resid 24 and name HG1) ! 0.3802 1456:20 ----- 2.79, 3.04 A assign (resid 86 and name HN) (resid 86 and name HG2) 4.15 2.35 2.35 ! 0.0000 1457:20 Intra 2.71, 3.22 A assign (resid 134 and name HN) (resid 134 and name HB) 2.65 0.85 0.85 ! 0.0000 1458:20 Intra 2.41, 2.52 A assign (resid 116 and name HN) (resid 116 and name HB) 2.65 0.85 0.85 ! 0.9977 1459:20 Intra 2.55, 2.61 A assign (resid 101 and name HN) (resid 102 and name HB) 3.65 1.85 1.85 ! 0.0000 1460:20 Seq 4.78, 5.02 A assign (resid 16 and name HN) (resid 1 and name HG1) 3.15 1.35 1.35 ! 0.7011 1461:20 Ambig 2.70, 4.07 A or (resid 2 and name HN) (resid 1 and name HG1) ! 0.2989 1461:20 ----- 3.11, 3.91 A assign (resid 178 and name HN) (resid 178 and name HB) 2.65 0.85 0.85 ! 0.8811 1462:20 Ambig 2.52, 2.63 A or (resid 3 and name HN) (resid 178 and name HB) ! 0.0953 1462:20 ----- 3.65, 3.99 A assign (resid 180 and name HN) (resid 179 and name HB1) 3.65 1.85 1.85 ! 0.5919 1464:20 Ambig 3.53, 3.93 A or (resid 3 and name HN) (resid 179 and name HB1) ! 0.3442 1464:20 ----- 3.86, 5.09 A assign (resid 179 and name HN) (resid 179 and name HB1) 3.15 1.35 1.35 ! 0.0000 1465:20 Intra 2.99, 3.38 A assign (resid 75 and name HN) (resid 75 and name HB) 3.65 1.85 1.85 ! 0.8535 1466:20 Ambig 2.52, 2.60 A or (resid 25 and name HN) (resid 24 and name HB1) ! 0.1465 1466:20 ----- 3.38, 3.59 A assign (resid 146 and name HN) (resid 146 and name HB1) 2.65 0.85 0.85 ! 0.0000 1467:20 Intra 2.34, 2.59 A assign (resid 178 and name HN) (resid 177 and name HB) 3.65 1.85 1.85 ! 0.9178 1468:20 Ambig 4.12, 4.28 A or (resid 3 and name HN) (resid 177 and name HB) ! 0.0822 1468:20 ----- 6.17, 6.46 A assign (resid 120 and name HN) (resid 120 and name HB*) 2.30 0.50 0.50 ! 0.5387 1469:20 Ambig 2.43, 3.09 A or (resid 111 and name HN) (resid 110 and name HB*) ! 0.4613 1469:20 ----- 2.49, 3.67 A assign (resid 177 and name HN) (resid 177 and name HB) 2.65 0.85 0.85 ! 0.9903 1470:20 Intra 2.50, 2.57 A assign (resid 25 and name HN) (resid 25 and name HB*) 3.65 1.85 1.85 ! 0.0000 1471:20 Intra 2.46, 3.21 A assign (resid 95 and name HN) (resid 95 and name HB*) 2.65 0.85 0.85 ! 0.0000 1472:20 Intra 2.40, 3.07 A assign (resid 75 and name HN) (resid 19 and name HB2) 4.15 2.35 2.35 ! 0.0000 1473:20 Long 5.15, 5.95 A assign (resid 98 and name HN) (resid 98 and name HB) 2.65 0.85 0.85 ! 0.6758 1474:20 Ambig 2.49, 2.59 A or (resid 37 and name HN) (resid 19 and name HB1) ! 0.3231 1474:20 ----- 2.82, 3.74 A assign (resid 180 and name HN) (resid 179 and name HB2) 3.65 1.85 1.85 ! 0.9220 1475:20 Seq 3.00, 3.89 A assign (resid 179 and name HN) (resid 179 and name HB2) 3.15 1.35 1.35 ! 0.0000 1477:20 Intra 2.48, 3.15 A assign (resid 23 and name HN) (resid 22 and name HB1) 3.65 1.85 1.85 ! 0.9640 1478:20 Seq 3.38, 3.70 A assign (resid 23 and name HN) (resid 22 and name HB1) 3.65 1.85 1.85 ! 0.9640 1479:20 Seq 3.38, 3.70 A assign (resid 23 and name HN) (resid 23 and name HB) 3.15 1.35 1.35 ! 0.9953 1480:20 Intra 2.50, 2.56 A assign (resid 30 and name HN) (resid 30 and name HB) 3.15 1.35 1.35 ! 0.0000 1481:20 Intra 2.51, 2.60 A assign (resid 123 and name HN) (resid 123 and name HG1) 3.15 1.35 1.35 ! 0.9632 1482:20 Intra 2.51, 2.63 A assign (resid 106 and name HN) (resid 107 and name HG1) 3.15 1.35 1.35 ! 0.2997 1483:20 Ambig 4.09, 6.34 A or (resid 108 and name HN) (resid 107 and name HG2) ! 0.2258 1483:20 ----- 4.29, 5.22 A or (resid 108 and name HN) (resid 107 and name HG1) ! 0.1920 1483:20 ----- 4.41, 5.16 A or (resid 106 and name HN) (resid 107 and name HG2) ! 0.1919 1483:20 ----- 4.41, 6.31 A or (resid 110 and name HN) (resid 107 and name HG1) ! 0.0597 1483:20 ----- 5.35, 6.00 A assign (resid 107 and name HN) (resid 107 and name HG1) 3.15 1.35 1.35 ! 0.0000 1484:20 Intra 2.41, 3.84 A assign (resid 123 and name HN) (resid 123 and name HG2) 3.15 1.35 1.35 ! 0.8039 1485:20 Ambig 3.58, 3.74 A or (resid 124 and name HN) (resid 123 and name HG2) ! 0.0903 1485:20 ----- 5.16, 5.25 A or (resid 110 and name HN) (resid 123 and name HG2) ! 0.0689 1485:20 ----- 5.39, 6.42 A assign (resid 28 and name HN) (resid 28 and name HB2) 3.15 1.35 1.35 ! 0.0000 1486:20 Intra 3.65, 3.75 A assign (resid 88 and name HN) (resid 87 and name HB2) 3.15 1.35 1.35 ! 0.0000 1487:20 Seq 2.62, 2.96 A assign (resid 102 and name HN) (resid 102 and name HB) 2.65 0.85 0.85 ! 0.9904 1488:20 Intra 2.55, 2.58 A assign (resid 142 and name HN) (resid 141 and name HB*) 2.65 0.85 0.85 ! 0.0000 1490:20 Seq 2.18, 3.37 A assign (resid 125 and name HN) (resid 31 and name HB2) 3.15 1.35 1.35 ! 0.3886 1492:20 Ambig 4.59, 5.16 A or (resid 124 and name HN) (resid 121 and name HB*) ! 0.3342 1492:20 ----- 4.71, 5.11 A or (resid 125 and name HN) (resid 121 and name HB*) ! 0.2283 1492:20 ----- 5.02, 5.60 A assign (resid 110 and name HN) (resid 110 and name HB*) 2.65 0.85 0.85 ! 0.9921 1493:20 Intra 2.43, 3.11 A assign (resid 121 and name HN) (resid 121 and name HB*) 2.30 0.50 0.50 ! 0.0000 1494:20 Intra 2.31, 3.05 A assign (resid 121 and name HN) (resid 120 and name HB*) 2.30 0.50 0.50 ! 0.8147 1495:20 Ambig 2.25, 2.96 A or (resid 28 and name HN) (resid 28 and name HB1) ! 0.1853 1495:20 ----- 2.88, 3.06 A assign (resid 96 and name HN) (resid 95 and name HB*) 2.65 0.85 0.85 ! 0.6589 1496:20 Ambig 2.54, 3.21 A or (resid 88 and name HN) (resid 87 and name HB1) ! 0.3061 1496:20 ----- 2.89, 3.53 A assign (resid 74 and name HD21) (resid 40 and name HB1) 4.90 3.10 3.10 ! 0.0000 1499:20 Long 6.57, 7.15 A assign (resid 122 and name HD*) (resid 114 and name HB) 2.65 0.85 0.85 ! 0.8411 1500:20 Ambig 2.76, 5.22 A or (resid 74 and name HD21) (resid 19 and name HB1) ! 0.0819 1500:20 ----- 4.07, 5.49 A assign (resid 106 and name HN) (resid 105 and name HB) 2.65 0.85 0.85 ! 0.9643 1501:20 Seq 2.53, 2.78 A assign (resid 172 and name HN) (resid 172 and name HB1) 3.65 1.85 1.85 ! 0.0000 1503:20 Intra 2.35, 2.54 A assign (resid 136 and name HN) (resid 136 and name HB2) 3.15 1.35 1.35 ! 0.8780 1504:20 Ambig 2.30, 2.49 A or (resid 137 and name HN) (resid 136 and name HB2) ! 0.1220 1504:20 ----- 3.20, 3.64 A assign (resid 136 and name HN) (resid 136 and name HB1) 2.65 0.85 0.85 ! 0.8335 1505:20 Ambig 2.60, 3.46 A or (resid 137 and name HN) (resid 136 and name HB1) ! 0.1665 1505:20 ----- 3.40, 4.03 A assign (resid 103 and name HN) (resid 102 and name HB) 2.65 0.85 0.85 ! 0.9624 1506:20 Seq 2.59, 2.74 A assign (resid 143 and name HD*) (resid 141 and name HB*) 4.15 2.35 2.35 ! 0.0000 1507:20 Mid 3.53, 5.93 A assign (resid 15 and name HN) (resid 75 and name HB) 4.90 3.10 3.10 ! 0.0000 1508:20 Long 7.27, 7.76 A assign (resid 131 and name HN) (resid 131 and name HB2) 3.15 1.35 1.35 ! 0.0000 1509:20 Intra 2.10, 2.43 A assign (resid 100 and name HN) (resid 99 and name HB*) 2.30 0.50 0.50 ! 0.2676 1510:20 Ambig 2.22, 3.03 A or (resid 99 and name HN) (resid 99 and name HB*) ! 0.2659 1510:20 ----- 2.22, 2.94 A or (resid 131 and name HN) (resid 131 and name HB1) ! 0.1734 1510:20 ----- 2.39, 2.87 A or (resid 74 and name HD22) (resid 19 and name HB1) ! 0.1520 1510:20 ----- 2.44, 3.91 A or (resid 99 and name HN) (resid 98 and name HB) ! 0.1388 1510:20 ----- 2.48, 2.64 A assign (resid 131 and name HN) (resid 127 and name HB1) 4.15 2.35 2.35 ! 0.0000 1511:20 Mid 5.53, 5.72 A assign (resid 4 and name HE*) (resid 172 and name HB2) 4.15 2.35 2.35 ! 0.9619 1515:20 Long 4.12, 5.87 A assign (resid 164 and name HA) (resid 164 and name HB2) 2.65 0.85 0.85 ! 0.9445 1516:20 Intra 2.98, 3.02 A assign (resid 164 and name HA) (resid 164 and name HB1) 2.65 0.85 0.85 ! 0.0000 1517:20 Intra 2.42, 2.53 A assign (resid 24 and name HA) (resid 24 and name HG2) 3.65 1.85 1.85 ! 0.0000 1519:20 Intra 2.38, 2.58 A assign (resid 149 and name HA) (resid 150 and name HB1) 4.15 2.35 2.35 ! 0.6318 1522:20 Ambig 4.98, 5.11 A or (resid 151 and name HA) (resid 150 and name HB1) ! 0.3682 1522:20 ----- 5.45, 5.64 A assign (resid 24 and name HA) (resid 24 and name HG1) 3.65 1.85 1.85 ! 0.0000 1523:20 Intra 2.56, 3.00 A assign (resid 179 and name HA) (resid 179 and name HB1) 2.30 0.50 0.50 ! 0.6250 1524:20 Ambig 2.37, 2.43 A or (resid 2 and name HA) (resid 179 and name HB1) ! 0.3640 1524:20 ----- 2.59, 3.68 A assign (resid 24 and name HA) (resid 35 and name HB1) 4.90 3.10 3.10 ! 0.0000 1525:20 Long 6.14, 7.04 A assign (resid 24 and name HA) (resid 24 and name HB2) 3.65 1.85 1.85 ! 0.9870 1526:20 Intra 2.99, 3.02 A assign (resid 24 and name HA) (resid 24 and name HB1) 3.65 1.85 1.85 ! 0.0000 1527:20 Intra 2.48, 2.51 A assign (resid 179 and name HA) (resid 179 and name HB2) 2.65 0.85 0.85 ! 0.8048 1529:20 Ambig 2.39, 2.75 A or (resid 2 and name HA) (resid 179 and name HB2) ! 0.1766 1529:20 ----- 3.08, 4.40 A assign (resid 123 and name HA) (resid 123 and name HG1) 3.15 1.35 1.35 ! 0.8250 1530:20 Ambig 2.85, 3.00 A or (resid 120 and name HA) (resid 123 and name HG1) ! 0.1509 1530:20 ----- 3.78, 4.06 A assign (resid 187 and name HA) (resid 187 and name HB1) 2.65 0.85 0.85 ! 0.9611 1531:20 Intra 2.48, 2.83 A assign (resid 104 and name HA) (resid 107 and name HG2) 3.15 1.35 1.35 ! 0.8883 1532:20 Ambig 2.24, 4.00 A or (resid 104 and name HA) (resid 107 and name HG1) ! 0.1117 1532:20 ----- 3.16, 4.87 A assign (resid 107 and name HA) (resid 107 and name HG1) 2.65 0.85 0.85 ! 0.6576 1533:20 Ambig 2.40, 2.65 A or (resid 107 and name HA) (resid 107 and name HG2) ! 0.3424 1533:20 ----- 2.68, 3.58 A assign (resid 148 and name HA) (resid 148 and name HG2) 3.15 1.35 1.35 ! 0.9980 1536:20 Intra 2.39, 2.49 A assign (resid 123 and name HA) (resid 123 and name HG2) 2.65 0.85 0.85 ! 0.9696 1538:20 Intra 2.42, 2.48 A assign (resid 1 and name HA) (resid 1 and name HG2) 3.15 1.35 1.35 ! 0.9795 1539:20 Intra 3.10, 3.34 A assign (resid 70 and name HA) (resid 70 and name HG*) 2.65 0.85 0.85 ! 0.7358 1541:20 Ambig 2.50, 3.09 A or (resid 68 and name HA) (resid 70 and name HG*) ! 0.2642 1541:20 ----- 2.97, 6.75 A assign (resid 146 and name HA) (resid 146 and name HB2) 2.65 0.85 0.85 ! 0.9244 1542:20 Intra 2.39, 2.50 A assign (resid 31 and name HA) (resid 31 and name HB1) 2.30 0.50 0.50 ! 0.9864 1544:20 Intra 2.25, 2.28 A assign (resid 150 and name HA) (resid 150 and name HB2) 2.65 0.85 0.85 ! 0.7316 1545:20 Ambig 2.71, 2.74 A or (resid 147 and name HB*) (resid 148 and name HG1) ! 0.1684 1545:20 ----- 3.46, 4.74 A or (resid 21 and name HB) (resid 24 and name HG1) ! 0.0912 1545:20 ----- 3.83, 5.07 A assign (resid 150 and name HA) (resid 150 and name HB1) 2.65 0.85 0.85 ! 0.0000 1546:20 Intra 2.27, 2.30 A assign (resid 150 and name HA) (resid 86 and name HG2) 4.15 2.35 2.35 ! 0.0000 1548:20 Long 5.12, 6.14 A assign (resid 78 and name HA) (resid 78 and name HB1) 2.65 0.85 0.85 ! 0.9802 1549:20 Intra 2.29, 2.31 A assign (resid 148 and name HA) (resid 148 and name HG1) 2.65 0.85 0.85 ! 0.0000 1550:20 Intra 2.66, 2.78 A assign (resid 7 and name HA) (resid 7 and name HB) 2.65 0.85 0.85 ! 0.9836 1551:20 Intra 3.03, 3.04 A assign (resid 178 and name HA) (resid 179 and name HB1) 4.15 2.35 2.35 ! 0.7917 1553:20 Ambig 4.51, 5.12 A or (resid 1 and name HA) (resid 179 and name HB1) ! 0.2083 1553:20 ----- 5.63, 6.59 A assign (resid 146 and name HA) (resid 146 and name HB1) 2.65 0.85 0.85 ! 0.9236 1555:20 Intra 2.48, 2.99 A assign (resid 31 and name HA) (resid 31 and name HB2) 2.65 0.85 0.85 ! 0.9384 1556:20 Intra 2.67, 2.71 A assign (resid 128 and name HA) (resid 131 and name HB2) 2.30 0.50 0.50 ! 0.5071 1557:20 Ambig 2.35, 3.11 A or (resid 121 and name HA) (resid 121 and name HB*) ! 0.4758 1557:20 ----- 2.37, 2.75 A assign (resid 110 and name HA) (resid 110 and name HB*) 2.30 0.50 0.50 ! 0.3349 1558:20 Ambig 2.38, 2.60 A or (resid 120 and name HA) (resid 120 and name HB*) ! 0.2968 1558:20 ----- 2.43, 2.75 A or (resid 117 and name HA) (resid 120 and name HB*) ! 0.2774 1558:20 ----- 2.46, 3.85 A or (resid 107 and name HA) (resid 110 and name HB*) ! 0.0792 1558:20 ----- 3.03, 4.43 A assign (resid 96 and name HA) (resid 95 and name HB*) 3.15 1.35 1.35 ! 0.8406 1561:20 Ambig 4.31, 4.51 A or (resid 113 and name HA1) (resid 114 and name HB) ! 0.1594 1561:20 ----- 5.68, 5.90 A assign (resid 178 and name HA) (resid 179 and name HB2) 4.15 2.35 2.35 ! 0.7174 1562:20 Ambig 4.54, 5.14 A or (resid 1 and name HA) (resid 179 and name HB2) ! 0.2826 1562:20 ----- 5.30, 7.01 A assign (resid 172 and name HA) (resid 172 and name HB1) 3.65 1.85 1.85 ! 0.8112 1563:20 Ambig 2.99, 3.00 A or (resid 32 and name HA1) (resid 172 and name HB1) ! 0.1888 1563:20 ----- 3.81, 4.20 A assign (resid 136 and name HA) (resid 136 and name HB2) 2.65 0.85 0.85 ! 0.9642 1564:20 Intra 2.55, 2.93 A assign (resid 22 and name HA) (resid 22 and name HB1) 2.65 0.85 0.85 ! 0.0000 1566:20 Intra 2.29, 2.32 A assign (resid 136 and name HA) (resid 136 and name HB1) 2.65 0.85 0.85 ! 0.9911 1567:20 Intra 2.43, 2.61 A assign (resid 122 and name HB2) (resid 123 and name HG1) 3.65 1.85 1.85 ! 0.8721 1570:20 Ambig 4.72, 4.85 A or (resid 127 and name HD1) (resid 123 and name HG1) ! 0.1279 1570:20 ----- 6.50, 7.15 A assign (resid 31 and name HD1) (resid 31 and name HB1) 3.15 1.35 1.35 ! 0.8689 1571:20 Ambig 2.81, 2.97 A or (resid 22 and name HD*) (resid 22 and name HB2) ! 0.1279 1571:20 ----- 3.87, 3.98 A assign (resid 31 and name HD1) (resid 31 and name HB1) 3.15 1.35 1.35 ! 0.7665 1572:20 Ambig 2.81, 2.97 A or (resid 22 and name HD*) (resid 24 and name HG1) ! 0.1228 1572:20 ----- 3.82, 5.10 A or (resid 9 and name HB2) (resid 148 and name HG1) ! 0.0946 1572:20 ----- 3.99, 4.54 A assign (resid 78 and name HD*) (resid 78 and name HB1) 2.65 0.85 0.85 ! 0.2083 1573:20 Ambig 3.80, 3.97 A or (resid 22 and name HD*) (resid 24 and name HG1) ! 0.2029 1573:20 ----- 3.82, 5.10 A or (resid 150 and name HD1) (resid 150 and name HB2) ! 0.1923 1573:20 ----- 3.85, 3.92 A or (resid 150 and name HD2) (resid 150 and name HB2) ! 0.1696 1573:20 ----- 3.93, 4.04 A or (resid 9 and name HB2) (resid 148 and name HG1) ! 0.1563 1573:20 ----- 3.99, 4.54 A assign (resid 87 and name HD1) (resid 87 and name HB2) 3.65 1.85 1.85 ! 0.8907 1574:20 Ambig 3.86, 3.96 A or (resid 137 and name HB1) (resid 134 and name HB) ! 0.1093 1574:20 ----- 5.47, 5.83 A assign (resid 116 and name HA) (resid 116 and name HB) 2.65 0.85 0.85 ! 0.9957 1575:20 Intra 3.02, 3.03 A assign (resid 145 and name HB*) (resid 148 and name HG1) 3.15 1.35 1.35 ! 0.6544 1576:20 Ambig 3.58, 4.29 A or (resid 23 and name HA) (resid 24 and name HG1) ! 0.3025 1576:20 ----- 4.07, 4.27 A assign (resid 102 and name HA) (resid 102 and name HB) 3.15 1.35 1.35 ! 0.8390 1577:20 Ambig 3.04, 3.04 A or (resid 87 and name HD1) (resid 86 and name HG2) ! 0.0827 1577:20 ----- 4.47, 5.10 A assign (resid 27 and name HA2) (resid 24 and name HB2) 3.65 1.85 1.85 ! 0.6161 1578:20 Ambig 4.50, 5.92 A or (resid 162 and name HA1) (resid 160 and name HB*) ! 0.2471 1578:20 ----- 5.25, 6.49 A or (resid 22 and name HD*) (resid 24 and name HB2) ! 0.1368 1578:20 ----- 5.79, 6.98 A assign (resid 157 and name HB2) (resid 141 and name HB*) 3.65 1.85 1.85 ! 0.0000 1579:20 Long 2.63, 4.64 A assign (resid 95 and name HA) (resid 95 and name HB*) 2.30 0.50 0.50 ! 0.7432 1580:20 Ambig 2.44, 2.75 A or (resid 87 and name HD1) (resid 87 and name HB1) ! 0.2568 1580:20 ----- 2.91, 3.33 A assign (resid 131 and name HE*) (resid 131 and name HB1) 3.15 1.35 1.35 ! 0.5400 1581:20 Ambig 2.06, 3.76 A or (resid 99 and name HE*) (resid 99 and name HB*) ! 0.4523 1581:20 ----- 2.12, 4.18 A assign (resid 87 and name HD2) (resid 86 and name HG1) 3.15 1.35 1.35 ! 0.3652 1582:20 Ambig 4.54, 5.12 A or (resid 82 and name HA) (resid 78 and name HB2) ! 0.3234 1582:20 ----- 4.63, 5.03 A or (resid 150 and name HD1) (resid 86 and name HG1) ! 0.3114 1582:20 ----- 4.66, 5.60 A assign (resid 98 and name HA) (resid 98 and name HB) 2.65 0.85 0.85 ! 0.9057 1583:20 Ambig 3.04, 3.05 A or (resid 97 and name HB*) (resid 98 and name HB) ! 0.0581 1583:20 ----- 4.81, 5.73 A assign (resid 133 and name HA) (resid 136 and name HB2) 3.65 1.85 1.85 ! 0.9111 1584:20 Ambig 2.79, 3.40 A or (resid 137 and name HA) (resid 136 and name HB2) ! 0.0889 1584:20 ----- 4.11, 4.69 A assign (resid 22 and name HD*) (resid 22 and name HB1) 3.15 1.35 1.35 ! 0.0000 1585:20 Intra 2.90, 3.44 A assign (resid 23 and name HA) (resid 23 and name HB) 4.15 2.35 2.35 ! 0.9847 1586:20 Intra 3.01, 3.03 A assign (resid 166 and name HA) (resid 166 and name HB2) 3.15 1.35 1.35 ! 0.0000 1587:20 Intra 2.68, 2.86 A assign (resid 166 and name HA) (resid 166 and name HB1) 3.65 1.85 1.85 ! 0.0000 1589:20 Intra 2.26, 2.29 A assign (resid 123 and name HB1) (resid 123 and name HG1) 2.65 0.85 0.85 ! 0.9938 1591:20 Intra 3.01, 3.01 A assign (resid 148 and name HB1) (resid 148 and name HG2) 2.30 0.50 0.50 ! 0.9985 1593:20 Intra 2.37, 2.39 A assign (resid 1 and name HB1) (resid 1 and name HG2) 2.65 0.85 0.85 ! 0.5130 1594:20 Ambig 2.40, 2.59 A or (resid 1 and name HB2) (resid 1 and name HG2) ! 0.4870 1594:20 ----- 2.42, 2.82 A assign (resid 78 and name HG1) (resid 78 and name HB1) 2.30 0.50 0.50 ! 0.4602 1596:20 Ambig 2.31, 2.34 A or (resid 78 and name HG2) (resid 78 and name HB1) ! 0.2239 1596:20 ----- 2.61, 2.65 A or (resid 150 and name HG1) (resid 150 and name HB2) ! 0.2092 1596:20 ----- 2.64, 2.67 A or (resid 148 and name HB1) (resid 148 and name HG1) ! 0.0986 1596:20 ----- 2.99, 3.00 A assign (resid 1 and name HB2) (resid 1 and name HG1) 2.30 0.50 0.50 ! 0.5665 1597:20 Ambig 2.32, 2.48 A or (resid 1 and name HB1) (resid 1 and name HG1) ! 0.4335 1597:20 ----- 2.43, 2.83 A assign (resid 24 and name HG2) (resid 24 and name HB2) 3.65 1.85 1.85 ! 0.9886 1599:20 Intra 2.50, 2.98 A assign (resid 24 and name HG2) (resid 24 and name HB1) 3.15 1.35 1.35 ! 0.9919 1600:20 Intra 2.36, 2.44 A assign (resid 118 and name HB1) (resid 114 and name HB) 3.15 1.35 1.35 ! 0.8277 1601:20 Ambig 3.78, 4.27 A or (resid 168 and name HB2) (resid 14 and name HB) ! 0.1723 1601:20 ----- 4.91, 5.45 A assign (resid 40 and name HG*) (resid 40 and name HB2) 3.65 1.85 1.85 ! 0.0000 1602:20 Intra 2.40, 2.72 A assign (resid 40 and name HG*) (resid 40 and name HB2) 3.65 1.85 1.85 ! 0.0000 1606:20 Intra 2.40, 2.72 A assign (resid 169 and name HB) (resid 136 and name HB1) 4.15 2.35 2.35 ! 0.0000 1607:20 Long 5.37, 6.03 A assign (resid 123 and name HB2) (resid 123 and name HG1) 2.65 0.85 0.85 ! 0.9615 1609:20 Intra 2.37, 2.43 A assign (resid 40 and name HB1) (resid 40 and name HG*) 2.30 0.50 0.50 ! 0.7380 1611:20 Ambig 2.37, 2.71 A or (resid 123 and name HB2) (resid 123 and name HG2) ! 0.1775 1611:20 ----- 3.00, 3.01 A or (resid 109 and name HG) (resid 123 and name HG2) ! 0.0691 1611:20 ----- 3.52, 5.00 A assign (resid 40 and name HB2) (resid 40 and name HG*) 2.65 0.85 0.85 ! 0.8903 1612:20 Ambig 2.40, 2.72 A or (resid 71 and name HB2) (resid 40 and name HG*) ! 0.0420 1612:20 ----- 3.98, 5.30 A assign (resid 152 and name HB*) (resid 148 and name HG2) 3.65 1.85 1.85 ! 0.0000 1613:20 Mid 5.00, 6.07 A assign (resid 3 and name HB) (resid 1 and name HG2) 2.30 0.50 0.50 ! 0.5253 1614:20 Ambig 2.23, 2.99 A or (resid 24 and name HB2) (resid 24 and name HG2) ! 0.2681 1614:20 ----- 2.50, 2.98 A or (resid 29 and name HB*) (resid 24 and name HG2) ! 0.2051 1614:20 ----- 2.61, 3.87 A assign (resid 13 and name HG1*) (resid 13 and name HB) 2.65 0.85 0.85 ! 0.0000 1615:20 Intra 2.31, 2.61 A assign (resid 146 and name HG*) (resid 146 and name HB2) 3.15 1.35 1.35 ! 0.0000 1616:20 Intra 2.29, 2.65 A assign (resid 82 and name HB*) (resid 146 and name HB2) 3.15 1.35 1.35 ! 0.0000 1617:20 Long 2.06, 3.55 A assign (resid 82 and name HB*) (resid 78 and name HB1) 3.15 1.35 1.35 ! 0.0000 1621:20 Mid 3.18, 4.60 A assign (resid 86 and name HB1) (resid 86 and name HG2) 2.65 0.85 0.85 ! 0.8928 1622:20 Ambig 2.49, 2.98 A or (resid 103 and name HG1) (resid 102 and name HB) ! 0.1072 1622:20 ----- 3.55, 4.76 A assign (resid 179 and name HG2) (resid 179 and name HB1) 2.30 0.50 0.50 ! 0.6060 1624:20 Ambig 2.31, 2.49 A or (resid 179 and name HG1) (resid 179 and name HB1) ! 0.3940 1624:20 ----- 2.48, 2.89 A assign (resid 71 and name HD*) (resid 40 and name HB1) 2.30 0.50 0.50 ! 0.3793 1625:20 Ambig 2.29, 4.88 A or (resid 86 and name HB1) (resid 86 and name HG1) ! 0.3034 1625:20 ----- 2.38, 2.48 A or (resid 121 and name HG2) (resid 121 and name HB*) ! 0.2731 1625:20 ----- 2.42, 2.75 A assign (resid 121 and name HG2) (resid 120 and name HB*) 2.65 0.85 0.85 ! 0.9896 1626:20 Seq 3.05, 3.91 A assign (resid 99 and name HG2) (resid 99 and name HB*) 2.30 0.50 0.50 ! 0.9044 1627:20 Ambig 2.32, 2.66 A or (resid 128 and name HG2*) (resid 131 and name HB1) ! 0.0942 1627:20 ----- 3.39, 5.10 A assign (resid 179 and name HG1) (resid 179 and name HB2) 2.65 0.85 0.85 ! 0.5622 1629:20 Ambig 2.36, 2.52 A or (resid 179 and name HG2) (resid 179 and name HB2) ! 0.4331 1629:20 ----- 2.47, 2.89 A assign (resid 22 and name HG1) (resid 22 and name HB1) 2.30 0.50 0.50 ! 0.8205 1630:20 Ambig 2.30, 2.32 A or (resid 22 and name HG2) (resid 22 and name HB1) ! 0.1734 1630:20 ----- 2.98, 2.99 A assign (resid 166 and name HG2) (resid 166 and name HB2) 3.65 1.85 1.85 ! 0.0000 1632:20 Intra 2.31, 2.33 A assign (resid 166 and name HG2) (resid 166 and name HB1) 3.65 1.85 1.85 ! 0.0000 1634:20 Intra 2.63, 2.84 A assign (resid 3 and name HG1*) (resid 1 and name HG2) 3.15 1.35 1.35 ! 0.7676 1635:20 Ambig 3.29, 4.80 A or (resid 3 and name HG2*) (resid 1 and name HG2) ! 0.1902 1635:20 ----- 4.15, 5.25 A assign (resid 134 and name HG2*) (resid 134 and name HB) 2.30 0.50 0.50 ! 0.5027 1639:20 Ambig 2.41, 2.63 A or (resid 116 and name HG1*) (resid 116 and name HB) ! 0.4959 1639:20 ----- 2.42, 2.64 A assign (resid 7 and name HG2*) (resid 7 and name HB) 2.30 0.50 0.50 ! 0.5078 1640:20 Ambig 2.41, 2.63 A or (resid 7 and name HG1*) (resid 7 and name HB) ! 0.4891 1640:20 ----- 2.43, 2.64 A assign (resid 154 and name HD1*) (resid 86 and name HG1) 3.65 1.85 1.85 ! 0.0000 1641:20 Long 2.29, 4.00 A assign (resid 3 and name HG1*) (resid 1 and name HG1) 3.65 1.85 1.85 ! 0.5168 1642:20 Ambig 4.03, 6.02 A or (resid 3 and name HG2*) (resid 1 and name HG1) ! 0.3804 1642:20 ----- 4.24, 5.91 A or (resid 2 and name HG12) (resid 1 and name HG1) ! 0.1028 1642:20 ----- 5.28, 6.41 A assign (resid 178 and name HG2*) (resid 178 and name HB) 2.30 0.50 0.50 ! 0.5062 1643:20 Ambig 2.40, 2.64 A or (resid 178 and name HG1*) (resid 178 and name HB) ! 0.4938 1643:20 ----- 2.41, 2.63 A assign (resid 75 and name HG2*) (resid 75 and name HB) 2.65 0.85 0.85 ! 0.9260 1644:20 Intra 2.36, 2.64 A assign (resid 177 and name HG2*) (resid 177 and name HB) 2.65 0.85 0.85 ! 0.9900 1646:20 Intra 2.42, 2.64 A assign (resid 177 and name HG1*) (resid 177 and name HB) 2.65 0.85 0.85 ! 0.9851 1647:20 Intra 2.40, 2.63 A assign (resid 30 and name HG1*) (resid 25 and name HB*) 3.15 1.35 1.35 ! 0.5803 1648:20 Ambig 4.81, 6.60 A or (resid 30 and name HG1*) (resid 31 and name HB2) ! 0.2934 1648:20 ----- 5.39, 6.39 A or (resid 33 and name HD1*) (resid 31 and name HB2) ! 0.1263 1648:20 ----- 6.20, 7.43 A assign (resid 114 and name HG1*) (resid 114 and name HB) 2.30 0.50 0.50 ! 0.4604 1649:20 Ambig 2.40, 2.63 A or (resid 98 and name HG2*) (resid 98 and name HB) ! 0.4349 1649:20 ----- 2.42, 2.63 A or (resid 21 and name HG2*) (resid 19 and name HB1) ! 0.0896 1649:20 ----- 3.15, 5.07 A assign (resid 14 and name HG2*) (resid 14 and name HB) 2.30 0.50 0.50 ! 0.5258 1650:20 Ambig 2.37, 2.63 A or (resid 98 and name HG1*) (resid 98 and name HB) ! 0.4742 1650:20 ----- 2.41, 2.64 A assign (resid 2 and name HG12) (resid 179 and name HB2) 4.15 2.35 2.35 ! 0.4977 1651:20 Ambig 4.27, 5.14 A or (resid 171 and name HG1*) (resid 172 and name HB1) ! 0.3633 1651:20 ----- 4.50, 5.45 A or (resid 3 and name HG1*) (resid 179 and name HB2) ! 0.1390 1651:20 ----- 5.28, 7.49 A assign (resid 136 and name HG2) (resid 136 and name HB2) 3.15 1.35 1.35 ! 0.0000 1656:20 Intra 2.39, 2.46 A assign (resid 140 and name HD1*) (resid 136 and name HB2) 2.30 0.50 0.50 ! 0.3933 1657:20 Ambig 2.18, 4.37 A or (resid 136 and name HG1) (resid 136 and name HB2) ! 0.2725 1657:20 ----- 2.32, 2.64 A or (resid 136 and name HD*) (resid 136 and name HB2) ! 0.1671 1657:20 ----- 2.51, 3.48 A or (resid 140 and name HD2*) (resid 136 and name HB2) ! 0.1655 1657:20 ----- 2.52, 4.24 A assign (resid 30 and name HG2*) (resid 30 and name HB) 2.30 0.50 0.50 ! 0.9948 1658:20 Intra 2.43, 2.64 A assign (resid 30 and name HG1*) (resid 30 and name HB) 2.30 0.50 0.50 ! 0.6387 1659:20 Ambig 2.40, 2.62 A or (resid 33 and name HD1*) (resid 30 and name HB) ! 0.3613 1659:20 ----- 2.64, 4.17 A assign (resid 140 and name HD2*) (resid 136 and name HB1) 2.65 0.85 0.85 ! 0.3551 1660:20 Ambig 2.26, 3.49 A or (resid 136 and name HG1) (resid 136 and name HB1) ! 0.2462 1660:20 ----- 2.40, 2.45 A or (resid 136 and name HD*) (resid 136 and name HB1) ! 0.2101 1660:20 ----- 2.46, 3.22 A or (resid 140 and name HD1*) (resid 136 and name HB1) ! 0.1857 1660:20 ----- 2.51, 4.37 A assign (resid 154 and name HD2*) (resid 86 and name HG2) 4.15 2.35 2.35 ! 0.0000 1662:20 Long 5.72, 7.52 A assign (resid 14 and name HG1*) (resid 14 and name HB) 2.65 0.85 0.85 ! 0.0000 1663:20 Intra 2.37, 2.60 A assign (resid 105 and name HG2*) (resid 105 and name HB) 2.65 0.85 0.85 ! 0.0000 1664:20 Intra 2.42, 2.63 A assign (resid 23 and name HG1*) (resid 30 and name HB) 2.65 0.85 0.85 ! 0.5166 1665:20 Ambig 2.33, 3.35 A or (resid 23 and name HG1*) (resid 23 and name HB) ! 0.4834 1665:20 ----- 2.36, 2.63 A assign (resid 132 and name HE1) (resid 136 and name HD*) 4.15 2.35 2.35 ! 0.0000 1667:20 Mid 3.09, 4.62 A assign (resid 12 and name HN) (resid 12 and name HB2) 4.15 2.35 2.35 ! 0.9880 1670:20 Intra 2.38, 2.52 A assign (resid 117 and name HN) (resid 117 and name HB*) 3.15 1.35 1.35 ! 0.0000 1671:20 Intra 2.43, 3.11 A assign (resid 8 and name HN) (resid 8 and name HG11) 3.65 1.85 1.85 ! 0.9581 1672:20 Intra 3.53, 3.61 A assign (resid 98 and name HN) (resid 97 and name HB*) 4.15 2.35 2.35 ! 0.0000 1673:20 Seq 2.39, 3.20 A assign (resid 171 and name HN) (resid 171 and name HB) 3.65 1.85 1.85 ! 0.0000 1674:20 Intra 2.51, 2.55 A assign (resid 148 and name HN) (resid 148 and name HB2) 4.15 2.35 2.35 ! 0.9534 1675:20 Intra 2.37, 2.44 A assign (resid 130 and name HN) (resid 127 and name HB1) 4.15 2.35 2.35 ! 0.0000 1676:20 Mid 5.65, 5.75 A assign (resid 29 and name HN) (resid 29 and name HB*) 2.65 0.85 0.85 ! 0.0000 1677:20 Intra 2.63, 3.22 A assign (resid 104 and name HN) (resid 103 and name HB2) 3.15 1.35 1.35 ! 0.0000 1678:20 Seq 2.28, 2.98 A assign (resid 104 and name HN) (resid 103 and name HB1) 2.65 0.85 0.85 ! 0.5716 1679:20 Ambig 2.14, 2.92 A or (resid 161 and name HN) (resid 161 and name HB*) ! 0.4284 1679:20 ----- 2.24, 2.96 A assign (resid 72 and name HN) (resid 71 and name HD*) 4.15 2.35 2.35 ! 0.0000 1681:20 Seq 4.34, 5.61 A assign (resid 71 and name HN) (resid 71 and name HD*) 3.65 1.85 1.85 ! 0.9360 1682:20 Intra 2.09, 3.85 A assign (resid 97 and name HN) (resid 97 and name HB*) 3.15 1.35 1.35 ! 0.0000 1683:20 Intra 2.43, 2.53 A assign (resid 132 and name HN) (resid 132 and name HB2) 3.15 1.35 1.35 ! 0.0000 1684:20 Intra 2.44, 2.54 A assign (resid 132 and name HN) (resid 132 and name HB1) 3.65 1.85 1.85 ! 0.0000 1685:20 Intra 2.43, 2.51 A assign (resid 132 and name HN) (resid 132 and name HB2) 3.65 1.85 1.85 ! 0.0000 1686:20 Intra 2.44, 2.54 A assign (resid 125 and name HN) (resid 125 and name HB1) 3.15 1.35 1.35 ! 0.9231 1687:20 Intra 3.50, 3.57 A assign (resid 93 and name HN) (resid 93 and name HB2) 3.15 1.35 1.35 ! 0.0000 1688:20 Intra 2.23, 2.71 A assign (resid 94 and name HN) (resid 93 and name HB2) 3.15 1.35 1.35 ! 0.9594 1689:20 Seq 2.19, 3.27 A assign (resid 128 and name HN) (resid 127 and name HB2) 2.65 0.85 0.85 ! 0.9234 1690:20 Seq 3.30, 3.43 A assign (resid 125 and name HN) (resid 124 and name HB2) 2.65 0.85 0.85 ! 0.5028 1691:20 Ambig 2.35, 2.73 A or (resid 124 and name HN) (resid 124 and name HB2) ! 0.4883 1691:20 ----- 2.36, 2.45 A assign (resid 125 and name HN) (resid 125 and name HB2) 2.65 0.85 0.85 ! 0.9767 1692:20 Intra 2.30, 2.46 A assign (resid 93 and name HN) (resid 93 and name HB1) 3.15 1.35 1.35 ! 0.0000 1694:20 Intra 2.32, 3.05 A assign (resid 94 and name HN) (resid 93 and name HB1) 3.15 1.35 1.35 ! 0.9979 1695:20 Seq 2.27, 3.42 A assign (resid 71 and name HN) (resid 70 and name HB1) 2.65 0.85 0.85 ! 0.9219 1696:20 Seq 2.11, 3.29 A assign (resid 128 and name HN) (resid 124 and name HB1) 4.90 3.10 3.10 ! 0.0000 1697:20 Mid 5.88, 6.15 A assign (resid 108 and name HN) (resid 107 and name HB1) 3.15 1.35 1.35 ! 0.8940 1698:20 Ambig 3.39, 3.69 A or (resid 110 and name HN) (resid 107 and name HB1) ! 0.0714 1698:20 ----- 5.17, 5.45 A assign (resid 107 and name HN) (resid 107 and name HB1) 3.15 1.35 1.35 ! 0.0000 1699:20 Intra 3.52, 3.63 A assign (resid 107 and name HN) (resid 107 and name HB2) 2.65 0.85 0.85 ! 0.0000 1700:20 Intra 2.24, 2.42 A assign (resid 43 and name HN) (resid 70 and name HB2) 3.15 1.35 1.35 ! 0.4715 1701:20 Ambig 3.11, 3.74 A or (resid 71 and name HN) (resid 70 and name HB2) ! 0.4588 1701:20 ----- 3.13, 4.13 A assign (resid 172 and name HN) (resid 172 and name HD*) 3.65 1.85 1.85 ! 0.0000 1702:20 Intra 4.61, 5.37 A assign (resid 119 and name HN) (resid 119 and name HG12) 3.15 1.35 1.35 ! 0.0000 1703:20 Intra 2.23, 2.39 A assign (resid 121 and name HN) (resid 121 and name HD*) 3.15 1.35 1.35 ! 0.0000 1704:20 Intra 3.11, 4.30 A assign (resid 126 and name HN) (resid 127 and name HG2) 4.15 2.35 2.35 ! 0.6278 1705:20 Ambig 4.59, 4.79 A or (resid 129 and name HN) (resid 127 and name HG2) ! 0.3722 1705:20 ----- 5.01, 5.11 A assign (resid 118 and name HN) (resid 117 and name HB*) 3.15 1.35 1.35 ! 0.0000 1706:20 Seq 2.35, 3.21 A assign (resid 107 and name HE22) (resid 106 and name HG*) 3.15 1.35 1.35 ! 0.7345 1707:20 Ambig 2.05, 4.91 A or (resid 18 and name HN) (resid 18 and name HG) ! 0.2655 1707:20 ----- 2.43, 2.64 A assign (resid 119 and name HN) (resid 119 and name HG11) 3.65 1.85 1.85 ! 0.0000 1708:20 Intra 2.38, 3.68 A assign (resid 136 and name HN) (resid 136 and name HD*) 3.15 1.35 1.35 ! 0.9668 1709:20 Intra 2.66, 4.27 A assign (resid 132 and name HD1) (resid 132 and name HB2) 4.15 2.35 2.35 ! 0.9772 1712:20 Intra 2.71, 2.86 A assign (resid 132 and name HD1) (resid 132 and name HB1) 3.65 1.85 1.85 ! 0.8182 1713:20 Ambig 3.84, 3.89 A or (resid 131 and name HN) (resid 132 and name HB1) ! 0.1818 1713:20 ----- 4.93, 5.14 A assign (resid 129 and name HD*) (resid 125 and name HB2) 4.15 2.35 2.35 ! 0.6966 1717:20 Ambig 4.83, 5.69 A or (resid 128 and name HN) (resid 125 and name HB2) ! 0.3034 1717:20 ----- 5.54, 5.69 A assign (resid 103 and name HN) (resid 103 and name HB1) 3.15 1.35 1.35 ! 0.7907 1718:20 Ambig 2.39, 3.17 A or (resid 107 and name HE21) (resid 103 and name HB1) ! 0.2093 1718:20 ----- 2.99, 5.61 A assign (resid 103 and name HN) (resid 103 and name HB2) 3.15 1.35 1.35 ! 0.9862 1719:20 Intra 2.20, 2.44 A assign (resid 132 and name HZ2) (resid 136 and name HD*) 3.65 1.85 1.85 ! 0.0000 1721:20 Mid 3.63, 5.14 A assign (resid 132 and name HH2) (resid 136 and name HD*) 4.15 2.35 2.35 ! 0.0000 1723:20 Mid 4.62, 6.58 A assign (resid 165 and name HA) (resid 165 and name HB1) 2.65 0.85 0.85 ! 0.9567 1724:20 Intra 2.42, 2.48 A assign (resid 165 and name HA) (resid 165 and name HB2) 2.65 0.85 0.85 ! 0.8986 1726:20 Ambig 2.56, 3.01 A or (resid 73 and name HA) (resid 165 and name HB2) ! 0.0809 1726:20 ----- 3.82, 4.70 A assign (resid 29 and name HA) (resid 29 and name HB*) 2.30 0.50 0.50 ! 0.9758 1727:20 Intra 2.36, 2.46 A assign (resid 71 and name HA) (resid 71 and name HD*) 3.65 1.85 1.85 ! 0.0000 1728:20 Intra 2.32, 3.95 A assign (resid 132 and name HA) (resid 132 and name HB2) 2.65 0.85 0.85 ! 0.5026 1730:20 Ambig 2.42, 2.47 A or (resid 97 and name HA) (resid 97 and name HB*) ! 0.4805 1730:20 ----- 2.44, 2.75 A assign (resid 132 and name HA) (resid 132 and name HB2) 3.15 1.35 1.35 ! 0.9728 1731:20 Intra 2.42, 2.47 A assign (resid 132 and name HA) (resid 132 and name HB1) 3.65 1.85 1.85 ! 0.9472 1732:20 Intra 3.01, 3.02 A assign (resid 93 and name HA) (resid 93 and name HB2) 2.65 0.85 0.85 ! 0.5207 1736:20 Ambig 2.37, 2.74 A or (resid 125 and name HA) (resid 125 and name HB1) ! 0.4739 1736:20 ----- 2.41, 2.48 A assign (resid 1 and name HA) (resid 1 and name HG1) 3.15 1.35 1.35 ! 0.9688 1738:20 Intra 2.57, 3.09 A assign (resid 123 and name HA) (resid 123 and name HB1) 2.30 0.50 0.50 ! 0.6093 1739:20 Ambig 2.50, 2.53 A or (resid 127 and name HA) (resid 127 and name HB2) ! 0.3643 1739:20 ----- 2.72, 2.74 A assign (resid 93 and name HA) (resid 93 and name HB1) 2.30 0.50 0.50 ! 0.5411 1741:20 Ambig 2.29, 2.62 A or (resid 121 and name HA) (resid 124 and name HB2) ! 0.3485 1741:20 ----- 2.46, 2.81 A or (resid 124 and name HA) (resid 124 and name HB2) ! 0.1080 1741:20 ----- 2.99, 3.02 A assign (resid 124 and name HA) (resid 124 and name HB1) 2.30 0.50 0.50 ! 0.9413 1742:20 Intra 2.42, 2.51 A assign (resid 148 and name HA) (resid 148 and name HB2) 3.65 1.85 1.85 ! 0.9921 1744:20 Intra 2.98, 2.99 A assign (resid 70 and name HA) (resid 70 and name HB1) 2.65 0.85 0.85 ! 0.9951 1746:20 Intra 2.41, 2.47 A assign (resid 117 and name HA) (resid 117 and name HB*) 2.30 0.50 0.50 ! 0.9982 1747:20 Intra 2.38, 2.74 A assign (resid 104 and name HA) (resid 107 and name HB2) 3.15 1.35 1.35 ! 0.9555 1748:20 Mid 2.37, 2.77 A assign (resid 107 and name HA) (resid 107 and name HB2) 2.65 0.85 0.85 ! 0.0000 1749:20 Intra 2.96, 3.00 A assign (resid 107 and name HA) (resid 107 and name HB1) 2.65 0.85 0.85 ! 0.9639 1750:20 Intra 2.44, 2.59 A assign (resid 120 and name HA) (resid 123 and name HB2) 3.15 1.35 1.35 ! 0.6722 1751:20 Ambig 2.66, 3.02 A or (resid 123 and name HA) (resid 123 and name HB2) ! 0.3278 1751:20 ----- 3.00, 3.01 A assign (resid 127 and name HA) (resid 127 and name HB1) 2.30 0.50 0.50 ! 0.9969 1752:20 Intra 2.29, 2.31 A assign (resid 100 and name HA) (resid 103 and name HB1) 2.65 0.85 0.85 ! 0.9071 1758:20 Ambig 1.99, 3.24 A or (resid 70 and name HA) (resid 70 and name HB2) ! 0.0779 1758:20 ----- 3.00, 3.02 A assign (resid 120 and name HA) (resid 120 and name HD*) 2.30 0.50 0.50 ! 0.9862 1761:20 Intra 1.97, 2.55 A assign (resid 18 and name HA) (resid 18 and name HG) 3.65 1.85 1.85 ! 0.9354 1762:20 Intra 3.11, 3.24 A assign (resid 8 and name HA) (resid 8 and name HG12) 3.15 1.35 1.35 ! 0.0000 1767:20 Intra 3.22, 3.29 A assign (resid 8 and name HA) (resid 8 and name HG11) 3.15 1.35 1.35 ! 0.0000 1769:20 Intra 3.82, 3.86 A assign (resid 136 and name HA) (resid 136 and name HD*) 2.65 0.85 0.85 ! 0.9637 1771:20 Intra 2.01, 2.78 A assign (resid 164 and name HB1) (resid 165 and name HB1) 3.65 1.85 1.85 ! 0.5822 1774:20 Ambig 4.62, 6.15 A or (resid 166 and name HA) (resid 165 and name HB1) ! 0.4178 1774:20 ----- 4.88, 5.09 A assign (resid 127 and name HD1) (resid 127 and name HB2) 3.15 1.35 1.35 ! 0.5646 1775:20 Ambig 3.85, 3.88 A or (resid 127 and name HD1) (resid 123 and name HB1) ! 0.3702 1775:20 ----- 4.13, 4.71 A assign (resid 106 and name HA) (resid 106 and name HB*) 3.15 1.35 1.35 ! 0.0000 1776:20 Intra 2.41, 2.75 A assign (resid 127 and name HD1) (resid 124 and name HB2) 4.15 2.35 2.35 ! 0.5476 1777:20 Ambig 6.40, 6.65 A or (resid 122 and name HB2) (resid 124 and name HB2) ! 0.4524 1777:20 ----- 6.61, 6.73 A assign (resid 106 and name HD*) (resid 106 and name HB*) 2.65 0.85 0.85 ! 0.0000 1778:20 Intra 2.39, 3.01 A assign (resid 9 and name HB2) (resid 148 and name HB1) 3.65 1.85 1.85 ! 0.6097 1779:20 Ambig 4.06, 4.65 A or (resid 78 and name HD*) (resid 70 and name HB1) ! 0.2610 1779:20 ----- 4.68, 7.09 A or (resid 150 and name HD1) (resid 148 and name HB1) ! 0.0611 1779:20 ----- 5.96, 6.29 A assign (resid 130 and name HA) (resid 130 and name HB) 4.15 2.35 2.35 ! 0.0000 1781:20 Intra 3.01, 3.03 A assign (resid 102 and name HA) (resid 105 and name HB) 2.65 0.85 0.85 ! 0.7835 1782:20 Ambig 2.30, 2.50 A or (resid 127 and name HD1) (resid 127 and name HB1) ! 0.2029 1782:20 ----- 2.88, 2.94 A assign (resid 172 and name HE*) (resid 172 and name HD*) 2.30 0.50 0.50 ! 0.9966 1783:20 Intra 2.39, 2.72 A assign (resid 34 and name HB1) (resid 172 and name HD*) 2.30 0.50 0.50 ! 0.5965 1784:20 Ambig 2.21, 3.58 A or (resid 146 and name HE*) (resid 146 and name HD*) ! 0.4035 1784:20 ----- 2.36, 2.69 A assign (resid 160 and name HE*) (resid 160 and name HD*) 2.30 0.50 0.50 ! 0.0000 1785:20 Intra 2.34, 2.68 A assign (resid 127 and name HD2) (resid 127 and name HG1) 2.65 0.85 0.85 ! 0.0000 1787:20 Intra 2.66, 2.68 A assign (resid 127 and name HD1) (resid 127 and name HG2) 2.65 0.85 0.85 ! 0.0000 1788:20 Intra 2.98, 2.99 A assign (resid 155 and name HA) (resid 155 and name HG1*) 3.15 1.35 1.35 ! 0.5864 1789:20 Ambig 2.36, 2.81 A or (resid 116 and name HA) (resid 119 and name HG11) ! 0.2301 1789:20 ----- 2.75, 3.13 A or (resid 119 and name HA) (resid 119 and name HG11) ! 0.1676 1789:20 ----- 2.90, 3.69 A assign (resid 63 and name HG*) (resid 63 and name HB2) 2.30 0.50 0.50 ! 0.0000 1796:20 Intra 2.33, 2.72 A assign (resid 148 and name HG2) (resid 148 and name HB1) 3.65 1.85 1.85 ! 0.9582 1797:20 Intra 2.37, 2.39 A assign (resid 107 and name HG2) (resid 107 and name HB1) 2.65 0.85 0.85 ! 0.5371 1798:20 Ambig 2.27, 2.46 A or (resid 107 and name HG1) (resid 107 and name HB1) ! 0.4629 1798:20 ----- 2.33, 2.50 A assign (resid 107 and name HG2) (resid 107 and name HB2) 2.30 0.50 0.50 ! 0.6238 1799:20 Ambig 2.31, 2.49 A or (resid 107 and name HG1) (resid 107 and name HB2) ! 0.3762 1799:20 ----- 2.52, 2.92 A assign (resid 63 and name HG*) (resid 63 and name HB1) 2.30 0.50 0.50 ! 0.9980 1802:20 Intra 2.35, 2.68 A assign (resid 127 and name HB2) (resid 127 and name HG1) 3.15 1.35 1.35 ! 0.9809 1804:20 Intra 2.65, 2.67 A assign (resid 71 and name HE*) (resid 71 and name HD*) 2.65 0.85 0.85 ! 0.0000 1805:20 Intra 2.37, 2.67 A assign (resid 136 and name HE2) (resid 136 and name HD*) 3.15 1.35 1.35 ! 0.0000 1806:20 Intra 2.36, 2.69 A assign (resid 13 and name HG1*) (resid 155 and name HG1*) 3.65 1.85 1.85 ! 0.0000 1811:20 Long 2.49, 4.39 A assign (resid 136 and name HE1) (resid 136 and name HD*) 3.15 1.35 1.35 ! 0.0000 1813:20 Intra 2.38, 2.71 A assign (resid 30 and name HG2*) (resid 132 and name HB2) 4.15 2.35 2.35 ! 0.6489 1814:20 Ambig 3.89, 5.06 A or (resid 136 and name HD*) (resid 132 and name HB2) ! 0.1588 1814:20 ----- 4.92, 7.60 A or (resid 33 and name HD2*) (resid 132 and name HB2) ! 0.1332 1814:20 ----- 5.06, 5.91 A assign (resid 171 and name HG2*) (resid 171 and name HB) 3.15 1.35 1.35 ! 0.0000 1815:20 Intra 2.43, 2.64 A assign (resid 171 and name HG1*) (resid 171 and name HB) 2.65 0.85 0.85 ! 0.9964 1816:20 Intra 2.39, 2.62 A assign (resid 3 and name HG2*) (resid 12 and name HB2) 3.65 1.85 1.85 ! 0.8502 1817:20 Ambig 3.46, 4.43 A or (resid 3 and name HG1*) (resid 12 and name HB2) ! 0.1295 1817:20 ----- 4.74, 6.53 A assign (resid 18 and name HD1*) (resid 18 and name HG) 2.30 0.50 0.50 ! 0.5394 1821:20 Ambig 2.32, 2.61 A or (resid 18 and name HD2*) (resid 18 and name HG) ! 0.4422 1821:20 ----- 2.40, 2.64 A assign (resid 8 and name HD1*) (resid 8 and name HG11) 2.30 0.50 0.50 ! 0.0000 1822:20 Intra 2.40, 2.63 A assign (resid 105 and name HG1*) (resid 105 and name HB) 3.15 1.35 1.35 ! 0.0000 1825:20 Intra 2.43, 2.65 A assign (resid 155 and name HD1*) (resid 155 and name HG1*) 3.15 1.35 1.35 ! 0.0000 1826:20 Intra 2.40, 2.61 A assign (resid 5 and name HN) (resid 5 and name HG2) 4.15 2.35 2.35 ! 0.9118 1828:20 Ambig 2.62, 3.70 A or (resid 6 and name HN) (resid 5 and name HG2) ! 0.0882 1828:20 ----- 3.86, 4.37 A assign (resid 5 and name HN) (resid 5 and name HG1) 3.65 1.85 1.85 ! 0.9289 1829:20 Intra 2.63, 3.22 A assign (resid 133 and name HN) (resid 133 and name HG) 4.15 2.35 2.35 ! 0.0000 1830:20 Intra 2.18, 2.40 A assign (resid 109 and name HN) (resid 109 and name HG) 3.65 1.85 1.85 ! 0.0000 1831:20 Intra 3.96, 4.07 A assign (resid 2 and name HN) (resid 2 and name HG11) 3.15 1.35 1.35 ! 0.9891 1832:20 Intra 2.24, 3.35 A assign (resid 95 and name HN) (resid 95 and name HG2) 3.15 1.35 1.35 ! 0.0000 1833:20 Intra 2.06, 2.29 A assign (resid 178 and name HN) (resid 5 and name HG2) 4.15 2.35 2.35 ! 0.8949 1834:20 Ambig 3.47, 5.39 A or (resid 3 and name HN) (resid 5 and name HG2) ! 0.1051 1834:20 ----- 4.96, 6.53 A assign (resid 42 and name HN) (resid 71 and name HG1) 3.65 1.85 1.85 ! 0.0000 1835:20 Long 3.64, 4.80 A assign (resid 120 and name HN) (resid 120 and name HG*) 2.65 0.85 0.85 ! 0.7047 1836:20 Ambig 2.07, 2.96 A or (resid 111 and name HN) (resid 110 and name HG*) ! 0.2136 1836:20 ----- 2.53, 3.93 A or (resid 139 and name HN) (resid 140 and name HG) ! 0.0495 1836:20 ----- 3.23, 3.42 A assign (resid 179 and name HN) (resid 179 and name HG2) 3.15 1.35 1.35 ! 0.9848 1837:20 Intra 2.03, 3.14 A assign (resid 95 and name HN) (resid 95 and name HG1) 3.65 1.85 1.85 ! 0.0000 1838:20 Intra 3.56, 3.71 A assign (resid 13 and name HN) (resid 18 and name HD1*) 4.15 2.35 2.35 ! 0.0000 1839:20 Long 6.62, 7.73 A assign (resid 71 and name HN) (resid 71 and name HG2) 4.15 2.35 2.35 ! 0.8585 1841:20 Ambig 2.87, 4.17 A or (resid 43 and name HN) (resid 71 and name HG2) ! 0.1196 1841:20 ----- 3.98, 5.30 A assign (resid 3 and name HN) (resid 2 and name HG12) 4.15 2.35 2.35 ! 0.9011 1843:20 Ambig 4.32, 5.05 A or (resid 178 and name HN) (resid 2 and name HG12) ! 0.0989 1843:20 ----- 6.25, 7.47 A assign (resid 133 and name HN) (resid 133 and name HD1*) 3.15 1.35 1.35 ! 0.0000 1844:20 Intra 3.94, 4.56 A assign (resid 134 and name HN) (resid 133 and name HD1*) 4.15 2.35 2.35 ! 0.0000 1845:20 Seq 4.75, 5.67 A assign (resid 134 and name HN) (resid 133 and name HD1*) 3.65 1.85 1.85 ! 0.0000 1846:20 Seq 4.75, 5.67 A assign (resid 157 and name HN) (resid 140 and name HD1*) 4.15 2.35 2.35 ! 0.8904 1847:20 Ambig 4.04, 5.33 A or (resid 134 and name HN) (resid 140 and name HD1*) ! 0.1096 1847:20 ----- 5.73, 6.72 A assign (resid 141 and name HN) (resid 140 and name HD1*) 3.15 1.35 1.35 ! 0.4058 1848:20 Ambig 4.71, 5.99 A or (resid 139 and name HN) (resid 140 and name HD1*) ! 0.3429 1848:20 ----- 4.85, 5.71 A or (resid 138 and name HN) (resid 140 and name HD1*) ! 0.2513 1848:20 ----- 5.10, 6.09 A assign (resid 34 and name HN) (resid 33 and name HD1*) 3.65 1.85 1.85 ! 0.0000 1849:20 Seq 5.06, 5.89 A assign (resid 109 and name HN) (resid 109 and name HD2*) 3.15 1.35 1.35 ! 0.0000 1850:20 Intra 3.96, 4.78 A assign (resid 151 and name HN) (resid 150 and name HG2) 3.65 1.85 1.85 ! 0.0000 1852:20 Seq 2.32, 2.64 A assign (resid 88 and name HN) (resid 87 and name HG*) 4.15 2.35 2.35 ! 0.0000 1853:20 Seq 4.31, 4.96 A assign (resid 20 and name HN) (resid 20 and name HG11) 3.65 1.85 1.85 ! 0.9638 1854:20 Intra 2.53, 2.82 A assign (resid 97 and name HZ2) (resid 154 and name HG) 4.15 2.35 2.35 ! 0.0000 1855:20 Long 4.23, 4.73 A assign (resid 96 and name HN) (resid 95 and name HG2) 4.15 2.35 2.35 ! 0.0000 1856:20 Seq 4.09, 4.28 A assign (resid 71 and name HN) (resid 71 and name HG1) 3.15 1.35 1.35 ! 0.0000 1857:20 Intra 2.76, 3.61 A assign (resid 110 and name HN) (resid 110 and name HG*) 3.15 1.35 1.35 ! 0.9835 1858:20 Intra 1.95, 2.83 A assign (resid 163 and name HN) (resid 160 and name HG*) 3.15 1.35 1.35 ! 0.8897 1859:20 Ambig 2.78, 4.69 A or (resid 69 and name HN) (resid 71 and name HG1) ! 0.0643 1859:20 ----- 4.31, 6.60 A assign (resid 19 and name HN) (resid 18 and name HD1*) 3.15 1.35 1.35 ! 0.7543 1861:20 Ambig 4.25, 5.29 A or (resid 17 and name HN) (resid 18 and name HD1*) ! 0.2457 1861:20 ----- 5.12, 6.06 A assign (resid 81 and name HD*) (resid 18 and name HD1*) 3.15 1.35 1.35 ! 0.9897 1862:20 Long 2.56, 5.28 A assign (resid 19 and name HN) (resid 19 and name HG*) 3.15 1.35 1.35 ! 0.8904 1863:20 Ambig 2.31, 3.90 A or (resid 20 and name HN) (resid 19 and name HG*) ! 0.0996 1863:20 ----- 3.33, 4.39 A assign (resid 129 and name HN) (resid 133 and name HD1*) 4.15 2.35 2.35 ! 0.0000 1864:20 Mid 6.13, 7.13 A assign (resid 132 and name HN) (resid 133 and name HD1*) 3.65 1.85 1.85 ! 0.0000 1865:20 Seq 5.70, 6.57 A assign (resid 137 and name HN) (resid 140 and name HD1*) 3.15 1.35 1.35 ! 0.6838 1866:20 Ambig 3.66, 4.61 A or (resid 136 and name HN) (resid 140 and name HD1*) ! 0.3162 1866:20 ----- 4.16, 5.41 A assign (resid 106 and name HN) (resid 109 and name HD2*) 3.65 1.85 1.85 ! 0.3832 1867:20 Ambig 4.45, 5.99 A or (resid 110 and name HN) (resid 109 and name HD2*) ! 0.2322 1867:20 ----- 4.84, 5.48 A or (resid 125 and name HN) (resid 109 and name HD2*) ! 0.1769 1867:20 ----- 5.06, 6.36 A or (resid 124 and name HN) (resid 109 and name HD2*) ! 0.1157 1867:20 ----- 5.44, 6.76 A or (resid 108 and name HN) (resid 109 and name HD2*) ! 0.0920 1867:20 ----- 5.65, 6.82 A assign (resid 122 and name HD*) (resid 109 and name HD2*) 3.15 1.35 1.35 ! 0.0000 1868:20 Long 3.14, 5.45 A assign (resid 97 and name HD1) (resid 154 and name HD2*) 3.15 1.35 1.35 ! 0.5000 1869:20 Ambig 4.42, 5.95 A or (resid 154 and name HN) (resid 154 and name HD2*) ! 0.5000 1869:20 ----- 4.42, 5.29 A assign (resid 129 and name HD*) (resid 133 and name HG) 4.15 2.35 2.35 ! 0.0000 1870:20 Mid 5.42, 6.26 A assign (resid 103 and name HN) (resid 103 and name HG2) 3.65 1.85 1.85 ! 0.4383 1871:20 Ambig 3.48, 4.01 A or (resid 107 and name HE21) (resid 103 and name HG2) ! 0.3769 1871:20 ----- 3.57, 5.47 A or (resid 104 and name HD22) (resid 103 and name HG2) ! 0.1849 1871:20 ----- 4.02, 6.28 A assign (resid 159 and name HD*) (resid 166 and name HG2) 4.15 2.35 2.35 ! 0.0000 1872:20 Long 5.81, 6.94 A assign (resid 143 and name HD*) (resid 166 and name HG1) 4.15 2.35 2.35 ! 0.0000 1873:20 Long 4.10, 5.71 A assign (resid 33 and name HN) (resid 33 and name HG) 3.65 1.85 1.85 ! 0.9088 1874:20 Ambig 2.92, 3.06 A or (resid 94 and name HD*) (resid 154 and name HG) ! 0.0912 1874:20 ----- 4.28, 7.07 A assign (resid 99 and name HN) (resid 99 and name HG1) 3.15 1.35 1.35 ! 0.5469 1876:20 Ambig 2.13, 3.03 A or (resid 131 and name HN) (resid 131 and name HG*) ! 0.4374 1876:20 ----- 2.21, 4.04 A assign (resid 100 and name HN) (resid 99 and name HG2) 3.15 1.35 1.35 ! 0.6198 1877:20 Ambig 3.04, 4.82 A or (resid 99 and name HN) (resid 99 and name HG2) ! 0.3802 1877:20 ----- 3.30, 3.77 A assign (resid 15 and name HN) (resid 18 and name HD1*) 3.65 1.85 1.85 ! 0.0000 1881:20 Mid 1.87, 3.08 A assign (resid 156 and name HD*) (resid 133 and name HD1*) 3.15 1.35 1.35 ! 0.8081 1882:20 Ambig 4.28, 6.13 A or (resid 129 and name HD*) (resid 133 and name HD1*) ! 0.1919 1882:20 ----- 5.43, 6.67 A assign (resid 156 and name HD*) (resid 140 and name HD1*) 2.65 0.85 0.85 ! 0.9787 1883:20 Long 1.94, 4.40 A assign (resid 158 and name HD*) (resid 140 and name HD1*) 3.65 1.85 1.85 ! 0.8402 1884:20 Ambig 4.82, 7.60 A or (resid 97 and name HH2) (resid 140 and name HD1*) ! 0.1598 1884:20 ----- 6.35, 7.70 A assign (resid 132 and name HD1) (resid 33 and name HD1*) 3.65 1.85 1.85 ! 0.0000 1887:20 Long 4.72, 5.36 A assign (resid 33 and name HN) (resid 33 and name HD1*) 3.15 1.35 1.35 ! 0.8147 1888:20 Ambig 3.89, 4.77 A or (resid 132 and name HZ2) (resid 33 and name HD1*) ! 0.1853 1888:20 ----- 4.98, 6.52 A assign (resid 142 and name HD*) (resid 154 and name HD2*) 2.65 0.85 0.85 ! 0.9584 1889:20 Long 3.28, 4.96 A assign (resid 33 and name HA) (resid 33 and name HG) 3.65 1.85 1.85 ! 0.0000 1893:20 Intra 2.83, 2.91 A assign (resid 4 and name HE*) (resid 172 and name HG*) 3.15 1.35 1.35 ! 0.0000 1894:20 Long 2.29, 4.42 A assign (resid 33 and name HA) (resid 33 and name HD1*) 3.65 1.85 1.85 ! 0.0000 1895:20 Intra 4.41, 4.67 A assign (resid 149 and name HA) (resid 150 and name HG1) 3.65 1.85 1.85 ! 0.8137 1897:20 Ambig 4.61, 4.70 A or (resid 151 and name HA) (resid 150 and name HG1) ! 0.1863 1897:20 ----- 5.89, 6.08 A assign (resid 21 and name HA) (resid 22 and name HG2) 3.15 1.35 1.35 ! 0.8576 1898:20 Ambig 4.32, 4.52 A or (resid 34 and name HA) (resid 22 and name HG2) ! 0.1424 1898:20 ----- 5.83, 6.25 A assign (resid 151 and name HA) (resid 150 and name HG2) 3.65 1.85 1.85 ! 0.5598 1899:20 Ambig 4.26, 4.53 A or (resid 149 and name HA) (resid 150 and name HG2) ! 0.4402 1899:20 ----- 4.43, 4.65 A assign (resid 165 and name HA) (resid 166 and name HG2) 3.65 1.85 1.85 ! 0.9168 1901:20 Ambig 4.43, 4.68 A or (resid 73 and name HA) (resid 166 and name HG2) ! 0.0832 1901:20 ----- 6.61, 7.84 A assign (resid 5 and name HA) (resid 5 and name HG2) 3.65 1.85 1.85 ! 0.0000 1902:20 Intra 2.48, 2.70 A assign (resid 71 and name HA) (resid 71 and name HG1) 3.65 1.85 1.85 ! 0.0000 1903:20 Intra 2.36, 2.79 A assign (resid 5 and name HA) (resid 5 and name HG1) 3.65 1.85 1.85 ! 0.0000 1904:20 Intra 2.63, 3.23 A assign (resid 71 and name HA) (resid 71 and name HG2) 3.15 1.35 1.35 ! 0.0000 1905:20 Intra 2.43, 3.21 A assign (resid 2 and name HA) (resid 2 and name HG12) 3.15 1.35 1.35 ! 0.5733 1908:20 Ambig 2.47, 3.03 A or (resid 179 and name HA) (resid 2 and name HG12) ! 0.4243 1908:20 ----- 2.60, 4.43 A assign (resid 156 and name HA) (resid 140 and name HD1*) 3.15 1.35 1.35 ! 0.8239 1909:20 Ambig 3.37, 4.85 A or (resid 140 and name HA) (resid 140 and name HD1*) ! 0.1761 1909:20 ----- 4.36, 4.66 A assign (resid 142 and name HA) (resid 154 and name HD2*) 3.65 1.85 1.85 ! 0.8194 1910:20 Ambig 4.68, 6.10 A or (resid 143 and name HA) (resid 154 and name HD2*) ! 0.0924 1910:20 ----- 6.74, 7.94 A or (resid 144 and name HA) (resid 154 and name HD2*) ! 0.0882 1910:20 ----- 6.79, 7.80 A assign (resid 128 and name HB) (resid 31 and name HG2) 3.15 1.35 1.35 ! 0.8224 1911:20 Ambig 2.92, 3.59 A or (resid 31 and name HA) (resid 31 and name HG2) ! 0.1776 1911:20 ----- 3.77, 3.84 A assign (resid 31 and name HA) (resid 31 and name HG1) 3.15 1.35 1.35 ! 0.6693 1912:20 Ambig 3.93, 4.00 A or (resid 128 and name HB) (resid 31 and name HG1) ! 0.3307 1912:20 ----- 4.42, 5.29 A assign (resid 31 and name HD2) (resid 31 and name HG2) 2.30 0.50 0.50 ! 0.8003 1913:20 Ambig 2.29, 2.31 A or (resid 125 and name HA) (resid 31 and name HG2) ! 0.1804 1913:20 ----- 2.94, 3.36 A assign (resid 31 and name HD2) (resid 31 and name HG1) 2.30 0.50 0.50 ! 0.7934 1914:20 Ambig 2.67, 2.70 A or (resid 78 and name HA) (resid 78 and name HG2) ! 0.0912 1914:20 ----- 3.83, 3.92 A or (resid 125 and name HA) (resid 31 and name HG1) ! 0.0886 1914:20 ----- 3.85, 4.71 A assign (resid 150 and name HA) (resid 150 and name HG1) 3.15 1.35 1.35 ! 0.5143 1915:20 Ambig 3.96, 4.01 A or (resid 77 and name HA2) (resid 78 and name HG1) ! 0.4857 1915:20 ----- 4.00, 4.35 A assign (resid 78 and name HA) (resid 78 and name HG1) 2.65 0.85 0.85 ! 0.0000 1916:20 Intra 2.80, 2.94 A assign (resid 21 and name HB) (resid 22 and name HG2) 3.15 1.35 1.35 ! 0.8145 1917:20 Ambig 3.63, 4.04 A or (resid 21 and name HB) (resid 22 and name HG1) ! 0.1855 1917:20 ----- 4.65, 5.04 A assign (resid 103 and name HA) (resid 103 and name HG2) 3.15 1.35 1.35 ! 0.9918 1922:20 Intra 2.43, 2.82 A assign (resid 150 and name HA) (resid 150 and name HG2) 3.65 1.85 1.85 ! 0.0000 1923:20 Intra 3.80, 3.86 A assign (resid 20 and name HA) (resid 20 and name HG11) 3.15 1.35 1.35 ! 0.9891 1926:20 Intra 2.36, 3.03 A assign (resid 103 and name HA) (resid 103 and name HG1) 3.15 1.35 1.35 ! 0.9245 1927:20 Intra 2.49, 2.77 A assign (resid 31 and name HA) (resid 33 and name HG) 4.15 2.35 2.35 ! 0.8712 1933:20 Ambig 5.30, 5.63 A or (resid 88 and name HA) (resid 154 and name HG) ! 0.1288 1933:20 ----- 7.28, 7.97 A assign (resid 167 and name HA) (resid 166 and name HG1) 4.90 3.10 3.10 ! 0.0000 1934:20 Seq 6.56, 6.79 A assign (resid 107 and name HA) (resid 110 and name HG*) 2.30 0.50 0.50 ! 0.5308 1937:20 Ambig 1.91, 3.92 A or (resid 117 and name HA) (resid 120 and name HG*) ! 0.1853 1937:20 ----- 2.28, 2.88 A or (resid 99 and name HA) (resid 99 and name HG1) ! 0.1199 1937:20 ----- 2.45, 2.91 A or (resid 110 and name HA) (resid 110 and name HG*) ! 0.1001 1937:20 ----- 2.52, 3.25 A assign (resid 99 and name HA) (resid 99 and name HG2) 3.15 1.35 1.35 ! 0.5871 1939:20 Ambig 2.45, 2.88 A or (resid 7 and name HA) (resid 176 and name HG*) ! 0.3978 1939:20 ----- 2.62, 4.18 A assign (resid 50 and name HA) (resid 50 and name HG11) 3.65 1.85 1.85 ! 0.8770 1942:20 Ambig 2.41, 3.21 A or (resid 48 and name HA) (resid 50 and name HG11) ! 0.1230 1942:20 ----- 3.34, 6.39 A assign (resid 19 and name HA) (resid 19 and name HG*) 3.15 1.35 1.35 ! 0.0000 1947:20 Intra 2.39, 2.98 A assign (resid 136 and name HA) (resid 136 and name HG1) 3.15 1.35 1.35 ! 0.9855 1950:20 Intra 2.42, 3.36 A assign (resid 20 and name HA) (resid 20 and name HG12) 3.15 1.35 1.35 ! 0.9931 1951:20 Intra 2.45, 2.62 A assign (resid 123 and name HA) (resid 109 and name HD2*) 3.15 1.35 1.35 ! 0.9752 1953:20 Long 2.36, 3.73 A assign (resid 31 and name HD1) (resid 31 and name HG1) 2.65 0.85 0.85 ! 0.5141 1955:20 Ambig 2.29, 2.31 A or (resid 78 and name HD*) (resid 78 and name HG2) ! 0.4833 1955:20 ----- 2.31, 2.49 A assign (resid 31 and name HD1) (resid 31 and name HG2) 2.65 0.85 0.85 ! 0.0000 1956:20 Intra 2.97, 2.99 A assign (resid 76 and name HB2) (resid 78 and name HG1) 3.65 1.85 1.85 ! 0.0000 1957:20 Mid 3.68, 4.92 A assign (resid 130 and name HA) (resid 133 and name HG) 4.15 2.35 2.35 ! 0.5676 1958:20 Ambig 2.94, 3.69 A or (resid 133 and name HA) (resid 133 and name HG) ! 0.4248 1958:20 ----- 3.08, 3.15 A assign (resid 22 and name HD*) (resid 22 and name HG1) 2.30 0.50 0.50 ! 0.0000 1959:20 Intra 2.28, 2.51 A assign (resid 22 and name HD*) (resid 22 and name HG2) 2.30 0.50 0.50 ! 0.0000 1960:20 Intra 2.29, 2.64 A assign (resid 103 and name HD*) (resid 103 and name HG2) 2.30 0.50 0.50 ! 0.0000 1963:20 Intra 2.30, 2.71 A assign (resid 87 and name HD2) (resid 87 and name HG*) 2.30 0.50 0.50 ! 0.8374 1964:20 Ambig 2.25, 2.55 A or (resid 150 and name HD1) (resid 150 and name HG2) ! 0.1626 1964:20 ----- 2.96, 2.99 A assign (resid 87 and name HD1) (resid 87 and name HG*) 2.65 0.85 0.85 ! 0.0000 1965:20 Intra 2.24, 2.58 A assign (resid 166 and name HD1) (resid 166 and name HG2) 4.15 2.35 2.35 ! 0.0000 1966:20 Intra 2.68, 2.86 A assign (resid 166 and name HA) (resid 166 and name HG2) 3.15 1.35 1.35 ! 0.0000 1967:20 Intra 3.78, 3.88 A assign (resid 106 and name HA) (resid 106 and name HG*) 3.15 1.35 1.35 ! 0.0000 1968:20 Intra 2.44, 2.88 A assign (resid 106 and name HD*) (resid 106 and name HG*) 2.65 0.85 0.85 ! 0.0000 1969:20 Intra 2.38, 2.66 A assign (resid 16 and name HB2) (resid 2 and name HG11) 4.15 2.35 2.35 ! 0.0000 1970:20 Long 3.76, 4.43 A assign (resid 103 and name HD*) (resid 103 and name HG1) 2.65 0.85 0.85 ! 0.0000 1971:20 Intra 2.29, 2.59 A assign (resid 166 and name HA) (resid 166 and name HG1) 3.65 1.85 1.85 ! 0.0000 1972:20 Intra 2.90, 3.53 A assign (resid 95 and name HA) (resid 95 and name HG2) 3.65 1.85 1.85 ! 0.0000 1973:20 Intra 2.95, 3.12 A assign (resid 92 and name HA2) (resid 95 and name HG2) 4.15 2.35 2.35 ! 0.9971 1974:20 Mid 2.48, 2.95 A assign (resid 160 and name HE*) (resid 160 and name HG*) 2.30 0.50 0.50 ! 0.9938 1975:20 Intra 2.32, 3.07 A assign (resid 99 and name HE*) (resid 99 and name HG1) 2.30 0.50 0.50 ! 0.3395 1976:20 Ambig 2.39, 3.25 A or (resid 131 and name HE*) (resid 131 and name HG*) ! 0.3351 1976:20 ----- 2.39, 3.25 A or (resid 120 and name HE*) (resid 120 and name HG*) ! 0.3255 1976:20 ----- 2.41, 2.94 A assign (resid 95 and name HA) (resid 95 and name HG1) 3.15 1.35 1.35 ! 0.0000 1977:20 Intra 3.72, 3.77 A assign (resid 137 and name HA) (resid 140 and name HD1*) 2.65 0.85 0.85 ! 0.8934 1979:20 Ambig 1.97, 2.94 A or (resid 133 and name HA) (resid 140 and name HD1*) ! 0.1031 1979:20 ----- 2.82, 4.23 A assign (resid 139 and name HB2) (resid 136 and name HG1) 4.15 2.35 2.35 ! 0.9973 1980:20 Mid 2.41, 4.82 A assign (resid 132 and name HB2) (resid 33 and name HD1*) 2.65 0.85 0.85 ! 0.9589 1981:20 Long 2.85, 3.30 A assign (resid 129 and name HB1) (resid 33 and name HD1*) 3.15 1.35 1.35 ! 0.0000 1982:20 Long 4.23, 5.27 A assign (resid 106 and name HA) (resid 109 and name HD2*) 2.65 0.85 0.85 ! 0.9693 1983:20 Mid 2.29, 3.62 A assign (resid 122 and name HB1) (resid 109 and name HD2*) 3.15 1.35 1.35 ! 0.8639 1984:20 Ambig 3.64, 5.27 A or (resid 174 and name HA1) (resid 109 and name HD2*) ! 0.0690 1984:20 ----- 5.55, 6.75 A assign (resid 97 and name HB*) (resid 154 and name HD2*) 4.15 2.35 2.35 ! 0.8865 1985:20 Ambig 4.25, 5.62 A or (resid 98 and name HA) (resid 154 and name HD2*) ! 0.1135 1985:20 ----- 5.99, 7.61 A assign (resid 142 and name HB2) (resid 154 and name HD2*) 4.15 2.35 2.35 ! 0.0000 1986:20 Long 3.18, 4.88 A assign (resid 78 and name HB1) (resid 78 and name HG1) 2.30 0.50 0.50 ! 0.6875 1987:20 Ambig 2.31, 2.34 A or (resid 150 and name HB2) (resid 150 and name HG1) ! 0.3125 1987:20 ----- 2.64, 2.67 A assign (resid 87 and name HB2) (resid 87 and name HG*) 2.30 0.50 0.50 ! 0.8317 1990:20 Ambig 2.27, 2.53 A or (resid 150 and name HB1) (resid 150 and name HG2) ! 0.1683 1990:20 ----- 2.96, 2.99 A assign (resid 106 and name HB*) (resid 106 and name HG*) 2.65 0.85 0.85 ! 0.9763 1991:20 Intra 2.27, 2.71 A assign (resid 179 and name HE*) (resid 179 and name HG2) 2.30 0.50 0.50 ! 0.5141 1993:20 Ambig 2.35, 3.17 A or (resid 176 and name HE*) (resid 176 and name HG*) ! 0.4656 1993:20 ----- 2.39, 3.05 A assign (resid 71 and name HE*) (resid 71 and name HG2) 3.15 1.35 1.35 ! 0.0000 1994:20 Intra 2.39, 3.01 A assign (resid 156 and name HB1) (resid 140 and name HD1*) 3.15 1.35 1.35 ! 0.9543 1995:20 Long 1.95, 3.23 A assign (resid 133 and name HG) (resid 133 and name HD1*) 2.30 0.50 0.50 ! 0.4997 1997:20 Ambig 2.41, 2.62 A or (resid 133 and name HB2) (resid 133 and name HD1*) ! 0.4980 1997:20 ----- 2.41, 3.05 A assign (resid 133 and name HB2) (resid 140 and name HD1*) 3.65 1.85 1.85 ! 0.0000 1998:20 Long 5.23, 6.05 A assign (resid 139 and name HB1) (resid 136 and name HG1) 4.15 2.35 2.35 ! 0.6570 2001:20 Ambig 3.75, 6.12 A or (resid 135 and name HB1) (resid 136 and name HG1) ! 0.2702 2001:20 ----- 4.35, 5.64 A assign (resid 133 and name HG) (resid 33 and name HD1*) 3.65 1.85 1.85 ! 0.9201 2002:20 Long 3.90, 5.06 A assign (resid 106 and name HB*) (resid 109 and name HD2*) 3.65 1.85 1.85 ! 0.5939 2003:20 Ambig 3.53, 5.82 A or (resid 123 and name HB1) (resid 109 and name HD2*) ! 0.4061 2003:20 ----- 3.76, 5.60 A assign (resid 142 and name HB1) (resid 154 and name HD2*) 3.65 1.85 1.85 ! 0.0000 2004:20 Long 2.37, 4.00 A assign (resid 128 and name HG2*) (resid 31 and name HG2) 3.15 1.35 1.35 ! 0.9932 2005:20 Long 2.13, 3.33 A assign (resid 128 and name HG2*) (resid 31 and name HG1) 3.15 1.35 1.35 ! 0.9827 2006:20 Long 3.21, 4.74 A assign (resid 22 and name HB1) (resid 22 and name HG2) 2.65 0.85 0.85 ! 0.0000 2008:20 Intra 2.98, 2.99 A assign (resid 103 and name HB1) (resid 103 and name HG1) 3.65 1.85 1.85 ! 0.0000 2010:20 Intra 2.98, 3.01 A assign (resid 110 and name HB*) (resid 106 and name HG*) 3.65 1.85 1.85 ! 0.3882 2011:20 Ambig 4.55, 7.41 A or (resid 103 and name HB2) (resid 106 and name HG*) ! 0.2832 2011:20 ----- 4.80, 7.27 A or (resid 103 and name HB1) (resid 106 and name HG*) ! 0.2227 2011:20 ----- 5.00, 7.04 A or (resid 109 and name HG) (resid 106 and name HG*) ! 0.1059 2011:20 ----- 5.66, 6.81 A assign (resid 5 and name HD*) (resid 5 and name HG2) 2.30 0.50 0.50 ! 0.3454 2013:20 Ambig 2.33, 2.63 A or (resid 71 and name HB2) (resid 71 and name HG1) ! 0.3248 2013:20 ----- 2.35, 2.74 A or (resid 160 and name HD*) (resid 160 and name HG*) ! 0.3105 2013:20 ----- 2.37, 2.70 A assign (resid 18 and name HG) (resid 18 and name HD1*) 2.30 0.50 0.50 ! 0.5788 2016:20 Ambig 2.32, 2.61 A or (resid 18 and name HB2) (resid 18 and name HD1*) ! 0.4212 2016:20 ----- 2.45, 3.07 A assign (resid 130 and name HB) (resid 133 and name HD1*) 3.65 1.85 1.85 ! 0.0000 2021:20 Mid 5.08, 6.75 A assign (resid 140 and name HG) (resid 140 and name HD1*) 2.65 0.85 0.85 ! 0.0000 2022:20 Intra 2.39, 2.63 A assign (resid 136 and name HB2) (resid 140 and name HD1*) 2.65 0.85 0.85 ! 0.6169 2023:20 Ambig 2.18, 4.37 A or (resid 140 and name HB2) (resid 140 and name HD1*) ! 0.3377 2023:20 ----- 2.41, 3.05 A assign (resid 136 and name HE1) (resid 136 and name HG1) 4.15 2.35 2.35 ! 0.0000 2024:20 Intra 2.38, 2.86 A assign (resid 33 and name HB2) (resid 33 and name HD1*) 2.30 0.50 0.50 ! 0.3700 2025:20 Ambig 2.34, 2.92 A or (resid 33 and name HG) (resid 33 and name HD1*) ! 0.3640 2025:20 ----- 2.35, 2.62 A or (resid 128 and name HG2*) (resid 33 and name HD1*) ! 0.2469 2025:20 ----- 2.51, 4.48 A assign (resid 109 and name HB2) (resid 109 and name HD2*) 2.30 0.50 0.50 ! 0.5004 2026:20 Ambig 2.38, 3.05 A or (resid 109 and name HG) (resid 109 and name HD2*) ! 0.4967 2026:20 ----- 2.39, 2.61 A assign (resid 86 and name HG1) (resid 154 and name HD2*) 3.65 1.85 1.85 ! 0.7894 2027:20 Ambig 4.16, 6.25 A or (resid 86 and name HG2) (resid 154 and name HD2*) ! 0.1172 2027:20 ----- 5.72, 7.52 A or (resid 150 and name HG1) (resid 154 and name HD2*) ! 0.0934 2027:20 ----- 5.94, 7.64 A assign (resid 86 and name HB2) (resid 154 and name HD2*) 4.15 2.35 2.35 ! 0.0000 2028:20 Long 4.24, 5.95 A assign (resid 154 and name HG) (resid 154 and name HD2*) 2.65 0.85 0.85 ! 0.9414 2029:20 Intra 2.41, 2.63 A assign (resid 30 and name HG2*) (resid 31 and name HG2) 4.15 2.35 2.35 ! 0.0000 2031:20 Seq 6.11, 7.03 A assign (resid 133 and name HD1*) (resid 133 and name HG) 3.15 1.35 1.35 ! 0.9785 2032:20 Intra 2.41, 2.62 A assign (resid 133 and name HD2*) (resid 133 and name HG) 2.65 0.85 0.85 ! 0.9424 2033:20 Intra 2.43, 2.64 A assign (resid 166 and name HB2) (resid 166 and name HG2) 3.65 1.85 1.85 ! 0.0000 2035:20 Intra 2.31, 2.33 A assign (resid 109 and name HD1*) (resid 109 and name HG) 3.15 1.35 1.35 ! 0.9526 2036:20 Intra 2.39, 2.62 A assign (resid 166 and name HB1) (resid 166 and name HG2) 3.65 1.85 1.85 ! 0.0000 2037:20 Intra 2.63, 2.84 A assign (resid 109 and name HD2*) (resid 109 and name HG) 3.15 1.35 1.35 ! 0.0000 2038:20 Intra 2.39, 2.61 A assign (resid 2 and name HD1*) (resid 2 and name HG12) 2.30 0.50 0.50 ! 0.0000 2042:20 Intra 2.39, 2.62 A assign (resid 171 and name HG2*) (resid 133 and name HD1*) 2.65 0.85 0.85 ! 0.7127 2044:20 Ambig 2.39, 4.36 A or (resid 102 and name HG2*) (resid 133 and name HD1*) ! 0.2806 2044:20 ----- 2.79, 5.28 A assign (resid 169 and name HG1*) (resid 33 and name HD1*) 3.65 1.85 1.85 ! 0.0000 2047:20 Long 4.78, 6.91 A assign (resid 109 and name HB1) (resid 109 and name HD2*) 2.65 0.85 0.85 ! 0.0000 2049:20 Intra 2.35, 3.06 A assign (resid 154 and name HB2) (resid 154 and name HD2*) 3.15 1.35 1.35 ! 0.0000 2051:20 Intra 2.44, 3.11 A assign (resid 105 and name HG1*) (resid 109 and name HG) 4.15 2.35 2.35 ! 0.0000 2053:20 Mid 4.67, 5.53 A assign (resid 105 and name HG1*) (resid 109 and name HD2*) 3.15 1.35 1.35 ! 0.0000 2055:20 Mid 2.98, 5.21 A assign (resid 173 and name HN) (resid 171 and name HG1*) 3.15 1.35 1.35 ! 0.0000 2058:20 Mid 2.77, 3.90 A assign (resid 132 and name HE1) (resid 23 and name HG2*) 4.15 2.35 2.35 ! 0.0000 2059:20 Long 4.40, 5.49 A assign (resid 176 and name HN) (resid 176 and name HG*) 3.15 1.35 1.35 ! 0.0000 2065:20 Intra 2.03, 2.90 A assign (resid 147 and name HN) (resid 146 and name HG*) 3.65 1.85 1.85 ! 0.0000 2066:20 Seq 3.68, 4.65 A assign (resid 74 and name HN) (resid 39 and name HB*) 4.15 2.35 2.35 ! 0.0000 2067:20 Long 3.20, 4.62 A assign (resid 169 and name HN) (resid 169 and name HG2*) 3.15 1.35 1.35 ! 0.9762 2068:20 Intra 2.61, 3.56 A assign (resid 169 and name HN) (resid 169 and name HG1*) 3.15 1.35 1.35 ! 0.9300 2069:20 Intra 4.10, 4.48 A assign (resid 105 and name HN) (resid 102 and name HG2*) 3.65 1.85 1.85 ! 0.0000 2070:20 Mid 5.94, 6.51 A assign (resid 21 and name HN) (resid 36 and name HG1*) 3.15 1.35 1.35 ! 0.4923 2072:20 Ambig 4.26, 5.52 A or (resid 36 and name HN) (resid 36 and name HG1*) ! 0.4772 2072:20 ----- 4.28, 4.62 A assign (resid 117 and name HN) (resid 116 and name HG2*) 3.15 1.35 1.35 ! 0.0000 2073:20 Seq 4.09, 4.72 A assign (resid 36 and name HN) (resid 167 and name HG2*) 3.15 1.35 1.35 ! 0.7526 2074:20 Ambig 2.58, 3.97 A or (resid 21 and name HN) (resid 21 and name HG2*) ! 0.2313 2074:20 ----- 3.14, 4.05 A assign (resid 35 and name HN) (resid 23 and name HG2*) 3.65 1.85 1.85 ! 0.0000 2075:20 Long 2.67, 3.82 A assign (resid 36 and name HN) (resid 23 and name HG2*) 4.15 2.35 2.35 ! 0.7585 2077:20 Ambig 5.46, 6.50 A or (resid 21 and name HN) (resid 23 and name HG2*) ! 0.2415 2077:20 ----- 6.60, 7.39 A assign (resid 41 and name HN) (resid 41 and name HG2*) 2.65 0.85 0.85 ! 0.5731 2078:20 Ambig 2.12, 3.02 A or (resid 36 and name HN) (resid 36 and name HG2*) ! 0.3628 2078:20 ----- 2.29, 3.50 A assign (resid 143 and name HN) (resid 154 and name HD1*) 3.65 1.85 1.85 ! 0.8227 2080:20 Ambig 3.47, 4.74 A or (resid 144 and name HN) (resid 154 and name HD1*) ! 0.1773 2080:20 ----- 4.49, 5.93 A assign (resid 105 and name HN) (resid 105 and name HG2*) 2.65 0.85 0.85 ! 0.9957 2081:20 Intra 2.23, 3.24 A assign (resid 169 and name HN) (resid 155 and name HG2*) 3.65 1.85 1.85 ! 0.9063 2082:20 Ambig 3.39, 4.14 A or (resid 36 and name HN) (resid 75 and name HG1*) ! 0.0763 2082:20 ----- 5.12, 7.22 A assign (resid 105 and name HN) (resid 105 and name HG1*) 3.65 1.85 1.85 ! 0.0000 2083:20 Intra 4.31, 4.53 A assign (resid 84 and name HN) (resid 84 and name HB) 3.65 1.85 1.85 ! 0.9989 2084:20 Intra 2.38, 2.54 A assign (resid 146 and name HN) (resid 146 and name HG*) 3.15 1.35 1.35 ! 0.9444 2085:20 Intra 2.42, 4.36 A assign (resid 168 and name HN) (resid 169 and name HG2*) 3.65 1.85 1.85 ! 0.5702 2086:20 Ambig 4.94, 6.01 A or (resid 167 and name HN) (resid 169 and name HG2*) ! 0.3188 2086:20 ----- 5.44, 6.57 A or (resid 34 and name HN) (resid 169 and name HG2*) ! 0.1110 2086:20 ----- 6.49, 7.83 A assign (resid 158 and name HN) (resid 169 and name HG2*) 2.65 0.85 0.85 ! 0.9406 2087:20 Long 2.64, 4.02 A assign (resid 39 and name HN) (resid 39 and name HB*) 3.15 1.35 1.35 ! 0.0000 2088:20 Intra 2.54, 3.30 A assign (resid 40 and name HN) (resid 39 and name HB*) 2.65 0.85 0.85 ! 0.0000 2089:20 Seq 2.91, 3.86 A assign (resid 179 and name HN) (resid 179 and name HG1) 3.65 1.85 1.85 ! 0.0000 2090:20 Intra 2.50, 3.06 A assign (resid 134 and name HN) (resid 134 and name HG2*) 2.65 0.85 0.85 ! 0.0000 2091:20 Intra 2.20, 3.18 A assign (resid 170 and name HN) (resid 169 and name HG1*) 2.65 0.85 0.85 ! 0.0000 2094:20 Seq 2.99, 3.94 A assign (resid 34 and name HN) (resid 169 and name HG1*) 3.65 1.85 1.85 ! 0.0000 2095:20 Long 5.13, 6.37 A assign (resid 98 and name HN) (resid 98 and name HG2*) 3.15 1.35 1.35 ! 0.0000 2096:20 Intra 2.07, 3.06 A assign (resid 115 and name HN) (resid 114 and name HG2*) 3.15 1.35 1.35 ! 0.0000 2097:20 Seq 4.09, 4.85 A assign (resid 75 and name HN) (resid 75 and name HG2*) 2.65 0.85 0.85 ! 0.9939 2098:20 Intra 1.86, 2.98 A assign (resid 37 and name HN) (resid 36 and name HG1*) 2.65 0.85 0.85 ! 0.7363 2099:20 Ambig 3.00, 3.78 A or (resid 168 and name HN) (resid 36 and name HG1*) ! 0.2637 2099:20 ----- 3.56, 4.58 A assign (resid 130 and name HN) (resid 130 and name HG2*) 2.65 0.85 0.85 ! 0.0000 2100:20 Intra 1.91, 2.85 A assign (resid 34 and name HN) (resid 33 and name HD2*) 3.15 1.35 1.35 ! 0.0000 2101:20 Seq 3.78, 4.46 A assign (resid 159 and name HN) (resid 140 and name HD2*) 3.65 1.85 1.85 ! 0.0000 2102:20 Long 5.33, 6.65 A assign (resid 34 and name HN) (resid 23 and name HG2*) 3.15 1.35 1.35 ! 0.0000 2103:20 Long 3.16, 3.90 A assign (resid 157 and name HN) (resid 140 and name HD2*) 3.15 1.35 1.35 ! 0.0000 2104:20 Long 2.50, 3.71 A assign (resid 23 and name HN) (resid 23 and name HG2*) 3.15 1.35 1.35 ! 0.9982 2105:20 Intra 2.14, 3.16 A assign (resid 141 and name HN) (resid 140 and name HD2*) 2.65 0.85 0.85 ! 0.7999 2106:20 Ambig 3.52, 4.34 A or (resid 139 and name HN) (resid 140 and name HD2*) ! 0.1762 2106:20 ----- 4.53, 5.44 A assign (resid 3 and name HN) (resid 3 and name HG1*) 2.30 0.50 0.50 ! 0.7697 2107:20 Ambig 2.31, 3.21 A or (resid 178 and name HN) (resid 3 and name HG1*) ! 0.1047 2107:20 ----- 3.22, 4.17 A or (resid 168 and name HN) (resid 75 and name HG2*) ! 0.0425 2107:20 ----- 3.74, 6.23 A or (resid 168 and name HN) (resid 36 and name HG2*) ! 0.0319 2107:20 ----- 3.92, 4.81 A assign (resid 155 and name HN) (resid 154 and name HD1*) 3.15 1.35 1.35 ! 0.0000 2108:20 Seq 2.78, 4.08 A assign (resid 109 and name HN) (resid 105 and name HG1*) 3.15 1.35 1.35 ! 0.0000 2109:20 Mid 4.19, 5.02 A assign (resid 174 and name HN) (resid 105 and name HG1*) 4.15 2.35 2.35 ! 0.0000 2110:20 Long 4.35, 5.22 A assign (resid 121 and name HN) (resid 121 and name HG1) 3.15 1.35 1.35 ! 0.9936 2112:20 Intra 1.86, 3.45 A assign (resid 121 and name HN) (resid 121 and name HG2) 3.15 1.35 1.35 ! 0.0000 2113:20 Intra 1.97, 2.46 A assign (resid 129 and name HN) (resid 128 and name HG2*) 3.15 1.35 1.35 ! 0.5328 2114:20 Ambig 3.81, 4.65 A or (resid 19 and name HN) (resid 39 and name HB*) ! 0.2812 2114:20 ----- 4.23, 6.25 A or (resid 38 and name HN) (resid 39 and name HB*) ! 0.1271 2114:20 ----- 4.83, 6.11 A assign (resid 74 and name HD21) (resid 39 and name HB*) 2.65 0.85 0.85 ! 0.9937 2115:20 Long 1.83, 3.47 A assign (resid 19 and name HN) (resid 18 and name HD2*) 3.15 1.35 1.35 ! 0.7737 2116:20 Ambig 3.83, 4.66 A or (resid 17 and name HN) (resid 18 and name HD2*) ! 0.2263 2116:20 ----- 4.70, 5.87 A assign (resid 18 and name HN) (resid 18 and name HD2*) 2.65 0.85 0.85 ! 0.4739 2117:20 Ambig 3.35, 4.41 A or (resid 81 and name HD*) (resid 18 and name HD2*) ! 0.4184 2117:20 ----- 3.42, 6.47 A or (resid 74 and name HD21) (resid 18 and name HD2*) ! 0.1077 2117:20 ----- 4.28, 6.14 A assign (resid 102 and name HN) (resid 98 and name HG2*) 4.15 2.35 2.35 ! 0.0000 2119:20 Mid 5.85, 6.86 A assign (resid 96 and name HN) (resid 98 and name HG2*) 3.65 1.85 1.85 ! 0.0000 2120:20 Mid 4.98, 6.24 A assign (resid 102 and name HN) (resid 102 and name HG2*) 3.15 1.35 1.35 ! 0.9987 2121:20 Intra 2.00, 3.02 A assign (resid 19 and name HN) (resid 36 and name HG1*) 3.65 1.85 1.85 ! 0.7280 2122:20 Ambig 3.39, 4.49 A or (resid 20 and name HN) (resid 36 and name HG1*) ! 0.1653 2122:20 ----- 4.34, 6.01 A or (resid 38 and name HN) (resid 36 and name HG1*) ! 0.1067 2122:20 ----- 4.67, 6.25 A assign (resid 114 and name HN) (resid 114 and name HG2*) 2.65 0.85 0.85 ! 0.9051 2123:20 Ambig 1.97, 3.09 A or (resid 122 and name HD*) (resid 114 and name HG2*) ! 0.0945 2123:20 ----- 2.87, 6.00 A assign (resid 19 and name HN) (resid 36 and name HG1*) 3.65 1.85 1.85 ! 0.6960 2127:20 Ambig 3.39, 4.49 A or (resid 20 and name HN) (resid 36 and name HG1*) ! 0.1580 2127:20 ----- 4.34, 6.01 A or (resid 38 and name HN) (resid 36 and name HG1*) ! 0.1020 2127:20 ----- 4.67, 6.25 A assign (resid 175 and name HN) (resid 171 and name HG1*) 2.65 0.85 0.85 ! 0.0000 2128:20 Mid 3.37, 4.55 A assign (resid 102 and name HN) (resid 130 and name HG2*) 3.65 1.85 1.85 ! 0.5753 2129:20 Ambig 5.79, 7.10 A or (resid 133 and name HN) (resid 130 and name HG2*) ! 0.4247 2129:20 ----- 6.09, 6.65 A assign (resid 172 and name HN) (resid 33 and name HD2*) 3.15 1.35 1.35 ! 0.9777 2130:20 Long 2.52, 3.98 A assign (resid 172 and name HN) (resid 23 and name HG2*) 4.15 2.35 2.35 ! 0.0000 2131:20 Long 5.57, 6.51 A assign (resid 136 and name HN) (resid 140 and name HD2*) 3.65 1.85 1.85 ! 0.5369 2134:20 Ambig 4.86, 6.22 A or (resid 137 and name HN) (resid 140 and name HD2*) ! 0.4631 2134:20 ----- 4.99, 6.00 A assign (resid 106 and name HN) (resid 105 and name HG2*) 3.15 1.35 1.35 ! 0.4284 2135:20 Ambig 4.30, 4.89 A or (resid 7 and name HN) (resid 105 and name HG2*) ! 0.2558 2135:20 ----- 4.69, 5.62 A or (resid 102 and name HN) (resid 105 and name HG2*) ! 0.2218 2135:20 ----- 4.80, 5.71 A or (resid 108 and name HN) (resid 105 and name HG2*) ! 0.0940 2135:20 ----- 5.54, 6.17 A assign (resid 142 and name HN) (resid 154 and name HD1*) 3.65 1.85 1.85 ! 0.5746 2136:20 Ambig 5.05, 6.52 A or (resid 145 and name HN) (resid 154 and name HD1*) ! 0.2913 2136:20 ----- 5.65, 7.31 A or (resid 156 and name HN) (resid 154 and name HD1*) ! 0.1342 2136:20 ----- 6.43, 7.50 A assign (resid 97 and name HZ2) (resid 154 and name HD1*) 3.65 1.85 1.85 ! 0.0000 2137:20 Long 3.94, 5.98 A assign (resid 154 and name HN) (resid 154 and name HD1*) 3.15 1.35 1.35 ! 0.7967 2138:20 Ambig 3.01, 5.01 A or (resid 97 and name HD1) (resid 154 and name HD1*) ! 0.2033 2138:20 ----- 3.78, 7.62 A assign (resid 133 and name HN) (resid 133 and name HD2*) 2.65 0.85 0.85 ! 0.0000 2140:20 Intra 3.33, 4.26 A assign (resid 132 and name HN) (resid 133 and name HD2*) 3.65 1.85 1.85 ! 0.8595 2141:20 Ambig 5.37, 6.48 A or (resid 154 and name HN) (resid 155 and name HG2*) ! 0.1405 2141:20 ----- 7.26, 7.77 A assign (resid 156 and name HN) (resid 155 and name HG2*) 3.15 1.35 1.35 ! 0.9765 2142:20 Seq 2.65, 3.47 A assign (resid 106 and name HN) (resid 105 and name HG1*) 3.15 1.35 1.35 ! 0.8732 2143:20 Ambig 3.27, 4.25 A or (resid 108 and name HN) (resid 105 and name HG1*) ! 0.0743 2143:20 ----- 4.93, 5.55 A assign (resid 156 and name HD*) (resid 169 and name HG2*) 3.65 1.85 1.85 ! 0.8447 2146:20 Ambig 5.02, 6.54 A or (resid 140 and name HN) (resid 169 and name HG2*) ! 0.1553 2146:20 ----- 6.66, 7.81 A assign (resid 158 and name HD*) (resid 169 and name HG2*) 2.30 0.50 0.50 ! 0.0000 2147:20 Long 2.08, 4.48 A assign (resid 74 and name HD22) (resid 39 and name HB*) 2.65 0.85 0.85 ! 0.0000 2148:20 Long 2.07, 3.54 A assign (resid 15 and name HN) (resid 18 and name HD2*) 3.65 1.85 1.85 ! 0.0000 2151:20 Mid 4.38, 5.19 A assign (resid 97 and name HZ3) (resid 98 and name HG2*) 2.65 0.85 0.85 ! 0.9260 2154:20 Seq 2.64, 4.04 A assign (resid 94 and name HD*) (resid 98 and name HG2*) 2.65 0.85 0.85 ! 0.7106 2155:20 Ambig 3.46, 4.84 A or (resid 137 and name HD*) (resid 98 and name HG2*) ! 0.1627 2155:20 ----- 4.42, 7.21 A or (resid 101 and name HD*) (resid 98 and name HG2*) ! 0.1267 2155:20 ----- 4.61, 7.16 A assign (resid 132 and name HH2) (resid 169 and name HG1*) 2.65 0.85 0.85 ! 0.0000 2157:20 Long 1.99, 3.68 A assign (resid 101 and name HD*) (resid 102 and name HG2*) 2.65 0.85 0.85 ! 0.9427 2158:20 Seq 2.51, 5.48 A assign (resid 175 and name HD*) (resid 171 and name HG1*) 3.15 1.35 1.35 ! 0.7733 2160:20 Ambig 3.59, 6.22 A or (resid 137 and name HD*) (resid 134 and name HG1*) ! 0.1693 2160:20 ----- 4.63, 6.45 A assign (resid 129 and name HD*) (resid 130 and name HG2*) 3.15 1.35 1.35 ! 0.8491 2163:20 Ambig 3.65, 6.00 A or (resid 128 and name HN) (resid 130 and name HG2*) ! 0.1509 2163:20 ----- 4.86, 6.09 A assign (resid 129 and name HD*) (resid 33 and name HD2*) 2.65 0.85 0.85 ! 0.9979 2164:20 Long 2.13, 4.71 A assign (resid 33 and name HN) (resid 33 and name HD2*) 3.15 1.35 1.35 ! 0.8952 2165:20 Ambig 4.23, 4.97 A or (resid 132 and name HZ2) (resid 33 and name HD2*) ! 0.1048 2165:20 ----- 6.05, 7.55 A assign (resid 132 and name HD1) (resid 23 and name HG2*) 4.15 2.35 2.35 ! 0.0000 2166:20 Long 5.51, 6.76 A assign (resid 156 and name HD*) (resid 140 and name HD2*) 2.65 0.85 0.85 ! 0.8546 2167:20 Ambig 2.74, 5.47 A or (resid 140 and name HN) (resid 140 and name HD2*) ! 0.1256 2167:20 ----- 3.78, 4.52 A assign (resid 132 and name HZ2) (resid 23 and name HG2*) 3.65 1.85 1.85 ! 0.8627 2168:20 Ambig 3.01, 4.07 A or (resid 33 and name HN) (resid 23 and name HG2*) ! 0.1373 2168:20 ----- 4.09, 5.12 A assign (resid 158 and name HD*) (resid 140 and name HD2*) 3.15 1.35 1.35 ! 0.0000 2169:20 Long 2.47, 4.88 A assign (resid 15 and name HN) (resid 14 and name HG2*) 2.30 0.50 0.50 ! 0.0000 2172:20 Seq 1.89, 3.06 A assign (resid 74 and name HD22) (resid 75 and name HG2*) 2.30 0.50 0.50 ! 0.9966 2174:20 Seq 2.21, 3.41 A assign (resid 142 and name HD*) (resid 154 and name HD1*) 3.65 1.85 1.85 ! 0.0000 2175:20 Long 3.55, 5.44 A assign (resid 175 and name HD*) (resid 105 and name HG2*) 3.15 1.35 1.35 ! 0.6658 2176:20 Ambig 3.23, 6.43 A or (resid 101 and name HD*) (resid 105 and name HG2*) ! 0.2976 2176:20 ----- 3.70, 4.97 A assign (resid 97 and name HH2) (resid 154 and name HD1*) 4.15 2.35 2.35 ! 0.0000 2177:20 Long 5.56, 6.52 A assign (resid 97 and name HH2) (resid 154 and name HD1*) 4.15 2.35 2.35 ! 0.0000 2178:20 Long 5.56, 6.52 A assign (resid 156 and name HD*) (resid 133 and name HD2*) 2.65 0.85 0.85 ! 0.9062 2181:20 Ambig 2.93, 4.83 A or (resid 156 and name HD*) (resid 155 and name HG2*) ! 0.0581 2181:20 ----- 4.64, 6.65 A assign (resid 101 and name HE*) (resid 133 and name HD2*) 3.15 1.35 1.35 ! 0.0000 2182:20 Long 3.17, 6.45 A assign (resid 132 and name HH2) (resid 169 and name HG2*) 2.65 0.85 0.85 ! 0.0000 2184:20 Long 2.06, 3.61 A assign (resid 157 and name HA) (resid 169 and name HG1*) 4.15 2.35 2.35 ! 0.7890 2185:20 Ambig 4.83, 5.55 A or (resid 33 and name HA) (resid 169 and name HG1*) ! 0.2110 2185:20 ----- 6.02, 7.19 A assign (resid 33 and name HA) (resid 33 and name HD2*) 2.65 0.85 0.85 ! 0.0000 2187:20 Intra 2.11, 3.09 A assign (resid 132 and name HH2) (resid 23 and name HG2*) 3.65 1.85 1.85 ! 0.6779 2188:20 Ambig 2.88, 3.73 A or (resid 35 and name HA) (resid 23 and name HG2*) ! 0.3221 2188:20 ----- 3.26, 4.34 A assign (resid 33 and name HA) (resid 23 and name HG2*) 4.15 2.35 2.35 ! 0.0000 2190:20 Long 4.12, 4.88 A assign (resid 4 and name HE*) (resid 14 and name HG2*) 3.65 1.85 1.85 ! 0.0000 2191:20 Long 3.80, 7.80 A assign (resid 4 and name HE*) (resid 177 and name HG1*) 3.15 1.35 1.35 ! 0.0000 2193:20 Long 3.47, 5.22 A assign (resid 39 and name HA) (resid 39 and name HB*) 2.30 0.50 0.50 ! 0.9557 2195:20 Intra 2.43, 2.66 A assign (resid 21 and name HA) (resid 21 and name HG2*) 2.65 0.85 0.85 ! 0.9983 2199:20 Intra 2.37, 2.99 A assign (resid 140 and name HA) (resid 140 and name HD2*) 2.30 0.50 0.50 ! 0.9241 2201:20 Intra 2.06, 2.92 A assign (resid 34 and name HA) (resid 23 and name HG2*) 3.15 1.35 1.35 ! 0.9997 2202:20 Long 1.97, 3.08 A assign (resid 175 and name HA) (resid 7 and name HG2*) 2.65 0.85 0.85 ! 0.9989 2203:20 Long 2.02, 2.88 A assign (resid 168 and name HA) (resid 155 and name HG2*) 3.15 1.35 1.35 ! 0.5616 2207:20 Ambig 3.64, 4.49 A or (resid 156 and name HA) (resid 155 and name HG2*) ! 0.3441 2207:20 ----- 3.95, 4.96 A or (resid 168 and name HA) (resid 75 and name HG1*) ! 0.0613 2207:20 ----- 5.27, 6.94 A assign (resid 146 and name HA) (resid 146 and name HG*) 2.65 0.85 0.85 ! 0.9139 2211:20 Ambig 2.47, 3.03 A or (resid 81 and name HA) (resid 146 and name HG*) ! 0.0531 2211:20 ----- 3.96, 7.32 A assign (resid 128 and name HB) (resid 128 and name HG2*) 2.30 0.50 0.50 ! 0.9751 2213:20 Intra 2.43, 2.65 A assign (resid 31 and name HD2) (resid 128 and name HG2*) 2.30 0.50 0.50 ! 0.7232 2214:20 Ambig 2.05, 3.11 A or (resid 128 and name HA) (resid 128 and name HG2*) ! 0.2747 2214:20 ----- 2.41, 3.05 A assign (resid 135 and name HA) (resid 134 and name HG2*) 3.65 1.85 1.85 ! 0.0000 2215:20 Seq 6.41, 6.58 A assign (resid 131 and name HA) (resid 134 and name HG2*) 3.15 1.35 1.35 ! 0.0000 2217:20 Mid 3.29, 4.27 A assign (resid 20 and name HA) (resid 36 and name HG1*) 3.15 1.35 1.35 ! 0.9722 2218:20 Long 2.78, 4.57 A assign (resid 114 and name HA) (resid 114 and name HG2*) 2.30 0.50 0.50 ! 0.9780 2219:20 Intra 2.46, 3.19 A assign (resid 21 and name HB) (resid 21 and name HG2*) 2.30 0.50 0.50 ! 0.8373 2222:20 Ambig 2.44, 2.65 A or (resid 68 and name HA) (resid 69 and name HG2*) ! 0.0722 2222:20 ----- 3.67, 6.34 A or (resid 70 and name HA) (resid 69 and name HG2*) ! 0.0472 2222:20 ----- 3.94, 5.72 A assign (resid 69 and name HA) (resid 69 and name HG2*) 2.30 0.50 0.50 ! 0.3431 2223:20 Ambig 2.40, 3.13 A or (resid 167 and name HB) (resid 167 and name HG2*) ! 0.3415 2223:20 ----- 2.40, 2.65 A or (resid 69 and name HB) (resid 69 and name HG2*) ! 0.3155 2223:20 ----- 2.43, 2.65 A assign (resid 74 and name HA) (resid 41 and name HG2*) 2.30 0.50 0.50 ! 0.5856 2224:20 Ambig 2.24, 3.00 A or (resid 75 and name HA) (resid 75 and name HG2*) ! 0.3552 2224:20 ----- 2.44, 3.19 A assign (resid 114 and name HA) (resid 114 and name HG1*) 2.65 0.85 0.85 ! 0.9912 2225:20 Intra 2.54, 3.14 A assign (resid 171 and name HA) (resid 33 and name HD2*) 2.65 0.85 0.85 ! 0.9991 2229:20 Long 1.87, 2.76 A assign (resid 136 and name HA) (resid 140 and name HD2*) 4.15 2.35 2.35 ! 0.9240 2230:20 Mid 4.69, 5.59 A assign (resid 77 and name HA2) (resid 41 and name HG2*) 3.15 1.35 1.35 ! 0.5426 2232:20 Ambig 4.33, 5.44 A or (resid 15 and name HB1) (resid 3 and name HG1*) ! 0.3074 2232:20 ----- 4.76, 5.44 A or (resid 167 and name HA) (resid 36 and name HG2*) ! 0.1219 2232:20 ----- 5.55, 6.68 A assign (resid 150 and name HA) (resid 154 and name HD1*) 3.65 1.85 1.85 ! 0.0000 2235:20 Mid 1.93, 3.18 A assign (resid 101 and name HA) (resid 105 and name HG2*) 4.15 2.35 2.35 ! 0.0000 2236:20 Mid 3.59, 4.81 A assign (resid 85 and name HA) (resid 154 and name HD1*) 4.15 2.35 2.35 ! 0.0000 2237:20 Long 6.23, 7.49 A assign (resid 121 and name HE*) (resid 121 and name HG1) 2.30 0.50 0.50 ! 0.5150 2240:20 Ambig 2.41, 3.19 A or (resid 146 and name HE*) (resid 146 and name HG*) ! 0.4850 2240:20 ----- 2.43, 3.13 A assign (resid 31 and name HD1) (resid 128 and name HG2*) 3.15 1.35 1.35 ! 0.0000 2241:20 Long 3.73, 4.80 A assign (resid 134 and name HA) (resid 134 and name HG2*) 2.30 0.50 0.50 ! 0.8824 2242:20 Ambig 2.45, 3.09 A or (resid 130 and name HA) (resid 134 and name HG2*) ! 0.1060 2242:20 ----- 3.49, 4.80 A assign (resid 137 and name HB1) (resid 134 and name HG2*) 3.65 1.85 1.85 ! 0.0000 2243:20 Mid 4.74, 6.08 A assign (resid 98 and name HA) (resid 98 and name HG2*) 2.30 0.50 0.50 ! 0.8441 2244:20 Ambig 2.46, 3.11 A or (resid 97 and name HB*) (resid 98 and name HG2*) ! 0.1559 2244:20 ----- 3.26, 5.30 A assign (resid 156 and name HB2) (resid 169 and name HG1*) 3.65 1.85 1.85 ! 0.0000 2245:20 Long 2.28, 3.27 A assign (resid 134 and name HA) (resid 134 and name HG1*) 2.65 0.85 0.85 ! 0.8818 2246:20 Ambig 2.55, 3.20 A or (resid 173 and name HB*) (resid 171 and name HG1*) ! 0.1083 2246:20 ----- 3.62, 5.37 A assign (resid 102 and name HA) (resid 102 and name HG2*) 2.65 0.85 0.85 ! 0.0000 2247:20 Intra 2.50, 3.14 A assign (resid 174 and name HA1) (resid 171 and name HG1*) 2.65 0.85 0.85 ! 0.8758 2249:20 Ambig 2.04, 2.79 A or (resid 129 and name HB1) (resid 171 and name HG1*) ! 0.1229 2249:20 ----- 2.84, 3.84 A assign (resid 116 and name HA) (resid 116 and name HG2*) 2.30 0.50 0.50 ! 0.0000 2250:20 Intra 2.48, 3.11 A assign (resid 22 and name HD*) (resid 21 and name HG2*) 2.65 0.85 0.85 ! 0.6347 2251:20 Ambig 2.80, 4.41 A or (resid 145 and name HB*) (resid 13 and name HG1*) ! 0.3314 2251:20 ----- 3.12, 7.07 A assign (resid 130 and name HA) (resid 130 and name HG2*) 2.30 0.50 0.50 ! 0.0000 2252:20 Intra 2.54, 3.18 A assign (resid 102 and name HA) (resid 130 and name HG2*) 3.65 1.85 1.85 ! 0.8778 2253:20 Ambig 4.24, 5.63 A or (resid 127 and name HD2) (resid 130 and name HG2*) ! 0.1222 2253:20 ----- 5.89, 7.09 A assign (resid 129 and name HB1) (resid 33 and name HD2*) 3.15 1.35 1.35 ! 0.0000 2254:20 Long 2.59, 3.85 A assign (resid 129 and name HB2) (resid 33 and name HD2*) 3.15 1.35 1.35 ! 0.7962 2256:20 Ambig 4.03, 5.29 A or (resid 132 and name HB2) (resid 33 and name HD2*) ! 0.2038 2256:20 ----- 5.06, 5.91 A assign (resid 137 and name HA) (resid 140 and name HD2*) 3.15 1.35 1.35 ! 0.5408 2257:20 Ambig 3.96, 4.90 A or (resid 133 and name HA) (resid 140 and name HD2*) ! 0.4592 2257:20 ----- 4.07, 5.70 A assign (resid 23 and name HA) (resid 23 and name HG2*) 2.65 0.85 0.85 ! 0.9866 2258:20 Intra 2.45, 3.16 A assign (resid 150 and name HD1) (resid 154 and name HD1*) 3.65 1.85 1.85 ! 0.5079 2259:20 Ambig 4.79, 6.13 A or (resid 155 and name HA) (resid 154 and name HD1*) ! 0.2505 2259:20 ----- 5.38, 6.46 A or (resid 150 and name HD2) (resid 154 and name HD1*) ! 0.1705 2259:20 ----- 5.74, 7.03 A assign (resid 174 and name HA2) (resid 105 and name HG2*) 3.15 1.35 1.35 ! 0.9798 2260:20 Long 3.30, 4.95 A assign (resid 174 and name HA1) (resid 105 and name HG2*) 3.15 1.35 1.35 ! 0.5930 2261:20 Ambig 2.93, 4.19 A or (resid 102 and name HA) (resid 105 and name HG2*) ! 0.4070 2261:20 ----- 3.12, 4.07 A assign (resid 105 and name HA) (resid 105 and name HG2*) 2.65 0.85 0.85 ! 0.0000 2262:20 Intra 2.41, 3.02 A assign (resid 133 and name HA) (resid 133 and name HD2*) 2.30 0.50 0.50 ! 0.7782 2263:20 Ambig 2.11, 2.97 A or (resid 155 and name HA) (resid 155 and name HG2*) ! 0.2157 2263:20 ----- 2.61, 3.25 A assign (resid 156 and name HB2) (resid 133 and name HD2*) 3.65 1.85 1.85 ! 0.8095 2264:20 Ambig 3.48, 4.59 A or (resid 156 and name HB2) (resid 155 and name HG2*) ! 0.1905 2264:20 ----- 4.43, 5.19 A assign (resid 174 and name HA2) (resid 105 and name HG1*) 3.15 1.35 1.35 ! 0.9363 2265:20 Long 2.05, 3.22 A assign (resid 174 and name HA1) (resid 105 and name HG1*) 3.15 1.35 1.35 ! 0.9734 2266:20 Long 2.10, 3.09 A assign (resid 105 and name HA) (resid 105 and name HG1*) 2.65 0.85 0.85 ! 0.0000 2267:20 Intra 2.64, 3.28 A assign (resid 137 and name HB2) (resid 134 and name HG2*) 3.15 1.35 1.35 ! 0.9415 2269:20 Mid 3.97, 5.17 A assign (resid 134 and name HB) (resid 134 and name HG2*) 2.30 0.50 0.50 ! 0.0000 2270:20 Intra 2.41, 2.63 A assign (resid 118 and name HB1) (resid 114 and name HG2*) 3.15 1.35 1.35 ! 0.0000 2271:20 Mid 4.61, 5.50 A assign (resid 137 and name HB2) (resid 134 and name HG1*) 3.15 1.35 1.35 ! 0.7681 2272:20 Ambig 3.91, 4.92 A or (resid 175 and name HB*) (resid 171 and name HG1*) ! 0.2319 2272:20 ----- 4.78, 6.82 A assign (resid 135 and name HB1) (resid 134 and name HG1*) 4.15 2.35 2.35 ! 0.0000 2274:20 Seq 5.77, 6.99 A assign (resid 134 and name HB) (resid 134 and name HG1*) 2.30 0.50 0.50 ! 0.0000 2275:20 Intra 2.43, 2.64 A assign (resid 36 and name HB) (resid 36 and name HG1*) 2.30 0.50 0.50 ! 0.5148 2276:20 Ambig 2.41, 2.63 A or (resid 134 and name HB) (resid 134 and name HG1*) ! 0.4852 2276:20 ----- 2.43, 2.64 A assign (resid 136 and name HE2) (resid 136 and name HG1) 4.15 2.35 2.35 ! 0.0000 2277:20 Intra 2.53, 3.27 A assign (resid 126 and name HA) (resid 130 and name HG2*) 3.65 1.85 1.85 ! 0.0000 2278:20 Mid 4.49, 5.61 A assign (resid 171 and name HB) (resid 33 and name HD2*) 3.65 1.85 1.85 ! 0.9158 2279:20 Ambig 4.27, 4.96 A or (resid 126 and name HA) (resid 33 and name HD2*) ! 0.0842 2279:20 ----- 6.35, 7.45 A assign (resid 158 and name HB*) (resid 140 and name HD2*) 2.30 0.50 0.50 ! 0.9786 2280:20 Long 1.93, 3.85 A assign (resid 14 and name HA) (resid 14 and name HG2*) 2.65 0.85 0.85 ! 0.9898 2281:20 Intra 2.49, 3.10 A assign (resid 36 and name HB) (resid 36 and name HG2*) 2.30 0.50 0.50 ! 0.5201 2282:20 Ambig 2.37, 2.63 A or (resid 13 and name HB) (resid 13 and name HG2*) ! 0.4766 2282:20 ----- 2.41, 2.64 A assign (resid 142 and name HB1) (resid 154 and name HD1*) 3.15 1.35 1.35 ! 0.9966 2283:20 Long 1.99, 3.21 A assign (resid 86 and name HG2) (resid 154 and name HD1*) 3.15 1.35 1.35 ! 0.6740 2284:20 Ambig 3.70, 5.13 A or (resid 148 and name HB1) (resid 154 and name HD1*) ! 0.1980 2284:20 ----- 4.53, 6.67 A or (resid 150 and name HG1) (resid 154 and name HD1*) ! 0.1280 2284:20 ----- 4.88, 6.53 A assign (resid 171 and name HB) (resid 105 and name HG2*) 3.65 1.85 1.85 ! 0.6714 2285:20 Ambig 3.76, 4.93 A or (resid 104 and name HB1) (resid 105 and name HG2*) ! 0.3286 2285:20 ----- 4.23, 5.42 A assign (resid 133 and name HG) (resid 133 and name HD2*) 2.30 0.50 0.50 ! 0.9244 2286:20 Intra 2.43, 2.64 A assign (resid 168 and name HB1) (resid 155 and name HG2*) 2.65 0.85 0.85 ! 0.8343 2287:20 Ambig 2.82, 3.68 A or (resid 156 and name HB1) (resid 133 and name HD2*) ! 0.1394 2287:20 ----- 3.80, 4.84 A assign (resid 106 and name HB*) (resid 105 and name HG1*) 3.65 1.85 1.85 ! 0.8129 2288:20 Ambig 4.09, 6.27 A or (resid 7 and name HB) (resid 105 and name HG1*) ! 0.1569 2288:20 ----- 5.38, 6.55 A assign (resid 84 and name HG2*) (resid 84 and name HB) 2.65 0.85 0.85 ! 0.9961 2290:20 Intra 2.45, 2.66 A assign (resid 121 and name HB*) (resid 121 and name HG1) 2.30 0.50 0.50 ! 0.3606 2292:20 Ambig 2.31, 2.47 A or (resid 131 and name HB2) (resid 131 and name HG*) ! 0.3283 2292:20 ----- 2.34, 2.65 A or (resid 146 and name HB1) (resid 146 and name HG*) ! 0.2886 2292:20 ----- 2.39, 2.70 A assign (resid 172 and name HB2) (resid 172 and name HG*) 2.30 0.50 0.50 ! 0.4843 2293:20 Ambig 2.39, 2.74 A or (resid 121 and name HB*) (resid 121 and name HG2) ! 0.4478 2293:20 ----- 2.42, 2.75 A assign (resid 121 and name HD*) (resid 121 and name HG1) 2.30 0.50 0.50 ! 0.3228 2294:20 Ambig 2.29, 2.67 A or (resid 146 and name HD*) (resid 146 and name HG*) ! 0.3158 2294:20 ----- 2.30, 2.68 A or (resid 99 and name HB*) (resid 99 and name HG1) ! 0.3062 2294:20 ----- 2.31, 2.71 A assign (resid 102 and name HB) (resid 102 and name HG2*) 2.30 0.50 0.50 ! 0.9972 2295:20 Intra 2.42, 2.64 A assign (resid 98 and name HB) (resid 102 and name HG2*) 3.15 1.35 1.35 ! 0.6984 2296:20 Ambig 4.96, 6.06 A or (resid 99 and name HB*) (resid 102 and name HG2*) ! 0.3016 2296:20 ----- 5.71, 7.09 A assign (resid 114 and name HB) (resid 114 and name HG2*) 2.30 0.50 0.50 ! 0.9457 2297:20 Intra 2.41, 2.63 A assign (resid 130 and name HB) (resid 130 and name HG2*) 2.30 0.50 0.50 ! 0.9966 2300:20 Intra 2.39, 2.64 A assign (resid 33 and name HG) (resid 33 and name HD2*) 2.30 0.50 0.50 ! 0.9085 2301:20 Ambig 2.34, 2.62 A or (resid 33 and name HB2) (resid 33 and name HD2*) ! 0.0759 2301:20 ----- 3.53, 3.85 A assign (resid 140 and name HG) (resid 140 and name HD2*) 2.65 0.85 0.85 ! 0.0000 2302:20 Intra 2.39, 2.63 A assign (resid 33 and name HB2) (resid 23 and name HG2*) 2.30 0.50 0.50 ! 0.5446 2303:20 Ambig 2.31, 3.36 A or (resid 23 and name HB) (resid 23 and name HG2*) ! 0.4407 2303:20 ----- 2.39, 2.63 A assign (resid 169 and name HG2*) (resid 140 and name HD2*) 2.30 0.50 0.50 ! 0.7175 2304:20 Ambig 2.12, 3.75 A or (resid 136 and name HB2) (resid 140 and name HD2*) ! 0.2527 2304:20 ----- 2.52, 4.24 A assign (resid 150 and name HG2) (resid 154 and name HD1*) 3.65 1.85 1.85 ! 0.0000 2306:20 Mid 5.11, 6.69 A assign (resid 105 and name HB) (resid 105 and name HG2*) 2.65 0.85 0.85 ! 0.9949 2307:20 Intra 2.42, 2.63 A assign (resid 154 and name HG) (resid 154 and name HD1*) 2.65 0.85 0.85 ! 0.8127 2308:20 Ambig 2.38, 2.63 A or (resid 86 and name HB1) (resid 154 and name HD1*) ! 0.1873 2308:20 ----- 3.04, 4.89 A assign (resid 108 and name HB*) (resid 105 and name HG2*) 3.15 1.35 1.35 ! 0.0000 2309:20 Mid 4.15, 5.94 A assign (resid 169 and name HB) (resid 155 and name HG2*) 3.15 1.35 1.35 ! 0.4714 2310:20 Ambig 4.48, 5.45 A or (resid 169 and name HB) (resid 133 and name HD2*) ! 0.4531 2310:20 ----- 4.51, 5.20 A assign (resid 109 and name HB2) (resid 105 and name HG1*) 3.15 1.35 1.35 ! 0.6463 2311:20 Ambig 4.22, 5.47 A or (resid 109 and name HG) (resid 105 and name HG1*) ! 0.3537 2311:20 ----- 4.67, 5.53 A assign (resid 105 and name HB) (resid 105 and name HG1*) 2.65 0.85 0.85 ! 0.0000 2312:20 Intra 2.43, 2.65 A assign (resid 108 and name HB*) (resid 105 and name HG1*) 3.15 1.35 1.35 ! 0.0000 2313:20 Mid 3.44, 5.50 A assign (resid 33 and name HD2*) (resid 169 and name HG1*) 3.15 1.35 1.35 ! 0.4482 2315:20 Ambig 4.13, 5.84 A or (resid 23 and name HG2*) (resid 169 and name HG1*) ! 0.2502 2315:20 ----- 4.56, 6.65 A or (resid 136 and name HD*) (resid 169 and name HG1*) ! 0.2463 2315:20 ----- 4.57, 7.26 A assign (resid 133 and name HD2*) (resid 169 and name HG1*) 2.65 0.85 0.85 ! 0.9755 2316:20 Long 2.44, 3.53 A assign (resid 20 and name HG12) (resid 36 and name HG1*) 3.65 1.85 1.85 ! 0.0000 2319:20 Long 2.93, 5.34 A assign (resid 171 and name HG2*) (resid 33 and name HD2*) 2.30 0.50 0.50 ! 0.0000 2320:20 Long 2.46, 3.79 A assign (resid 169 and name HG1*) (resid 23 and name HG2*) 3.15 1.35 1.35 ! 0.0000 2321:20 Long 4.56, 6.65 A assign (resid 75 and name HG1*) (resid 14 and name HG2*) 3.15 1.35 1.35 ! 0.0000 2322:20 Long 2.11, 4.25 A assign (resid 109 and name HD1*) (resid 105 and name HG1*) 2.30 0.50 0.50 ! 0.9531 2324:20 Mid 2.14, 3.44 A assign (resid 109 and name HD2*) (resid 105 and name HG1*) 2.65 0.85 0.85 ! 0.0000 2325:20 Mid 2.98, 5.21 A assign (resid 23 and name HG1*) (resid 169 and name HG1*) 3.65 1.85 1.85 ! 0.0000 2326:20 Long 6.07, 7.90 A assign (resid 20 and name HG2*) (resid 36 and name HG1*) 3.65 1.85 1.85 ! 0.5357 2327:20 Ambig 4.61, 7.32 A or (resid 20 and name HD1*) (resid 36 and name HG1*) ! 0.4643 2327:20 ----- 4.72, 7.56 A assign (resid 14 and name HG1*) (resid 36 and name HG1*) 3.65 1.85 1.85 ! 0.0000 2328:20 Long 4.21, 6.71 A assign (resid 20 and name HG2*) (resid 36 and name HG2*) 3.65 1.85 1.85 ! 0.6510 2330:20 Ambig 3.58, 5.97 A or (resid 20 and name HD1*) (resid 36 and name HG2*) ! 0.3490 2330:20 ----- 3.97, 6.76 A assign (resid 20 and name HD1*) (resid 14 and name HG2*) 3.65 1.85 1.85 ! 0.9869 2331:20 Long 2.05, 4.66 A assign (resid 20 and name HD1*) (resid 14 and name HG2*) 3.65 1.85 1.85 ! 0.0000 2332:20 Long 2.05, 4.66 A assign (resid 132 and name HE1) (resid 30 and name HG1*) 3.65 1.85 1.85 ! 0.0000 2337:20 Long 4.25, 5.83 A assign (resid 132 and name HE1) (resid 23 and name HG1*) 3.65 1.85 1.85 ! 0.0000 2339:20 Long 2.48, 3.38 A assign (resid 9 and name HN) (resid 152 and name HB*) 3.15 1.35 1.35 ! 0.0000 2340:20 Long 3.06, 4.47 A assign (resid 8 and name HN) (resid 152 and name HB*) 3.65 1.85 1.85 ! 0.0000 2341:20 Long 5.14, 6.38 A assign (resid 117 and name HN) (resid 115 and name HB*) 3.15 1.35 1.35 ! 0.0000 2342:20 Mid 3.06, 4.12 A assign (resid 117 and name HN) (resid 116 and name HG1*) 3.65 1.85 1.85 ! 0.0000 2343:20 Seq 3.24, 4.32 A assign (resid 176 and name HN) (resid 7 and name HG2*) 2.65 0.85 0.85 ! 0.0000 2344:20 Long 2.70, 3.74 A assign (resid 5 and name HN) (resid 177 and name HG2*) 3.65 1.85 1.85 ! 0.0000 2345:20 Long 4.41, 5.95 A assign (resid 74 and name HN) (resid 41 and name HG1*) 3.65 1.85 1.85 ! 0.0000 2346:20 Long 3.28, 4.52 A assign (resid 41 and name HN) (resid 41 and name HG1*) 3.15 1.35 1.35 ! 0.0000 2347:20 Intra 2.77, 3.78 A assign (resid 8 and name HN) (resid 7 and name HG1*) 3.15 1.35 1.35 ! 0.5588 2348:20 Ambig 4.01, 4.79 A or (resid 105 and name HN) (resid 7 and name HG1*) ! 0.4412 2348:20 ----- 4.17, 5.41 A assign (resid 74 and name HN) (resid 75 and name HG1*) 4.15 2.35 2.35 ! 0.0000 2349:20 Seq 7.04, 7.33 A assign (resid 153 and name HN) (resid 152 and name HB*) 3.15 1.35 1.35 ! 0.0000 2352:20 Seq 3.39, 4.13 A assign (resid 151 and name HN) (resid 152 and name HB*) 3.65 1.85 1.85 ! 0.5684 2353:20 Ambig 4.31, 5.15 A or (resid 10 and name HN) (resid 152 and name HB*) ! 0.2983 2353:20 ----- 4.80, 6.08 A or (resid 11 and name HN) (resid 152 and name HB*) ! 0.1333 2353:20 ----- 5.49, 6.87 A assign (resid 160 and name HN) (resid 163 and name HB*) 3.15 1.35 1.35 ! 0.0000 2354:20 Mid 2.46, 3.56 A assign (resid 85 and name HN) (resid 84 and name HG2*) 2.65 0.85 0.85 ! 0.0000 2355:20 Seq 2.65, 3.53 A assign (resid 84 and name HN) (resid 84 and name HG2*) 3.65 1.85 1.85 ! 0.0000 2356:20 Intra 4.36, 4.55 A assign (resid 116 and name HN) (resid 115 and name HB*) 2.30 0.50 0.50 ! 0.5404 2359:20 Ambig 2.30, 3.45 A or (resid 115 and name HN) (resid 115 and name HB*) ! 0.4586 2359:20 ----- 2.36, 2.87 A assign (resid 42 and name HN) (resid 42 and name HB*) 2.65 0.85 0.85 ! 0.6451 2360:20 Ambig 2.38, 2.91 A or (resid 44 and name HN) (resid 42 and name HB*) ! 0.3549 2360:20 ----- 2.63, 5.39 A assign (resid 43 and name HN) (resid 42 and name HB*) 3.15 1.35 1.35 ! 0.9866 2361:20 Seq 2.79, 3.93 A assign (resid 116 and name HN) (resid 116 and name HG2*) 2.65 0.85 0.85 ! 0.6050 2362:20 Ambig 1.94, 2.94 A or (resid 115 and name HN) (resid 114 and name HG1*) ! 0.3914 2362:20 ----- 2.09, 2.95 A assign (resid 70 and name HN) (resid 69 and name HG2*) 3.65 1.85 1.85 ! 0.6708 2363:20 Ambig 2.29, 4.35 A or (resid 13 and name HN) (resid 13 and name HG1*) ! 0.3130 2363:20 ----- 2.60, 3.65 A assign (resid 171 and name HN) (resid 171 and name HG2*) 2.65 0.85 0.85 ! 0.0000 2364:20 Intra 2.22, 3.24 A assign (resid 158 and name HN) (resid 167 and name HG2*) 3.65 1.85 1.85 ! 0.8077 2365:20 Ambig 4.32, 5.28 A or (resid 161 and name HN) (resid 167 and name HG2*) ! 0.1038 2365:20 ----- 6.08, 7.65 A or (resid 170 and name HN) (resid 167 and name HG2*) ! 0.0885 2365:20 ----- 6.25, 7.78 A assign (resid 120 and name HN) (resid 116 and name HG1*) 3.15 1.35 1.35 ! 0.5918 2366:20 Ambig 4.18, 5.23 A or (resid 116 and name HN) (resid 116 and name HG1*) ! 0.4082 2366:20 ----- 4.44, 4.56 A assign (resid 85 and name HN) (resid 85 and name HB*) 3.15 1.35 1.35 ! 0.0000 2368:20 Intra 2.40, 2.92 A assign (resid 86 and name HN) (resid 85 and name HB*) 2.65 0.85 0.85 ! 0.0000 2369:20 Seq 2.69, 3.69 A assign (resid 109 and name HN) (resid 109 and name HD1*) 2.65 0.85 0.85 ! 0.9411 2370:20 Intra 2.51, 3.15 A assign (resid 130 and name HN) (resid 130 and name HG1*) 3.15 1.35 1.35 ! 0.5041 2371:20 Ambig 4.38, 4.54 A or (resid 130 and name HN) (resid 102 and name HG1*) ! 0.3261 2371:20 ----- 4.71, 6.18 A or (resid 104 and name HN) (resid 102 and name HG1*) ! 0.1084 2371:20 ----- 5.66, 6.55 A assign (resid 13 and name HN) (resid 13 and name HG2*) 2.65 0.85 0.85 ! 0.9483 2373:20 Intra 2.03, 2.97 A assign (resid 179 and name HN) (resid 178 and name HG1*) 3.15 1.35 1.35 ! 0.9974 2374:20 Seq 2.52, 3.47 A assign (resid 72 and name HN) (resid 43 and name HG2*) 2.65 0.85 0.85 ! 0.9630 2375:20 Long 2.18, 3.71 A assign (resid 178 and name HN) (resid 177 and name HG2*) 3.15 1.35 1.35 ! 0.8394 2376:20 Ambig 4.57, 5.21 A or (resid 3 and name HN) (resid 177 and name HG2*) ! 0.1606 2376:20 ----- 6.01, 7.09 A assign (resid 177 and name HN) (resid 177 and name HG2*) 2.65 0.85 0.85 ! 0.9996 2377:20 Intra 1.97, 3.05 A assign (resid 30 and name HN) (resid 30 and name HG2*) 3.15 1.35 1.35 ! 0.0000 2378:20 Intra 2.31, 3.31 A assign (resid 42 and name HN) (resid 41 and name HG1*) 3.15 1.35 1.35 ! 0.0000 2380:20 Seq 3.86, 4.61 A assign (resid 178 and name HN) (resid 177 and name HG1*) 2.65 0.85 0.85 ! 0.8091 2381:20 Ambig 3.05, 4.01 A or (resid 3 and name HN) (resid 177 and name HG1*) ! 0.1812 2381:20 ----- 3.91, 4.88 A assign (resid 179 and name HN) (resid 177 and name HG1*) 3.15 1.35 1.35 ! 0.6342 2382:20 Ambig 4.01, 5.66 A or (resid 177 and name HN) (resid 177 and name HG1*) ! 0.3658 2382:20 ----- 4.40, 4.55 A assign (resid 30 and name HN) (resid 30 and name HG1*) 3.15 1.35 1.35 ! 0.0000 2384:20 Intra 4.33, 4.58 A assign (resid 30 and name HN) (resid 23 and name HG1*) 3.65 1.85 1.85 ! 0.0000 2385:20 Long 3.05, 4.27 A assign (resid 24 and name HN) (resid 23 and name HG1*) 2.65 0.85 0.85 ! 0.9937 2386:20 Seq 2.95, 3.84 A assign (resid 149 and name HD21) (resid 152 and name HB*) 3.65 1.85 1.85 ! 0.9822 2387:20 Mid 2.39, 4.74 A assign (resid 163 and name HN) (resid 163 and name HB*) 2.65 0.85 0.85 ! 0.9208 2388:20 Intra 2.36, 2.98 A assign (resid 119 and name HN) (resid 115 and name HB*) 3.65 1.85 1.85 ! 0.0000 2391:20 Mid 4.39, 5.23 A assign (resid 118 and name HN) (resid 115 and name HB*) 2.65 0.85 0.85 ! 0.9947 2393:20 Mid 2.80, 3.89 A assign (resid 118 and name HN) (resid 114 and name HG1*) 2.65 0.85 0.85 ! 0.5609 2394:20 Ambig 3.92, 5.08 A or (resid 114 and name HN) (resid 114 and name HG1*) ! 0.2921 2394:20 ----- 4.37, 4.56 A or (resid 122 and name HN) (resid 114 and name HG1*) ! 0.0978 2394:20 ----- 5.25, 6.82 A assign (resid 4 and name HN) (resid 3 and name HG2*) 3.15 1.35 1.35 ! 0.0000 2395:20 Seq 2.24, 3.17 A assign (resid 4 and name HN) (resid 3 and name HG1*) 2.65 0.85 0.85 ! 0.6280 2398:20 Ambig 3.63, 4.66 A or (resid 4 and name HN) (resid 13 and name HG2*) ! 0.3483 2398:20 ----- 4.00, 4.87 A assign (resid 7 and name HN) (resid 7 and name HG2*) 2.30 0.50 0.50 ! 0.9696 2399:20 Intra 1.98, 3.09 A assign (resid 28 and name HN) (resid 30 and name HG2*) 4.15 2.35 2.35 ! 0.6619 2400:20 Ambig 5.51, 6.46 A or (resid 132 and name HN) (resid 30 and name HG2*) ! 0.3381 2400:20 ----- 6.16, 7.45 A assign (resid 74 and name HD21) (resid 41 and name HG1*) 3.15 1.35 1.35 ! 0.0000 2402:20 Long 3.02, 4.86 A assign (resid 108 and name HN) (resid 7 and name HG1*) 3.15 1.35 1.35 ! 0.7521 2403:20 Ambig 3.49, 4.87 A or (resid 7 and name HN) (resid 7 and name HG1*) ! 0.2013 2403:20 ----- 4.35, 4.57 A assign (resid 76 and name HN) (resid 75 and name HG1*) 3.15 1.35 1.35 ! 0.8143 2404:20 Ambig 3.47, 4.49 A or (resid 73 and name HD21) (resid 75 and name HG1*) ! 0.1645 2404:20 ----- 4.52, 5.50 A assign (resid 132 and name HN) (resid 30 and name HG1*) 4.15 2.35 2.35 ! 0.0000 2405:20 Long 4.44, 5.37 A assign (resid 152 and name HN) (resid 152 and name HB*) 3.15 1.35 1.35 ! 0.8942 2407:20 Ambig 2.66, 3.34 A or (resid 149 and name HD22) (resid 152 and name HB*) ! 0.1058 2407:20 ----- 3.80, 5.91 A assign (resid 129 and name HD*) (resid 171 and name HG2*) 3.15 1.35 1.35 ! 0.9063 2409:20 Ambig 3.94, 5.58 A or (resid 175 and name HN) (resid 171 and name HG2*) ! 0.0937 2409:20 ----- 5.75, 6.35 A assign (resid 14 and name HN) (resid 3 and name HG2*) 2.65 0.85 0.85 ! 0.0000 2410:20 Long 3.23, 4.04 A assign (resid 129 and name HD*) (resid 102 and name HG1*) 3.15 1.35 1.35 ! 0.5724 2413:20 Ambig 3.85, 7.42 A or (resid 97 and name HE3) (resid 98 and name HG1*) ! 0.2605 2413:20 ----- 4.39, 5.24 A or (resid 175 and name HN) (resid 7 and name HG2*) ! 0.1566 2413:20 ----- 4.78, 5.39 A assign (resid 129 and name HD*) (resid 109 and name HD1*) 3.15 1.35 1.35 ! 0.0000 2414:20 Long 3.67, 6.23 A assign (resid 99 and name HN) (resid 98 and name HG1*) 2.65 0.85 0.85 ! 0.4319 2415:20 Ambig 3.49, 4.32 A or (resid 131 and name HN) (resid 130 and name HG1*) ! 0.3693 2415:20 ----- 3.58, 4.35 A or (resid 97 and name HZ3) (resid 98 and name HG1*) ! 0.1715 2415:20 ----- 4.07, 5.53 A assign (resid 4 and name HD*) (resid 177 and name HG2*) 3.15 1.35 1.35 ! 0.0000 2416:20 Long 2.16, 5.05 A assign (resid 132 and name HD1) (resid 30 and name HG2*) 3.15 1.35 1.35 ! 0.0000 2417:20 Long 2.73, 4.34 A assign (resid 74 and name HD21) (resid 41 and name HG1*) 3.65 1.85 1.85 ! 0.0000 2418:20 Long 3.02, 4.86 A assign (resid 132 and name HD1) (resid 23 and name HG1*) 3.65 1.85 1.85 ! 0.0000 2419:20 Long 3.82, 4.90 A assign (resid 132 and name HZ2) (resid 23 and name HG1*) 3.15 1.35 1.35 ! 0.9962 2420:20 Long 2.36, 3.31 A assign (resid 4 and name HE*) (resid 177 and name HG2*) 3.15 1.35 1.35 ! 0.0000 2422:20 Long 2.33, 4.59 A assign (resid 132 and name HH2) (resid 23 and name HG1*) 3.65 1.85 1.85 ! 0.0000 2424:20 Long 3.69, 4.76 A assign (resid 33 and name HA) (resid 23 and name HG1*) 4.15 2.35 2.35 ! 0.0000 2425:20 Long 6.27, 7.42 A assign (resid 21 and name HA) (resid 21 and name HB) 2.65 0.85 0.85 ! 0.9942 2427:20 Intra 2.52, 2.59 A assign (resid 4 and name HA) (resid 177 and name HG1*) 3.15 1.35 1.35 ! 0.6655 2428:20 Ambig 3.40, 5.15 A or (resid 2 and name HA) (resid 177 and name HG1*) ! 0.1632 2428:20 ----- 4.29, 5.19 A or (resid 179 and name HA) (resid 177 and name HG1*) ! 0.1533 2428:20 ----- 4.34, 5.65 A assign (resid 24 and name HA) (resid 30 and name HG1*) 4.15 2.35 2.35 ! 0.0000 2430:20 Long 6.75, 7.46 A assign (resid 24 and name HA) (resid 23 and name HG1*) 3.65 1.85 1.85 ! 0.0000 2431:20 Seq 3.62, 4.76 A assign (resid 8 and name HA) (resid 152 and name HB*) 3.15 1.35 1.35 ! 0.0000 2435:20 Long 4.16, 5.38 A assign (resid 9 and name HA) (resid 152 and name HB*) 3.15 1.35 1.35 ! 0.9994 2437:20 Long 1.90, 2.99 A assign (resid 163 and name HA) (resid 163 and name HB*) 2.65 0.85 0.85 ! 0.0000 2439:20 Intra 2.43, 2.64 A assign (resid 115 and name HA) (resid 115 and name HB*) 2.65 0.85 0.85 ! 0.0000 2443:20 Intra 2.41, 2.63 A assign (resid 114 and name HA) (resid 115 and name HB*) 3.15 1.35 1.35 ! 0.0000 2444:20 Seq 4.40, 5.10 A assign (resid 117 and name HA) (resid 116 and name HG2*) 3.65 1.85 1.85 ! 0.0000 2446:20 Seq 6.28, 6.51 A assign (resid 171 and name HA) (resid 171 and name HG2*) 3.15 1.35 1.35 ! 0.0000 2449:20 Intra 2.56, 3.19 A assign (resid 178 and name HA) (resid 178 and name HG1*) 2.65 0.85 0.85 ! 0.9889 2450:20 Intra 2.47, 3.14 A assign (resid 7 and name HA) (resid 7 and name HG2*) 2.30 0.50 0.50 ! 0.7470 2452:20 Ambig 2.49, 3.15 A or (resid 131 and name HA) (resid 130 and name HG1*) ! 0.1086 2452:20 ----- 3.44, 4.67 A or (resid 103 and name HA) (resid 102 and name HG1*) ! 0.0900 2452:20 ----- 3.55, 4.80 A assign (resid 177 and name HA) (resid 177 and name HG2*) 2.65 0.85 0.85 ! 0.0000 2453:20 Intra 2.59, 3.22 A assign (resid 30 and name HA) (resid 30 and name HG2*) 2.65 0.85 0.85 ! 0.0000 2455:20 Intra 2.51, 3.18 A assign (resid 7 and name HA) (resid 7 and name HG1*) 2.65 0.85 0.85 ! 0.9916 2456:20 Intra 2.48, 3.13 A assign (resid 177 and name HA) (resid 177 and name HG1*) 2.65 0.85 0.85 ! 0.0000 2458:20 Intra 2.46, 3.10 A assign (resid 22 and name HD*) (resid 21 and name HB) 2.30 0.50 0.50 ! 0.0000 2461:20 Seq 2.15, 3.18 A assign (resid 149 and name HB2) (resid 152 and name HB*) 3.65 1.85 1.85 ! 0.0000 2462:20 Mid 2.13, 3.64 A assign (resid 9 and name HB2) (resid 152 and name HB*) 3.15 1.35 1.35 ! 0.8136 2463:20 Ambig 3.38, 4.33 A or (resid 153 and name HA1) (resid 152 and name HB*) ! 0.1513 2463:20 ----- 4.47, 5.01 A assign (resid 84 and name HB) (resid 84 and name HG2*) 2.65 0.85 0.85 ! 0.0000 2464:20 Intra 2.45, 2.66 A assign (resid 116 and name HA) (resid 116 and name HG1*) 3.15 1.35 1.35 ! 0.9963 2465:20 Intra 2.53, 3.16 A assign (resid 130 and name HA) (resid 130 and name HG1*) 2.30 0.50 0.50 ! 0.9164 2466:20 Ambig 2.47, 3.11 A or (resid 130 and name HA) (resid 102 and name HG1*) ! 0.0301 2466:20 ----- 4.37, 6.03 A assign (resid 106 and name HD*) (resid 102 and name HG1*) 2.30 0.50 0.50 ! 0.6485 2467:20 Ambig 2.26, 5.17 A or (resid 102 and name HA) (resid 102 and name HG1*) ! 0.3254 2467:20 ----- 2.54, 3.17 A assign (resid 31 and name HD1) (resid 30 and name HG2*) 3.15 1.35 1.35 ! 0.0000 2468:20 Seq 4.61, 5.43 A assign (resid 132 and name HB1) (resid 30 and name HG2*) 3.65 1.85 1.85 ! 0.0000 2469:20 Long 5.02, 6.27 A assign (resid 74 and name HB2) (resid 41 and name HG1*) 2.65 0.85 0.85 ! 0.0000 2470:20 Long 3.02, 4.09 A assign (resid 31 and name HD1) (resid 30 and name HG1*) 3.15 1.35 1.35 ! 0.0000 2472:20 Seq 4.02, 4.72 A assign (resid 23 and name HA) (resid 23 and name HG1*) 2.65 0.85 0.85 ! 0.9728 2473:20 Intra 2.47, 3.11 A assign (resid 8 and name HB) (resid 152 and name HB*) 3.15 1.35 1.35 ! 0.9321 2475:20 Long 3.05, 4.29 A assign (resid 149 and name HB1) (resid 152 and name HB*) 3.15 1.35 1.35 ! 0.9108 2476:20 Ambig 2.40, 4.75 A or (resid 151 and name HB1) (resid 152 and name HB*) ! 0.0781 2476:20 ----- 3.61, 4.87 A assign (resid 28 and name HG1) (resid 30 and name HG2*) 3.15 1.35 1.35 ! 0.8432 2480:20 Ambig 3.56, 4.72 A or (resid 136 and name HE2) (resid 30 and name HG2*) ! 0.0997 2480:20 ----- 5.08, 6.83 A assign (resid 74 and name HB1) (resid 41 and name HG1*) 3.15 1.35 1.35 ! 0.9987 2481:20 Long 2.07, 2.93 A assign (resid 41 and name HB) (resid 41 and name HG1*) 2.30 0.50 0.50 ! 0.0000 2482:20 Intra 2.38, 2.63 A assign (resid 25 and name HG*) (resid 30 and name HG1*) 3.15 1.35 1.35 ! 0.7112 2483:20 Ambig 4.19, 6.31 A or (resid 31 and name HB1) (resid 30 and name HG1*) ! 0.1119 2483:20 ----- 5.70, 6.57 A or (resid 125 and name HG2) (resid 30 and name HG1*) ! 0.0985 2483:20 ----- 5.83, 7.53 A assign (resid 35 and name HB2) (resid 23 and name HG1*) 3.65 1.85 1.85 ! 0.0000 2484:20 Long 2.60, 4.33 A assign (resid 24 and name HG1) (resid 23 and name HG1*) 3.65 1.85 1.85 ! 0.0000 2485:20 Seq 5.40, 6.30 A assign (resid 35 and name HB1) (resid 21 and name HB) 3.15 1.35 1.35 ! 0.5151 2486:20 Ambig 3.48, 4.51 A or (resid 22 and name HG2) (resid 21 and name HB) ! 0.3950 2486:20 ----- 3.63, 4.04 A or (resid 22 and name HG1) (resid 21 and name HB) ! 0.0900 2486:20 ----- 4.65, 5.04 A assign (resid 167 and name HG2*) (resid 167 and name HB) 2.30 0.50 0.50 ! 0.5198 2488:20 Ambig 2.40, 2.65 A or (resid 69 and name HG2*) (resid 69 and name HB) ! 0.4802 2488:20 ----- 2.43, 2.65 A assign (resid 70 and name HB2) (resid 69 and name HG2*) 4.15 2.35 2.35 ! 0.6503 2490:20 Ambig 3.70, 6.41 A or (resid 43 and name HB) (resid 69 and name HG2*) ! 0.2517 2490:20 ----- 4.33, 7.53 A or (resid 12 and name HB1) (resid 13 and name HG1*) ! 0.0601 2490:20 ----- 5.50, 6.50 A assign (resid 109 and name HG) (resid 109 and name HD1*) 2.30 0.50 0.50 ! 0.5122 2492:20 Ambig 2.39, 2.62 A or (resid 178 and name HB) (resid 178 and name HG1*) ! 0.4878 2492:20 ----- 2.41, 2.63 A assign (resid 43 and name HB) (resid 43 and name HG1*) 2.30 0.50 0.50 ! 0.5164 2493:20 Ambig 2.38, 2.63 A or (resid 43 and name HB) (resid 43 and name HG2*) ! 0.4836 2493:20 ----- 2.41, 2.64 A assign (resid 177 and name HB) (resid 177 and name HG2*) 2.30 0.50 0.50 ! 0.9790 2494:20 Intra 2.42, 2.64 A assign (resid 25 and name HB*) (resid 30 and name HG2*) 3.15 1.35 1.35 ! 0.9895 2495:20 Long 2.27, 3.86 A assign (resid 30 and name HB) (resid 30 and name HG2*) 2.30 0.50 0.50 ! 0.6226 2496:20 Ambig 2.43, 2.64 A or (resid 23 and name HB) (resid 30 and name HG2*) ! 0.3661 2496:20 ----- 2.65, 3.90 A assign (resid 75 and name HB) (resid 75 and name HG1*) 2.30 0.50 0.50 ! 0.4382 2497:20 Ambig 2.38, 2.63 A or (resid 18 and name HB1) (resid 75 and name HG1*) ! 0.3286 2497:20 ----- 2.50, 4.27 A or (resid 14 and name HB) (resid 75 and name HG1*) ! 0.2283 2497:20 ----- 2.66, 4.27 A assign (resid 177 and name HB) (resid 177 and name HG1*) 2.30 0.50 0.50 ! 0.9145 2498:20 Ambig 2.40, 2.63 A or (resid 179 and name HB1) (resid 177 and name HG1*) ! 0.0835 2498:20 ----- 3.58, 5.79 A assign (resid 128 and name HG2*) (resid 30 and name HG1*) 2.30 0.50 0.50 ! 0.6089 2500:20 Ambig 2.17, 3.26 A or (resid 30 and name HB) (resid 30 and name HG1*) ! 0.3350 2500:20 ----- 2.40, 2.62 A assign (resid 25 and name HB*) (resid 23 and name HG1*) 3.15 1.35 1.35 ! 0.5721 2501:20 Ambig 2.86, 4.92 A or (resid 35 and name HB1) (resid 23 and name HG1*) ! 0.3242 2501:20 ----- 3.15, 5.21 A or (resid 136 and name HE1) (resid 23 and name HG1*) ! 0.0809 2501:20 ----- 3.97, 5.05 A assign (resid 30 and name HB) (resid 23 and name HG1*) 2.30 0.50 0.50 ! 0.5150 2502:20 Ambig 2.33, 3.35 A or (resid 23 and name HB) (resid 23 and name HG1*) ! 0.4819 2502:20 ----- 2.36, 2.63 A assign (resid 21 and name HG2*) (resid 21 and name HB) 2.65 0.85 0.85 ! 0.0000 2505:20 Intra 2.44, 2.65 A assign (resid 8 and name HG2*) (resid 152 and name HB*) 2.65 0.85 0.85 ! 0.0000 2507:20 Long 2.29, 4.02 A assign (resid 33 and name HD2*) (resid 171 and name HG2*) 3.15 1.35 1.35 ! 0.9780 2508:20 Long 2.46, 3.79 A assign (resid 30 and name HG1*) (resid 23 and name HG1*) 2.65 0.85 0.85 ! 0.5690 2510:20 Ambig 3.32, 5.30 A or (resid 33 and name HD1*) (resid 23 and name HG1*) ! 0.4310 2510:20 ----- 3.48, 5.95 A assign (resid 23 and name HN) (resid 22 and name HA) 2.65 0.85 0.85 ! 0.9980 2513:20 Seq 2.23, 2.34 A assign (resid 34 and name HA) (resid 22 and name HA) 3.15 1.35 1.35 ! 0.9825 2514:20 Long 2.27, 2.65 A assign (resid 22 and name HB2) (resid 22 and name HA) 2.65 0.85 0.85 ! 0.0000 2515:20 Intra 2.71, 2.73 A assign (resid 22 and name HB1) (resid 22 and name HA) 3.15 1.35 1.35 ! 0.9974 2516:20 Intra 2.29, 2.32 A assign (resid 33 and name HB2) (resid 22 and name HA) 4.15 2.35 2.35 ! 0.0000 2517:20 Long 5.78, 6.08 A assign (resid 23 and name HG2*) (resid 22 and name HA) 3.15 1.35 1.35 ! 0.0000 2518:20 Seq 3.72, 4.84 A assign (resid 22 and name HG2) (resid 22 and name HA) 2.65 0.85 0.85 ! 0.3795 2519:20 Ambig 3.83, 3.87 A or (resid 22 and name HG1) (resid 22 and name HA) ! 0.2992 2519:20 ----- 3.99, 4.03 A or (resid 35 and name HB1) (resid 22 and name HA) ! 0.2314 2519:20 ----- 4.16, 5.05 A or (resid 172 and name HB2) (resid 22 and name HA) ! 0.0772 2519:20 ----- 5.00, 5.50 A assign (resid 122 and name HD*) (resid 122 and name HA) 2.65 0.85 0.85 ! 0.0000 2522:20 Intra 2.08, 3.42 A assign (resid 4 and name HN) (resid 3 and name HA) 2.65 0.85 0.85 ! 0.0000 2523:20 Seq 2.08, 2.16 A assign (resid 15 and name HA) (resid 3 and name HA) 2.65 0.85 0.85 ! 0.0000 2524:20 Long 2.01, 2.13 A assign (resid 16 and name HN) (resid 3 and name HA) 3.15 1.35 1.35 ! 0.0000 2525:20 Long 3.11, 3.54 A assign (resid 4 and name HD*) (resid 3 and name HA) 3.65 1.85 1.85 ! 0.0000 2526:20 Seq 3.07, 4.99 A assign (resid 125 and name HN) (resid 122 and name HA) 3.15 1.35 1.35 ! 0.5223 2527:20 Ambig 3.22, 3.51 A or (resid 123 and name HN) (resid 122 and name HA) ! 0.3200 2527:20 ----- 3.50, 3.53 A or (resid 124 and name HN) (resid 122 and name HA) ! 0.1577 2527:20 ----- 3.94, 4.09 A assign (resid 122 and name HB2) (resid 122 and name HA) 2.30 0.50 0.50 ! 0.0000 2528:20 Intra 2.58, 2.62 A assign (resid 125 and name HG2) (resid 122 and name HA) 3.65 1.85 1.85 ! 0.4653 2529:20 Ambig 4.18, 4.53 A or (resid 125 and name HB1) (resid 122 and name HA) ! 0.4621 2529:20 ----- 4.19, 4.47 A assign (resid 143 and name HN) (resid 142 and name HA) 2.30 0.50 0.50 ! 0.5078 2532:20 Ambig 2.02, 2.15 A or (resid 144 and name HN) (resid 143 and name HA) ! 0.4346 2532:20 ----- 2.07, 2.28 A assign (resid 86 and name HN) (resid 143 and name HA) 3.15 1.35 1.35 ! 0.8703 2533:20 Ambig 2.81, 3.08 A or (resid 141 and name HN) (resid 142 and name HA) ! 0.0828 2533:20 ----- 4.16, 4.58 A assign (resid 142 and name HN) (resid 142 and name HA) 3.65 1.85 1.85 ! 0.9041 2534:20 Ambig 2.90, 2.91 A or (resid 142 and name HN) (resid 143 and name HA) ! 0.0441 2534:20 ----- 4.79, 4.98 A assign (resid 142 and name HD*) (resid 142 and name HA) 3.65 1.85 1.85 ! 0.9790 2535:20 Intra 2.39, 3.47 A assign (resid 143 and name HD*) (resid 143 and name HA) 3.15 1.35 1.35 ! 0.6186 2536:20 Ambig 2.91, 3.49 A or (resid 143 and name HD*) (resid 142 and name HA) ! 0.3814 2536:20 ----- 3.16, 5.06 A assign (resid 156 and name HA) (resid 142 and name HA) 3.15 1.35 1.35 ! 0.9820 2537:20 Long 2.83, 3.05 A assign (resid 85 and name HA) (resid 143 and name HA) 3.15 1.35 1.35 ! 0.9940 2538:20 Long 2.29, 2.62 A assign (resid 166 and name HA) (resid 165 and name HA) 3.15 1.35 1.35 ! 0.5184 2539:20 Ambig 4.35, 4.46 A or (resid 164 and name HB2) (resid 165 and name HA) ! 0.4816 2539:20 ----- 4.41, 4.88 A assign (resid 142 and name HB1) (resid 142 and name HA) 2.30 0.50 0.50 ! 0.7650 2540:20 Ambig 2.37, 2.44 A or (resid 143 and name HB2) (resid 143 and name HA) ! 0.1858 2540:20 ----- 3.00, 3.02 A assign (resid 85 and name HB*) (resid 143 and name HA) 3.15 1.35 1.35 ! 0.8974 2541:20 Ambig 4.32, 5.13 A or (resid 85 and name HB*) (resid 142 and name HA) ! 0.1026 2541:20 ----- 6.20, 7.51 A assign (resid 86 and name HG1) (resid 143 and name HA) 4.15 2.35 2.35 ! 0.9257 2542:20 Long 3.61, 4.59 A assign (resid 155 and name HG2*) (resid 142 and name HA) 3.65 1.85 1.85 ! 0.7381 2543:20 Ambig 4.47, 5.67 A or (resid 155 and name HG2*) (resid 143 and name HA) ! 0.2619 2543:20 ----- 5.31, 6.20 A assign (resid 84 and name HN) (resid 143 and name HA) 3.65 1.85 1.85 ! 0.5968 2544:20 Ambig 4.26, 4.45 A or (resid 155 and name HN) (resid 143 and name HA) ! 0.3598 2544:20 ----- 4.64, 4.75 A assign (resid 20 and name HG2*) (resid 34 and name HA) 3.65 1.85 1.85 ! 0.0000 2545:20 Long 5.01, 5.99 A assign (resid 164 and name HB1) (resid 164 and name HA) 2.30 0.50 0.50 ! 0.9965 2550:20 Intra 2.42, 2.53 A assign (resid 97 and name HE1) (resid 151 and name HA) 3.15 1.35 1.35 ! 0.0000 2553:20 Long 2.83, 3.61 A assign (resid 16 and name HN) (resid 16 and name HA) 3.15 1.35 1.35 ! 0.8442 2554:20 Ambig 2.69, 2.83 A or (resid 2 and name HN) (resid 16 and name HA) ! 0.1558 2554:20 ----- 3.57, 4.93 A assign (resid 139 and name HN) (resid 139 and name HA) 2.65 0.85 0.85 ! 0.9393 2555:20 Intra 2.93, 2.94 A assign (resid 145 and name HN) (resid 144 and name HA) 3.15 1.35 1.35 ! 0.9991 2556:20 Seq 2.25, 2.33 A assign (resid 16 and name HB2) (resid 16 and name HA) 2.65 0.85 0.85 ! 0.0000 2557:20 Intra 2.36, 2.44 A assign (resid 18 and name HN) (resid 16 and name HA) 3.15 1.35 1.35 ! 0.0000 2558:20 Mid 2.96, 3.47 A assign (resid 20 and name HG11) (resid 16 and name HA) 3.15 1.35 1.35 ! 0.7384 2559:20 Ambig 3.02, 3.53 A or (resid 20 and name HB) (resid 16 and name HA) ! 0.2204 2559:20 ----- 3.70, 4.29 A assign (resid 20 and name HD1*) (resid 16 and name HA) 3.15 1.35 1.35 ! 0.9942 2560:20 Mid 2.01, 3.11 A assign (resid 139 and name HB2) (resid 139 and name HA) 2.65 0.85 0.85 ! 0.8757 2561:20 Ambig 2.99, 3.02 A or (resid 158 and name HB*) (resid 139 and name HA) ! 0.1243 2561:20 ----- 4.14, 4.76 A assign (resid 16 and name HB1) (resid 16 and name HA) 2.65 0.85 0.85 ! 0.9811 2562:20 Intra 2.29, 2.68 A assign (resid 139 and name HB1) (resid 139 and name HA) 3.15 1.35 1.35 ! 0.9675 2563:20 Intra 2.45, 2.51 A assign (resid 66 and name HB*) (resid 66 and name HA) 2.30 0.50 0.50 ! 0.4856 2564:20 Ambig 2.40, 2.72 A or (resid 67 and name HB*) (resid 67 and name HA) ! 0.4800 2564:20 ----- 2.41, 2.74 A assign (resid 11 and name HN) (resid 11 and name HA) 3.15 1.35 1.35 ! 0.9623 2567:20 Intra 2.85, 2.91 A assign (resid 36 and name HG2*) (resid 20 and name HG12) 3.15 1.35 1.35 ! 0.5273 2568:20 Ambig 2.29, 4.53 A or (resid 136 and name HB1) (resid 136 and name HD*) ! 0.3432 2568:20 ----- 2.46, 3.22 A or (resid 36 and name HG1*) (resid 20 and name HG12) ! 0.1213 2568:20 ----- 2.93, 5.34 A assign (resid 119 and name HD1*) (resid 110 and name HG*) 3.15 1.35 1.35 ! 0.5994 2570:20 Ambig 3.08, 6.62 A or (resid 98 and name HG1*) (resid 99 and name HG1) ! 0.1298 2570:20 ----- 3.98, 5.63 A or (resid 119 and name HG11) (resid 110 and name HG*) ! 0.1251 2570:20 ----- 4.00, 7.17 A or (resid 130 and name HG1*) (resid 131 and name HG*) ! 0.1146 2570:20 ----- 4.06, 6.87 A assign (resid 140 and name HD2*) (resid 140 and name HG) 2.65 0.85 0.85 ! 0.3104 2571:20 Ambig 2.39, 2.63 A or (resid 140 and name HD1*) (resid 140 and name HG) ! 0.3070 2571:20 ----- 2.39, 2.63 A or (resid 136 and name HG1) (resid 140 and name HG) ! 0.2980 2571:20 ----- 2.40, 4.71 A or (resid 140 and name HB1) (resid 140 and name HG) ! 0.0770 2571:20 ----- 3.01, 3.02 A assign (resid 7 and name HG2*) (resid 176 and name HG*) 2.30 0.50 0.50 ! 0.5715 2572:20 Ambig 2.02, 4.14 A or (resid 178 and name HG2*) (resid 176 and name HG*) ! 0.3853 2572:20 ----- 2.15, 5.25 A assign (resid 8 and name HD1*) (resid 105 and name HG2*) 2.30 0.50 0.50 ! 0.6001 2573:20 Ambig 2.73, 5.38 A or (resid 7 and name HG2*) (resid 105 and name HG2*) ! 0.3573 2573:20 ----- 2.98, 5.14 A assign (resid 154 and name HB2) (resid 154 and name HD1*) 3.65 1.85 1.85 ! 0.0000 2574:20 Intra 2.37, 3.07 A assign (resid 3 and name HN) (resid 2 and name HB) 3.15 1.35 1.35 ! 0.9405 2575:20 Seq 3.89, 4.15 A assign (resid 16 and name HB1) (resid 2 and name HD1*) 4.15 2.35 2.35 ! 0.9792 2576:20 Long 3.05, 5.64 A assign (resid 179 and name HE*) (resid 2 and name HD1*) 3.65 1.85 1.85 ! 0.0000 2577:20 Long 2.11, 4.97 A assign (resid 16 and name HB2) (resid 2 and name HD1*) 3.65 1.85 1.85 ! 0.0000 2578:20 Long 3.75, 5.96 A assign (resid 16 and name HB1) (resid 2 and name HG2*) 3.65 1.85 1.85 ! 0.8517 2579:20 Ambig 3.74, 5.11 A or (resid 4 and name HB2) (resid 2 and name HG2*) ! 0.0952 2579:20 ----- 5.39, 7.05 A assign (resid 179 and name HE*) (resid 2 and name HG2*) 4.15 2.35 2.35 ! 0.0000 2580:20 Long 2.55, 6.37 A assign (resid 3 and name HB) (resid 3 and name HA) 3.15 1.35 1.35 ! 0.9977 2581:20 Intra 2.44, 2.49 A assign (resid 15 and name HA) (resid 3 and name HG2*) 3.65 1.85 1.85 ! 0.0000 2582:20 Long 2.12, 3.73 A assign (resid 15 and name HA) (resid 3 and name HG1*) 3.65 1.85 1.85 ! 0.7373 2583:20 Ambig 5.13, 5.61 A or (resid 15 and name HA) (resid 13 and name HG2*) ! 0.2627 2583:20 ----- 6.09, 7.09 A assign (resid 4 and name HB2) (resid 13 and name HG2*) 2.30 0.50 0.50 ! 0.9421 2585:20 Long 2.48, 3.12 A assign (resid 12 and name HB2) (resid 3 and name HG2*) 3.15 1.35 1.35 ! 0.9243 2586:20 Long 3.46, 4.43 A assign (resid 13 and name HG2*) (resid 4 and name HB2) 4.15 2.35 2.35 ! 0.9808 2587:20 Long 2.48, 3.12 A assign (resid 175 and name HD*) (resid 6 and name HB2) 3.15 1.35 1.35 ! 0.0000 2589:20 Long 3.02, 4.99 A assign (resid 175 and name HD*) (resid 6 and name HB1) 3.65 1.85 1.85 ! 0.0000 2590:20 Long 4.23, 6.24 A assign (resid 6 and name HA) (resid 6 and name HB1) 3.65 1.85 1.85 ! 0.0000 2591:20 Intra 3.01, 3.02 A assign (resid 8 and name HB) (resid 8 and name HG11) 3.65 1.85 1.85 ! 0.9816 2592:20 Intra 2.44, 2.46 A assign (resid 8 and name HB) (resid 8 and name HG12) 3.65 1.85 1.85 ! 0.8201 2593:20 Ambig 2.45, 2.47 A or (resid 7 and name HB) (resid 8 and name HG12) ! 0.1799 2593:20 ----- 3.16, 3.42 A assign (resid 149 and name HD22) (resid 9 and name HA) 3.65 1.85 1.85 ! 0.6562 2594:20 Ambig 4.97, 6.87 A or (resid 152 and name HN) (resid 9 and name HA) ! 0.3438 2594:20 ----- 5.54, 5.75 A assign (resid 3 and name HG2*) (resid 12 and name HB1) 3.15 1.35 1.35 ! 0.9970 2596:20 Long 2.19, 2.90 A assign (resid 43 and name HG2*) (resid 70 and name HB2) 2.65 0.85 0.85 ! 0.9104 2597:20 Ambig 2.49, 4.50 A or (resid 43 and name HG1*) (resid 70 and name HB2) ! 0.0815 2597:20 ----- 3.72, 4.94 A assign (resid 43 and name HG2*) (resid 70 and name HB1) 3.15 1.35 1.35 ! 0.8935 2598:20 Ambig 2.73, 4.78 A or (resid 43 and name HG1*) (resid 70 and name HB1) ! 0.1065 2598:20 ----- 3.89, 5.77 A assign (resid 120 and name HG*) (resid 117 and name HG2) 3.15 1.35 1.35 ! 0.5948 2599:20 Ambig 3.71, 5.31 A or (resid 5 and name HB2) (resid 12 and name HG*) ! 0.1532 2599:20 ----- 4.65, 6.06 A or (resid 115 and name HB*) (resid 117 and name HG2) ! 0.1145 2599:20 ----- 4.88, 6.80 A or (resid 121 and name HG1) (resid 124 and name HG*) ! 0.0824 2599:20 ----- 5.16, 6.73 A assign (resid 5 and name HG1) (resid 12 and name HG*) 3.65 1.85 1.85 ! 0.9906 2600:20 Long 2.56, 4.34 A assign (resid 117 and name HA) (resid 117 and name HG1) 2.65 0.85 0.85 ! 0.0000 2601:20 Intra 2.47, 2.88 A assign (resid 13 and name HN) (resid 13 and name HB) 3.65 1.85 1.85 ! 0.0000 2602:20 Intra 3.70, 3.75 A assign (resid 175 and name HD*) (resid 13 and name HG1*) 3.15 1.35 1.35 ! 0.9764 2605:20 Long 2.71, 5.89 A assign (resid 35 and name HB2) (resid 167 and name HG2*) 3.15 1.35 1.35 ! 0.5529 2608:20 Ambig 2.21, 5.20 A or (resid 13 and name HB) (resid 13 and name HG1*) ! 0.4207 2608:20 ----- 2.31, 2.61 A assign (resid 37 and name HB1) (resid 19 and name HB1) 2.65 0.85 0.85 ! 0.5673 2609:20 Ambig 2.29, 3.38 A or (resid 14 and name HA) (resid 14 and name HB) ! 0.4209 2609:20 ----- 2.40, 2.53 A assign (resid 75 and name HG1*) (resid 14 and name HB) 3.15 1.35 1.35 ! 0.9185 2610:20 Ambig 2.66, 4.27 A or (resid 30 and name HG1*) (resid 131 and name HB1) ! 0.0296 2610:20 ----- 4.71, 6.17 A assign (resid 20 and name HD1*) (resid 14 and name HG1*) 3.15 1.35 1.35 ! 0.8772 2611:20 Ambig 2.44, 4.53 A or (resid 20 and name HG2*) (resid 14 and name HG1*) ! 0.1228 2611:20 ----- 3.39, 5.84 A assign (resid 75 and name HG1*) (resid 14 and name HG1*) 3.65 1.85 1.85 ! 0.0000 2612:20 Long 4.53, 6.40 A assign (resid 4 and name HB1) (resid 14 and name HG1*) 2.65 0.85 0.85 ! 0.0000 2613:20 Long 3.45, 4.35 A assign (resid 18 and name HN) (resid 18 and name HA) 3.65 1.85 1.85 ! 0.0000 2614:20 Intra 2.91, 2.92 A assign (resid 19 and name HN) (resid 18 and name HA) 2.65 0.85 0.85 ! 0.9810 2615:20 Seq 2.38, 2.61 A assign (resid 18 and name HB1) (resid 18 and name HA) 2.65 0.85 0.85 ! 0.9822 2616:20 Intra 2.42, 2.44 A assign (resid 18 and name HB2) (resid 18 and name HA) 2.65 0.85 0.85 ! 0.0000 2617:20 Intra 3.01, 3.02 A assign (resid 19 and name HN) (resid 19 and name HD*) 3.65 1.85 1.85 ! 0.3113 2618:20 Ambig 2.67, 4.69 A or (resid 20 and name HN) (resid 19 and name HD*) ! 0.2421 2618:20 ----- 2.79, 5.43 A or (resid 163 and name HN) (resid 160 and name HD*) ! 0.2274 2618:20 ----- 2.81, 5.88 A or (resid 38 and name HN) (resid 160 and name HD*) ! 0.1854 2618:20 ----- 2.91, 6.95 A assign (resid 17 and name HN) (resid 18 and name HG) 3.65 1.85 1.85 ! 0.8128 2619:20 Ambig 3.60, 3.83 A or (resid 19 and name HN) (resid 18 and name HG) ! 0.1737 2619:20 ----- 4.65, 4.88 A assign (resid 14 and name HA) (resid 18 and name HD1*) 3.65 1.85 1.85 ! 0.9885 2620:20 Mid 1.89, 3.13 A assign (resid 74 and name HB2) (resid 18 and name HD1*) 3.65 1.85 1.85 ! 0.0000 2621:20 Long 4.58, 6.37 A assign (resid 74 and name HB1) (resid 18 and name HD2*) 3.65 1.85 1.85 ! 0.7015 2622:20 Ambig 3.88, 5.46 A or (resid 14 and name HA) (resid 18 and name HD2*) ! 0.1692 2622:20 ----- 4.91, 6.07 A or (resid 81 and name HB*) (resid 18 and name HD2*) ! 0.0877 2622:20 ----- 5.48, 7.53 A assign (resid 74 and name HB2) (resid 18 and name HD2*) 3.65 1.85 1.85 ! 0.0000 2623:20 Long 2.21, 3.85 A assign (resid 18 and name HG) (resid 18 and name HD2*) 2.30 0.50 0.50 ! 0.9306 2624:20 Intra 2.40, 2.64 A assign (resid 18 and name HD1*) (resid 20 and name HD1*) 3.15 1.35 1.35 ! 0.4160 2625:20 Ambig 4.59, 7.37 A or (resid 36 and name HG1*) (resid 20 and name HD1*) ! 0.3501 2625:20 ----- 4.72, 7.56 A or (resid 3 and name HG2*) (resid 20 and name HD1*) ! 0.1246 2625:20 ----- 5.61, 7.88 A or (resid 2 and name HG12) (resid 20 and name HD1*) ! 0.1093 2625:20 ----- 5.73, 7.60 A assign (resid 20 and name HG12) (resid 20 and name HD1*) 3.15 1.35 1.35 ! 0.0000 2626:20 Intra 2.36, 2.62 A assign (resid 18 and name HB1) (resid 20 and name HD1*) 3.65 1.85 1.85 ! 0.5644 2627:20 Ambig 4.02, 6.57 A or (resid 14 and name HB) (resid 20 and name HD1*) ! 0.2607 2627:20 ----- 4.57, 6.08 A or (resid 19 and name HB1) (resid 20 and name HD1*) ! 0.1750 2627:20 ----- 4.88, 7.93 A assign (resid 36 and name HG1*) (resid 20 and name HG2*) 3.65 1.85 1.85 ! 0.0000 2629:20 Long 4.61, 7.32 A assign (resid 20 and name HG2*) (resid 21 and name HA) 3.65 1.85 1.85 ! 0.9855 2630:20 Seq 3.45, 4.71 A assign (resid 155 and name HD1*) (resid 13 and name HG1*) 3.15 1.35 1.35 ! 0.0000 2632:20 Long 2.23, 4.98 A assign (resid 19 and name HE*) (resid 21 and name HG2*) 3.15 1.35 1.35 ! 0.0000 2633:20 Mid 2.14, 4.88 A assign (resid 28 and name HN) (resid 28 and name HG2) 3.15 1.35 1.35 ! 0.9991 2634:20 Intra 1.99, 2.23 A assign (resid 28 and name HN) (resid 28 and name HG1) 3.15 1.35 1.35 ! 0.0000 2635:20 Intra 2.69, 3.09 A assign (resid 30 and name HN) (resid 29 and name HA) 2.30 0.50 0.50 ! 0.0000 2636:20 Seq 2.14, 2.20 A assign (resid 24 and name HA) (resid 29 and name HA) 2.65 0.85 0.85 ! 0.0000 2637:20 Long 2.06, 2.36 A assign (resid 29 and name HB*) (resid 29 and name HA) 2.65 0.85 0.85 ! 0.9756 2638:20 Intra 2.36, 2.46 A assign (resid 30 and name HA) (resid 30 and name HB) 3.65 1.85 1.85 ! 0.8859 2639:20 Ambig 3.04, 3.05 A or (resid 31 and name HD2) (resid 30 and name HB) ! 0.1141 2639:20 ----- 4.28, 4.44 A assign (resid 132 and name HD1) (resid 30 and name HG1*) 3.15 1.35 1.35 ! 0.0000 2640:20 Long 3.23, 4.65 A assign (resid 23 and name HG1*) (resid 30 and name HG1*) 2.65 0.85 0.85 ! 0.0000 2641:20 Long 3.32, 5.30 A assign (resid 23 and name HG1*) (resid 30 and name HG2*) 3.15 1.35 1.35 ! 0.0000 2642:20 Long 2.33, 3.82 A assign (resid 23 and name HB) (resid 22 and name HB2) 3.65 1.85 1.85 ! 0.3610 2643:20 Ambig 4.63, 4.92 A or (resid 128 and name HG2*) (resid 31 and name HB1) ! 0.3595 2643:20 ----- 4.63, 6.00 A or (resid 30 and name HB) (resid 22 and name HB2) ! 0.0832 2643:20 ----- 5.91, 6.38 A or (resid 33 and name HB2) (resid 22 and name HB2) ! 0.0516 2643:20 ----- 6.40, 6.98 A or (resid 33 and name HG) (resid 31 and name HB1) ! 0.0426 2643:20 ----- 6.61, 7.17 A or (resid 30 and name HB) (resid 31 and name HB1) ! 0.0397 2643:20 ----- 6.69, 6.80 A assign (resid 30 and name HG2*) (resid 31 and name HG1) 4.15 2.35 2.35 ! 0.0000 2644:20 Seq 6.44, 7.39 A assign (resid 34 and name HN) (resid 33 and name HB2) 3.65 1.85 1.85 ! 0.0000 2645:20 Seq 3.67, 3.89 A assign (resid 154 and name HD2*) (resid 154 and name HG) 3.15 1.35 1.35 ! 0.0000 2646:20 Intra 2.41, 2.63 A assign (resid 23 and name HG1*) (resid 33 and name HD1*) 3.15 1.35 1.35 ! 0.0000 2647:20 Long 3.48, 5.95 A assign (resid 172 and name HB2) (resid 33 and name HD2*) 3.15 1.35 1.35 ! 0.8105 2648:20 Ambig 4.68, 5.95 A or (resid 170 and name HB2) (resid 33 and name HD2*) ! 0.1895 2648:20 ----- 5.96, 6.91 A assign (resid 36 and name HN) (resid 35 and name HA) 2.65 0.85 0.85 ! 0.9862 2649:20 Seq 2.21, 2.30 A assign (resid 169 and name HA) (resid 35 and name HA) 3.15 1.35 1.35 ! 0.9229 2650:20 Long 2.75, 3.16 A assign (resid 36 and name HB) (resid 35 and name HA) 4.15 2.35 2.35 ! 0.0000 2651:20 Seq 4.50, 4.69 A assign (resid 36 and name HG1*) (resid 35 and name HA) 3.65 1.85 1.85 ! 0.0000 2652:20 Seq 6.12, 6.53 A assign (resid 35 and name HB1) (resid 35 and name HA) 2.65 0.85 0.85 ! 0.9671 2653:20 Intra 2.48, 2.98 A assign (resid 39 and name HN) (resid 38 and name HA) 2.65 0.85 0.85 ! 0.0000 2654:20 Seq 2.06, 2.13 A assign (resid 75 and name HG2*) (resid 38 and name HA) 3.15 1.35 1.35 ! 0.7568 2655:20 Ambig 2.74, 4.56 A or (resid 36 and name HG1*) (resid 38 and name HA) ! 0.2374 2655:20 ----- 3.32, 5.14 A assign (resid 75 and name HG2*) (resid 38 and name HB*) 3.65 1.85 1.85 ! 0.0000 2656:20 Long 3.80, 6.79 A assign (resid 39 and name HN) (resid 39 and name HA) 3.65 1.85 1.85 ! 0.0000 2657:20 Intra 2.84, 2.90 A assign (resid 40 and name HG*) (resid 39 and name HB*) 3.65 1.85 1.85 ! 0.6225 2658:20 Ambig 5.28, 6.44 A or (resid 37 and name HB2) (resid 39 and name HB*) ! 0.2461 2658:20 ----- 6.16, 7.75 A or (resid 165 and name HB2) (resid 39 and name HB*) ! 0.1314 2658:20 ----- 6.84, 7.95 A assign (resid 75 and name HG2*) (resid 39 and name HB*) 3.15 1.35 1.35 ! 0.6613 2659:20 Ambig 4.40, 6.69 A or (resid 41 and name HG2*) (resid 39 and name HB*) ! 0.3387 2659:20 ----- 4.92, 7.24 A assign (resid 40 and name HG*) (resid 40 and name HB1) 2.65 0.85 0.85 ! 0.8748 2660:20 Ambig 2.37, 2.71 A or (resid 144 and name HB*) (resid 86 and name HG1) ! 0.0653 2660:20 ----- 3.65, 4.88 A assign (resid 40 and name HA) (resid 40 and name HB2) 3.65 1.85 1.85 ! 0.0000 2661:20 Intra 3.00, 3.02 A assign (resid 144 and name HN) (resid 86 and name HG1) 3.65 1.85 1.85 ! 0.7632 2662:20 Ambig 4.35, 4.94 A or (resid 85 and name HN) (resid 86 and name HG1) ! 0.2368 2662:20 ----- 5.29, 6.61 A assign (resid 30 and name HG1*) (resid 29 and name HG1) 3.65 1.85 1.85 ! 0.0000 2663:20 Seq 6.02, 6.72 A assign (resid 74 and name HN) (resid 41 and name HG2*) 3.15 1.35 1.35 ! 0.8178 2664:20 Ambig 2.94, 4.19 A or (resid 74 and name HN) (resid 75 and name HG2*) ! 0.1822 2664:20 ----- 3.77, 5.13 A assign (resid 43 and name HG2*) (resid 42 and name HA) 3.15 1.35 1.35 ! 0.9425 2665:20 Seq 3.54, 4.68 A assign (resid 71 and name HG2) (resid 42 and name HA) 3.15 1.35 1.35 ! 0.0000 2666:20 Long 2.21, 3.66 A assign (resid 42 and name HB*) (resid 42 and name HA) 2.30 0.50 0.50 ! 0.0000 2667:20 Intra 2.41, 2.64 A assign (resid 70 and name HB2) (resid 42 and name HA) 3.65 1.85 1.85 ! 0.3930 2668:20 Ambig 4.30, 5.24 A or (resid 43 and name HB) (resid 42 and name HA) ! 0.3253 2668:20 ----- 4.44, 4.65 A or (resid 40 and name HB1) (resid 42 and name HA) ! 0.1632 2668:20 ----- 4.98, 5.68 A or (resid 72 and name HB*) (resid 42 and name HA) ! 0.1185 2668:20 ----- 5.25, 6.47 A assign (resid 71 and name HA) (resid 42 and name HA) 2.65 0.85 0.85 ! 0.0000 2669:20 Long 2.27, 2.55 A assign (resid 43 and name HN) (resid 42 and name HA) 2.30 0.50 0.50 ! 0.9909 2670:20 Seq 2.02, 2.11 A assign (resid 71 and name HE*) (resid 42 and name HB*) 3.65 1.85 1.85 ! 0.0000 2671:20 Long 2.13, 5.28 A assign (resid 43 and name HG2*) (resid 42 and name HB*) 3.65 1.85 1.85 ! 0.6896 2672:20 Ambig 4.90, 6.65 A or (resid 41 and name HG1*) (resid 42 and name HB*) ! 0.1889 2672:20 ----- 6.08, 7.36 A or (resid 43 and name HG1*) (resid 42 and name HB*) ! 0.1215 2672:20 ----- 6.55, 7.87 A assign (resid 71 and name HN) (resid 70 and name HG*) 3.65 1.85 1.85 ! 0.6540 2673:20 Ambig 4.11, 4.92 A or (resid 43 and name HN) (resid 70 and name HG*) ! 0.1868 2673:20 ----- 5.07, 6.07 A or (resid 68 and name HN) (resid 70 and name HG*) ! 0.1591 2673:20 ----- 5.20, 7.69 A assign (resid 73 and name HD22) (resid 73 and name HA) 3.15 1.35 1.35 ! 0.5151 2675:20 Ambig 4.57, 4.77 A or (resid 77 and name HN) (resid 73 and name HA) ! 0.3130 2675:20 ----- 4.97, 5.16 A or (resid 73 and name HD22) (resid 165 and name HA) ! 0.1719 2675:20 ----- 5.49, 6.91 A assign (resid 74 and name HN) (resid 73 and name HA) 2.65 0.85 0.85 ! 0.0000 2676:20 Seq 2.00, 2.08 A assign (resid 73 and name HB*) (resid 73 and name HA) 2.65 0.85 0.85 ! 0.9470 2677:20 Intra 2.39, 2.74 A assign (resid 148 and name HB2) (resid 84 and name HB) 4.90 3.10 3.10 ! 0.0000 2678:20 Long 5.94, 6.80 A assign (resid 86 and name HG2) (resid 84 and name HG2*) 3.15 1.35 1.35 ! 0.0000 2680:20 Mid 3.41, 4.87 A assign (resid 143 and name HD*) (resid 85 and name HB*) 3.65 1.85 1.85 ! 0.0000 2682:20 Long 3.36, 5.34 A assign (resid 87 and name HD1) (resid 85 and name HB*) 3.65 1.85 1.85 ! 0.8872 2683:20 Ambig 3.69, 5.46 A or (resid 83 and name HB1) (resid 85 and name HB*) ! 0.1128 2683:20 ----- 5.20, 6.64 A assign (resid 176 and name HE*) (resid 176 and name HB*) 3.65 1.85 1.85 ! 0.9334 2684:20 Intra 2.06, 4.17 A assign (resid 177 and name HG1*) (resid 176 and name HB*) 4.15 2.35 2.35 ! 0.0000 2685:20 Seq 6.66, 7.73 A assign (resid 154 and name HD1*) (resid 86 and name HB1) 3.65 1.85 1.85 ! 0.0000 2686:20 Long 3.04, 4.89 A assign (resid 85 and name HB*) (resid 87 and name HD2) 4.15 2.35 2.35 ! 0.0000 2687:20 Mid 5.43, 6.82 A assign (resid 88 and name HN) (resid 88 and name HA) 3.15 1.35 1.35 ! 0.9950 2689:20 Intra 2.72, 2.82 A assign (resid 88 and name HB*) (resid 88 and name HA) 3.15 1.35 1.35 ! 0.9935 2691:20 Intra 2.47, 2.78 A assign (resid 95 and name HN) (resid 95 and name HD*) 3.15 1.35 1.35 ! 0.0000 2693:20 Intra 3.31, 4.03 A assign (resid 178 and name HN) (resid 179 and name HD*) 3.65 1.85 1.85 ! 0.5341 2694:20 Ambig 4.36, 7.25 A or (resid 3 and name HN) (resid 179 and name HD*) ! 0.2573 2694:20 ----- 4.93, 7.03 A or (resid 180 and name HN) (resid 179 and name HD*) ! 0.2086 2694:20 ----- 5.10, 6.15 A assign (resid 96 and name HN) (resid 95 and name HD*) 3.65 1.85 1.85 ! 0.0000 2695:20 Seq 4.96, 5.47 A assign (resid 101 and name HB2) (resid 98 and name HG2*) 3.65 1.85 1.85 ! 0.6247 2696:20 Ambig 4.62, 5.89 A or (resid 94 and name HB2) (resid 98 and name HG2*) ! 0.3004 2696:20 ----- 5.22, 6.29 A assign (resid 99 and name HN) (resid 99 and name HD*) 3.15 1.35 1.35 ! 0.8623 2697:20 Ambig 2.20, 4.07 A or (resid 100 and name HN) (resid 99 and name HD*) ! 0.0903 2697:20 ----- 3.21, 5.13 A assign (resid 107 and name HE21) (resid 110 and name HD*) 3.15 1.35 1.35 ! 0.9883 2698:20 Mid 2.12, 4.58 A assign (resid 100 and name HB2) (resid 101 and name HA) 3.65 1.85 1.85 ! 0.6700 2699:20 Ambig 4.06, 4.63 A or (resid 104 and name HB1) (resid 101 and name HA) ! 0.3300 2699:20 ----- 4.57, 4.89 A assign (resid 104 and name HB2) (resid 101 and name HA) 3.65 1.85 1.85 ! 0.0000 2700:20 Mid 2.95, 3.24 A assign (resid 101 and name HB1) (resid 101 and name HA) 2.65 0.85 0.85 ! 0.9576 2702:20 Intra 3.02, 3.03 A assign (resid 103 and name HD*) (resid 99 and name HA) 3.65 1.85 1.85 ! 0.4854 2703:20 Ambig 4.01, 6.03 A or (resid 103 and name HD*) (resid 103 and name HA) ! 0.4351 2703:20 ----- 4.09, 4.58 A assign (resid 103 and name HD*) (resid 103 and name HB1) 3.15 1.35 1.35 ! 0.0000 2704:20 Intra 2.34, 3.13 A assign (resid 103 and name HD*) (resid 103 and name HB2) 3.15 1.35 1.35 ! 0.0000 2705:20 Intra 2.35, 2.93 A assign (resid 103 and name HN) (resid 103 and name HG1) 3.65 1.85 1.85 ! 0.9659 2706:20 Intra 2.26, 3.25 A assign (resid 99 and name HA) (resid 103 and name HD*) 3.15 1.35 1.35 ! 0.5273 2707:20 Ambig 4.01, 6.03 A or (resid 103 and name HA) (resid 103 and name HD*) ! 0.4727 2707:20 ----- 4.09, 4.58 A assign (resid 100 and name HA) (resid 103 and name HD*) 3.15 1.35 1.35 ! 0.0000 2708:20 Mid 1.95, 3.49 A assign (resid 105 and name HA) (resid 105 and name HB) 3.65 1.85 1.85 ! 0.0000 2710:20 Intra 3.02, 3.04 A assign (resid 103 and name HA) (resid 106 and name HD*) 3.15 1.35 1.35 ! 0.0000 2713:20 Mid 2.25, 4.05 A assign (resid 110 and name HN) (resid 109 and name HB2) 3.65 1.85 1.85 ! 0.9483 2717:20 Seq 2.44, 2.62 A assign (resid 120 and name HE*) (resid 120 and name HA) 3.15 1.35 1.35 ! 0.0000 2718:20 Intra 4.18, 4.55 A assign (resid 111 and name HN) (resid 110 and name HD*) 3.15 1.35 1.35 ! 0.7890 2720:20 Ambig 2.62, 5.27 A or (resid 120 and name HN) (resid 120 and name HD*) ! 0.2110 2720:20 ----- 3.26, 4.03 A assign (resid 5 and name HA) (resid 5 and name HD*) 3.65 1.85 1.85 ! 0.9928 2721:20 Intra 2.22, 4.12 A assign (resid 118 and name HB1) (resid 115 and name HB*) 3.65 1.85 1.85 ! 0.0000 2722:20 Mid 4.01, 5.51 A assign (resid 118 and name HB2) (resid 115 and name HB*) 3.15 1.35 1.35 ! 0.0000 2723:20 Mid 2.46, 3.91 A assign (resid 117 and name HG1) (resid 115 and name HB*) 3.65 1.85 1.85 ! 0.0000 2724:20 Mid 3.96, 5.99 A assign (resid 114 and name HG1*) (resid 115 and name HB*) 3.15 1.35 1.35 ! 0.7805 2725:20 Ambig 3.18, 5.09 A or (resid 116 and name HG2*) (resid 115 and name HB*) ! 0.2195 2725:20 ----- 3.93, 6.25 A assign (resid 117 and name HB*) (resid 115 and name HB*) 3.65 1.85 1.85 ! 0.9518 2726:20 Mid 3.74, 5.65 A assign (resid 116 and name HB) (resid 116 and name HG1*) 2.65 0.85 0.85 ! 0.0000 2728:20 Intra 2.42, 2.64 A assign (resid 116 and name HB) (resid 116 and name HG2*) 2.30 0.50 0.50 ! 0.0000 2729:20 Intra 2.41, 2.63 A assign (resid 116 and name HG1*) (resid 117 and name HB*) 3.65 1.85 1.85 ! 0.0000 2730:20 Seq 5.10, 6.62 A assign (resid 119 and name HG2*) (resid 119 and name HD1*) 2.30 0.50 0.50 ! 0.9009 2733:20 Ambig 2.03, 3.71 A or (resid 114 and name HG2*) (resid 119 and name HD1*) ! 0.0533 2733:20 ----- 3.25, 4.87 A assign (resid 109 and name HD2*) (resid 119 and name HG2*) 3.65 1.85 1.85 ! 0.0000 2734:20 Long 4.76, 7.25 A assign (resid 121 and name HA) (resid 121 and name HE*) 3.15 1.35 1.35 ! 0.8514 2735:20 Ambig 1.84, 4.33 A or (resid 90 and name HB1) (resid 95 and name HE*) ! 0.1451 2735:20 ----- 2.46, 5.47 A assign (resid 121 and name HN) (resid 121 and name HE*) 3.65 1.85 1.85 ! 0.9730 2736:20 Intra 2.82, 5.01 A assign (resid 123 and name HB1) (resid 126 and name HB*) 3.15 1.35 1.35 ! 0.5113 2738:20 Ambig 3.65, 4.51 A or (resid 106 and name HB*) (resid 126 and name HB*) ! 0.4424 2738:20 ----- 3.74, 6.99 A assign (resid 107 and name HE22) (resid 105 and name HB) 4.90 3.10 3.10 ! 0.0000 2739:20 Mid 7.10, 7.59 A assign (resid 128 and name HG2*) (resid 128 and name HB) 2.65 0.85 0.85 ! 0.9658 2740:20 Intra 2.43, 2.65 A assign (resid 140 and name HD2*) (resid 169 and name HG2*) 2.30 0.50 0.50 ! 0.8623 2741:20 Ambig 2.12, 3.75 A or (resid 136 and name HG1) (resid 169 and name HG2*) ! 0.0714 2741:20 ----- 3.20, 4.75 A assign (resid 31 and name HG2) (resid 128 and name HG2*) 2.30 0.50 0.50 ! 0.9143 2742:20 Ambig 2.13, 3.33 A or (resid 31 and name HG1) (resid 128 and name HG2*) ! 0.0766 2742:20 ----- 3.21, 4.74 A assign (resid 133 and name HA) (resid 136 and name HB1) 3.65 1.85 1.85 ! 0.8732 2743:20 Ambig 3.06, 4.53 A or (resid 137 and name HA) (resid 136 and name HB1) ! 0.1268 2743:20 ----- 4.22, 4.63 A assign (resid 136 and name HB2) (resid 136 and name HG2) 3.15 1.35 1.35 ! 0.6722 2744:20 Ambig 2.39, 2.46 A or (resid 169 and name HG2*) (resid 136 and name HG2) ! 0.3239 2744:20 ----- 2.70, 5.28 A assign (resid 136 and name HA) (resid 136 and name HG2) 3.15 1.35 1.35 ! 0.8580 2745:20 Ambig 2.86, 3.33 A or (resid 132 and name HA) (resid 136 and name HG2) ! 0.1420 2745:20 ----- 3.86, 5.02 A assign (resid 136 and name HB2) (resid 136 and name HG1) 3.15 1.35 1.35 ! 0.8640 2746:20 Ambig 2.32, 2.64 A or (resid 169 and name HG2*) (resid 136 and name HG1) ! 0.1234 2746:20 ----- 3.20, 4.75 A assign (resid 139 and name HN) (resid 139 and name HB2) 3.15 1.35 1.35 ! 0.9167 2747:20 Ambig 2.45, 2.51 A or (resid 120 and name HN) (resid 120 and name HE*) ! 0.0519 2747:20 ----- 3.96, 4.88 A assign (resid 141 and name HB*) (resid 140 and name HA) 4.15 2.35 2.35 ! 0.0000 2748:20 Seq 4.13, 4.86 A assign (resid 140 and name HA) (resid 140 and name HB2) 3.65 1.85 1.85 ! 0.9261 2749:20 Intra 3.00, 3.01 A assign (resid 141 and name HN) (resid 140 and name HB1) 3.65 1.85 1.85 ! 0.9911 2751:20 Seq 2.45, 3.18 A assign (resid 136 and name HB1) (resid 140 and name HD1*) 3.15 1.35 1.35 ! 0.0000 2752:20 Mid 2.51, 4.37 A assign (resid 152 and name HN) (resid 148 and name HB2) 4.90 3.10 3.10 ! 0.5731 2753:20 Ambig 6.21, 6.62 A or (resid 149 and name HD22) (resid 148 and name HB2) ! 0.4269 2753:20 ----- 6.52, 7.25 A assign (resid 152 and name HB*) (resid 149 and name HB2) 3.15 1.35 1.35 ! 0.0000 2754:20 Mid 2.13, 3.64 A assign (resid 149 and name HA) (resid 149 and name HB2) 3.15 1.35 1.35 ! 0.9828 2755:20 Intra 2.61, 2.99 A assign (resid 150 and name HA) (resid 149 and name HB2) 3.65 1.85 1.85 ! 0.5389 2757:20 Ambig 5.04, 5.41 A or (resid 9 and name HA) (resid 149 and name HB2) ! 0.4611 2757:20 ----- 5.17, 5.50 A assign (resid 154 and name HN) (resid 153 and name HA2) 3.65 1.85 1.85 ! 0.9932 2758:20 Seq 2.75, 2.81 A assign (resid 155 and name HN) (resid 154 and name HD2*) 4.15 2.35 2.35 ! 0.0000 2759:20 Seq 5.57, 5.78 A assign (resid 97 and name HE1) (resid 154 and name HD2*) 3.65 1.85 1.85 ! 0.0000 2760:20 Long 4.22, 5.39 A assign (resid 159 and name HB2) (resid 163 and name HB*) 3.65 1.85 1.85 ! 0.0000 2761:20 Mid 5.37, 6.70 A assign (resid 166 and name HA) (resid 163 and name HB*) 3.65 1.85 1.85 ! 0.8765 2762:20 Ambig 4.24, 5.68 A or (resid 164 and name HB1) (resid 163 and name HB*) ! 0.1235 2762:20 ----- 5.88, 6.95 A assign (resid 166 and name HD1) (resid 165 and name HA) 3.15 1.35 1.35 ! 0.0000 2763:20 Seq 2.10, 2.47 A assign (resid 118 and name HB2) (resid 114 and name HG1*) 2.30 0.50 0.50 ! 0.7670 2765:20 Ambig 1.99, 2.89 A or (resid 171 and name HB) (resid 171 and name HG2*) ! 0.2324 2765:20 ----- 2.43, 2.64 A assign (resid 114 and name HB) (resid 114 and name HG1*) 2.30 0.50 0.50 ! 0.6086 2766:20 Ambig 2.40, 2.63 A or (resid 119 and name HG12) (resid 114 and name HG1*) ! 0.3806 2766:20 ----- 2.59, 4.38 A assign (resid 172 and name HB2) (resid 172 and name HA) 3.15 1.35 1.35 ! 0.9749 2767:20 Intra 2.43, 2.52 A assign (resid 7 and name HN) (resid 175 and name HA) 3.65 1.85 1.85 ! 0.9688 2768:20 Long 3.51, 3.79 A assign (resid 6 and name HA) (resid 175 and name HA) 3.15 1.35 1.35 ! 0.0000 2769:20 Long 3.40, 3.82 A assign (resid 99 and name HD*) (resid 96 and name HA) 2.65 0.85 0.85 ! 0.8393 2770:20 Ambig 2.24, 3.66 A or (resid 177 and name HB) (resid 177 and name HA) ! 0.1398 2770:20 ----- 3.02, 3.03 A assign (resid 5 and name HE*) (resid 178 and name HG2*) 2.65 0.85 0.85 ! 0.9445 2771:20 Long 1.88, 4.23 A assign (resid 5 and name HE*) (resid 178 and name HG1*) 2.65 0.85 0.85 ! 0.0000 2772:20 Long 2.55, 4.93 A assign (resid 120 and name HE*) (resid 116 and name HG1*) 3.15 1.35 1.35 ! 0.0000 2773:20 Mid 2.11, 3.78 A assign (resid 171 and name HB) (resid 171 and name HG1*) 2.30 0.50 0.50 ! 0.0000 2774:20 Intra 2.39, 2.62 A assign (resid 168 and name HB1) (resid 36 and name HG1*) 3.15 1.35 1.35 ! 0.3487 2775:20 Ambig 4.33, 5.62 A or (resid 37 and name HB1) (resid 36 and name HG1*) ! 0.2809 2775:20 ----- 4.48, 5.58 A or (resid 14 and name HA) (resid 36 and name HG1*) ! 0.1846 2775:20 ----- 4.81, 6.93 A or (resid 135 and name HB2) (resid 134 and name HG1*) ! 0.1139 2775:20 ----- 5.21, 6.42 A assign (resid 175 and name HB*) (resid 177 and name HG2*) 3.65 1.85 1.85 ! 0.0000 2776:20 Mid 3.67, 5.43 A assign (resid 5 and name HG1) (resid 5 and name HA) 3.65 1.85 1.85 ! 0.7299 2777:20 Ambig 2.63, 3.23 A or (resid 13 and name HG1*) (resid 5 and name HA) ! 0.2701 2777:20 ----- 3.10, 4.97 A assign (resid 71 and name HB1) (resid 40 and name HA) 3.15 1.35 1.35 ! 0.8794 2778:20 Ambig 3.11, 4.06 A or (resid 71 and name HD*) (resid 40 and name HA) ! 0.1206 2778:20 ----- 4.34, 6.94 A assign (resid 71 and name HB2) (resid 71 and name HA) 2.65 0.85 0.85 ! 0.9082 2779:20 Ambig 2.99, 3.02 A or (resid 152 and name HB*) (resid 151 and name HA) ! 0.0521 2779:20 ----- 4.82, 5.61 A assign (resid 151 and name HB1) (resid 151 and name HA) 2.65 0.85 0.85 ! 0.9757 2783:20 Intra 2.39, 2.49 A assign (resid 2 and name HN) (resid 2 and name HG2*) 3.15 1.35 1.35 ! 0.5560 2785:20 Ambig 4.30, 4.57 A or (resid 16 and name HN) (resid 2 and name HG2*) ! 0.4440 2785:20 ----- 4.46, 5.50 A assign (resid 145 and name HA) (resid 155 and name HD1*) 3.15 1.35 1.35 ! 0.0000 2787:20 Long 4.02, 5.06 A assign (resid 131 and name HB2) (resid 128 and name HA) 3.65 1.85 1.85 ! 0.9644 2788:20 Mid 2.35, 3.11 A assign (resid 130 and name HB) (resid 127 and name HA) 2.65 0.85 0.85 ! 0.9512 2789:20 Mid 2.83, 3.03 A assign (resid 155 and name HG2*) (resid 155 and name HD1*) 3.15 1.35 1.35 ! 0.9962 2792:20 Intra 2.01, 4.00 A assign (resid 51 and name HN) (resid 50 and name HD1*) 3.65 1.85 1.85 ! 0.0000 2793:20 Seq 3.98, 5.76 A assign (resid 96 and name HN) (resid 96 and name HB*) 2.65 0.85 0.85 ! 0.0000 2794:20 Intra 2.45, 2.96 A assign (resid 132 and name HB2) (resid 132 and name HA) 2.65 0.85 0.85 ! 0.0000 2796:20 Intra 2.42, 2.47 A assign (resid 150 and name HG2) (resid 150 and name HA) 3.15 1.35 1.35 ! 0.0000 2797:20 Intra 3.80, 3.86 A assign (resid 29 and name HG1) (resid 31 and name HA) 3.15 1.35 1.35 ! 0.7821 2798:20 Ambig 3.18, 3.77 A or (resid 31 and name HG1) (resid 31 and name HA) ! 0.2179 2798:20 ----- 3.93, 4.00 A assign (resid 101 and name HB1) (resid 98 and name HA) 3.15 1.35 1.35 ! 0.9880 2799:20 Mid 2.23, 2.61 A assign (resid 127 and name HG1) (resid 126 and name HB*) 3.15 1.35 1.35 ! 0.0000 2800:20 Seq 4.43, 5.50 A assign (resid 119 and name HB) (resid 119 and name HD1*) 2.65 0.85 0.85 ! 0.9937 2801:20 Intra 2.70, 3.91 A assign (resid 171 and name HG1*) (resid 171 and name HA) 3.15 1.35 1.35 ! 0.0000 2802:20 Intra 2.52, 3.11 A assign (resid 114 and name HG1*) (resid 114 and name HA) 2.30 0.50 0.50 ! 0.0000 2803:20 Intra 2.54, 3.14 A assign (resid 121 and name HD*) (resid 121 and name HA) 3.15 1.35 1.35 ! 0.9911 2805:20 Intra 1.88, 3.06 A assign (resid 124 and name HB2) (resid 121 and name HA) 2.65 0.85 0.85 ! 0.0000 2806:20 Mid 2.46, 2.81 A assign (resid 121 and name HG2) (resid 121 and name HA) 3.15 1.35 1.35 ! 0.8679 2807:20 Ambig 2.41, 2.94 A or (resid 121 and name HG1) (resid 121 and name HA) ! 0.1295 2807:20 ----- 3.31, 3.71 A assign (resid 106 and name HG*) (resid 106 and name HA) 2.65 0.85 0.85 ! 0.9548 2808:20 Intra 2.44, 2.88 A assign (resid 100 and name HB2) (resid 100 and name HA) 2.65 0.85 0.85 ! 0.0000 2810:20 Intra 2.93, 2.99 A assign (resid 161 and name HG*) (resid 161 and name HA) 2.65 0.85 0.85 ! 0.5104 2811:20 Ambig 2.42, 3.19 A or (resid 124 and name HG*) (resid 124 and name HA) ! 0.4855 2811:20 ----- 2.44, 2.99 A assign (resid 31 and name HG2) (resid 125 and name HA) 2.65 0.85 0.85 ! 0.8313 2812:20 Ambig 2.94, 3.36 A or (resid 124 and name HB2) (resid 125 and name HA) ! 0.1687 2812:20 ----- 3.83, 4.36 A assign (resid 161 and name HB*) (resid 161 and name HA) 2.30 0.50 0.50 ! 0.8961 2813:20 Ambig 2.37, 2.69 A or (resid 127 and name HG2) (resid 124 and name HA) ! 0.0789 2813:20 ----- 3.55, 3.87 A assign (resid 107 and name HB1) (resid 107 and name HA) 2.30 0.50 0.50 ! 0.7405 2814:20 Ambig 2.44, 2.59 A or (resid 107 and name HB2) (resid 107 and name HA) ! 0.2280 2814:20 ----- 2.96, 3.00 A assign (resid 148 and name HB1) (resid 148 and name HA) 2.30 0.50 0.50 ! 0.0000 2815:20 Intra 2.49, 2.55 A assign (resid 63 and name HB2) (resid 63 and name HA) 2.65 0.85 0.85 ! 0.0000 2816:20 Intra 2.44, 2.59 A assign (resid 140 and name HD1*) (resid 133 and name HA) 3.15 1.35 1.35 ! 0.7722 2818:20 Ambig 2.82, 4.23 A or (resid 136 and name HG1) (resid 133 and name HA) ! 0.0890 2818:20 ----- 4.05, 5.11 A or (resid 140 and name HD2*) (resid 133 and name HA) ! 0.0857 2818:20 ----- 4.07, 5.70 A assign (resid 17 and name HN) (resid 17 and name HA) 2.65 0.85 0.85 ! 0.9918 2819:20 Intra 2.85, 2.87 A assign (resid 84 and name HA) (resid 85 and name HA) 3.15 1.35 1.35 ! 0.5151 2820:20 Ambig 4.33, 4.39 A or (resid 86 and name HA) (resid 85 and name HA) ! 0.4849 2820:20 ----- 4.37, 4.41 A assign (resid 141 and name HG2) (resid 141 and name HA) 2.65 0.85 0.85 ! 0.0000 2821:20 Intra 2.36, 2.76 A assign (resid 41 and name HG1*) (resid 74 and name HA) 3.15 1.35 1.35 ! 0.7121 2822:20 Ambig 3.44, 4.45 A or (resid 43 and name HG2*) (resid 74 and name HA) ! 0.2879 2822:20 ----- 4.00, 6.46 A assign (resid 127 and name HG1) (resid 127 and name HD1) 2.65 0.85 0.85 ! 0.7942 2827:20 Ambig 2.30, 2.31 A or (resid 127 and name HB1) (resid 127 and name HD1) ! 0.2058 2827:20 ----- 2.88, 2.94 A assign (resid 103 and name HB2) (resid 106 and name HD*) 3.65 1.85 1.85 ! 0.5097 2831:20 Ambig 4.27, 6.59 A or (resid 103 and name HB1) (resid 106 and name HD*) ! 0.4903 2831:20 ----- 4.30, 6.45 A assign (resid 158 and name HD*) (resid 136 and name HE1) 4.15 2.35 2.35 ! 0.0000 2833:20 Long 4.27, 5.60 A assign (resid 151 and name HA) (resid 151 and name HB2) 2.65 0.85 0.85 ! 0.9578 2834:20 Intra 2.99, 3.02 A assign (resid 42 and name HB*) (resid 71 and name HE*) 2.30 0.50 0.50 ! 0.6428 2845:20 Ambig 2.13, 5.28 A or (resid 179 and name HG2) (resid 179 and name HE*) ! 0.3554 2845:20 ----- 2.35, 3.17 A assign (resid 98 and name HG1*) (resid 95 and name HE*) 3.65 1.85 1.85 ! 0.0000 2848:20 Mid 4.49, 7.28 A assign (resid 7 and name HG2*) (resid 176 and name HE*) 2.65 0.85 0.85 ! 0.5081 2849:20 Ambig 2.20, 4.96 A or (resid 7 and name HG1*) (resid 176 and name HE*) ! 0.4155 2849:20 ----- 2.28, 5.08 A assign (resid 178 and name HG2*) (resid 5 and name HE*) 3.15 1.35 1.35 ! 0.8582 2850:20 Ambig 1.88, 4.23 A or (resid 178 and name HG1*) (resid 5 and name HE*) ! 0.1409 2850:20 ----- 2.55, 4.93 A assign (resid 167 and name HG2*) (resid 160 and name HE*) 2.65 0.85 0.85 ! 0.4039 2851:20 Ambig 2.12, 5.22 A or (resid 21 and name HG2*) (resid 19 and name HE*) ! 0.3890 2851:20 ----- 2.14, 4.88 A or (resid 5 and name HG1) (resid 5 and name HE*) ! 0.2057 2851:20 ----- 2.38, 3.11 A assign (resid 98 and name HG2*) (resid 95 and name HE*) 3.15 1.35 1.35 ! 0.0000 2852:20 Mid 3.68, 5.90 A assign (resid 95 and name HD*) (resid 95 and name HE*) 2.30 0.50 0.50 ! 0.0000 2853:20 Intra 2.36, 2.63 A assign (resid 160 and name HG*) (resid 160 and name HE*) 2.30 0.50 0.50 ! 0.5072 2854:20 Ambig 2.32, 3.07 A or (resid 5 and name HG2) (resid 5 and name HE*) ! 0.4873 2854:20 ----- 2.33, 3.48 A assign (resid 116 and name HG1*) (resid 120 and name HE*) 2.65 0.85 0.85 ! 0.9948 2855:20 Mid 2.11, 3.78 A assign (resid 71 and name HG2) (resid 71 and name HE*) 2.65 0.85 0.85 ! 0.9988 2856:20 Intra 2.39, 3.01 A assign (resid 176 and name HG*) (resid 176 and name HE*) 2.30 0.50 0.50 ! 0.8815 2857:20 Ambig 2.39, 3.05 A or (resid 108 and name HB*) (resid 176 and name HE*) ! 0.0941 2857:20 ----- 3.46, 6.45 A assign (resid 141 and name HB*) (resid 141 and name HG1) 2.30 0.50 0.50 ! 0.0000 2861:20 Intra 2.34, 2.72 A assign (resid 93 and name HB1) (resid 93 and name HG*) 2.30 0.50 0.50 ! 0.3491 2862:20 Ambig 2.28, 2.62 A or (resid 124 and name HB2) (resid 124 and name HG*) ! 0.2952 2862:20 ----- 2.34, 2.64 A or (resid 12 and name HB2) (resid 12 and name HG*) ! 0.2899 2862:20 ----- 2.35, 2.74 A assign (resid 20 and name HD1*) (resid 4 and name HB1) 4.15 2.35 2.35 ! 0.0000 2863:20 Long 5.94, 7.08 A assign (resid 117 and name HA) (resid 117 and name HG2) 2.65 0.85 0.85 ! 0.3777 2864:20 Ambig 2.34, 3.03 A or (resid 161 and name HA) (resid 161 and name HG*) ! 0.3086 2864:20 ----- 2.42, 3.19 A or (resid 124 and name HA) (resid 124 and name HG*) ! 0.2936 2864:20 ----- 2.44, 2.99 A assign (resid 31 and name HD1) (resid 29 and name HG1) 2.65 0.85 0.85 ! 0.0000 2865:20 Mid 2.86, 3.33 A assign (resid 156 and name HB1) (resid 169 and name HB) 3.15 1.35 1.35 ! 0.9974 2867:20 Long 2.25, 2.72 A assign (resid 12 and name HB2) (resid 3 and name HB) 4.15 2.35 2.35 ! 0.8103 2870:20 Ambig 5.87, 6.42 A or (resid 4 and name HB1) (resid 3 and name HB) ! 0.1897 2870:20 ----- 7.48, 7.53 A assign (resid 169 and name HG2*) (resid 169 and name HB) 2.65 0.85 0.85 ! 0.9864 2875:20 Intra 2.37, 2.61 A assign (resid 180 and name HN) (resid 179 and name HB1) 3.65 1.85 1.85 ! 0.5919 2877:20 Ambig 3.53, 3.93 A or (resid 3 and name HN) (resid 179 and name HB1) ! 0.3442 2877:20 ----- 3.86, 5.09 A assign (resid 24 and name HN) (resid 24 and name HB2) 2.65 0.85 0.85 ! 0.9011 2878:20 Ambig 2.47, 2.55 A or (resid 29 and name HN) (resid 28 and name HB1) ! 0.0953 2878:20 ----- 3.60, 3.79 A assign (resid 30 and name HN) (resid 23 and name HB) 3.15 1.35 1.35 ! 0.0000 2879:20 Long 2.19, 2.64 A assign (resid 107 and name HN) (resid 107 and name HG1) 3.15 1.35 1.35 ! 0.5315 2880:20 Ambig 2.41, 3.84 A or (resid 107 and name HN) (resid 107 and name HG2) ! 0.4685 2880:20 ----- 2.46, 3.91 A assign (resid 74 and name HD22) (resid 19 and name HB2) 2.65 0.85 0.85 ! 0.9757 2881:20 Long 2.23, 3.04 A assign (resid 188 and name HA) (resid 188 and name HB1) 3.15 1.35 1.35 ! 0.0000 2882:20 Intra 2.40, 2.81 A assign (resid 187 and name HA) (resid 187 and name HB2) 3.15 1.35 1.35 ! 0.0000 2883:20 Intra 2.45, 2.71 A assign (resid 22 and name HA) (resid 22 and name HB2) 2.30 0.50 0.50 ! 0.0000 2888:20 Intra 2.71, 2.73 A assign (resid 31 and name HD2) (resid 31 and name HB1) 3.15 1.35 1.35 ! 0.5897 2891:20 Ambig 3.79, 3.87 A or (resid 125 and name HA) (resid 31 and name HB1) ! 0.2317 2891:20 ----- 4.43, 5.25 A or (resid 30 and name HA) (resid 31 and name HB1) ! 0.1449 2891:20 ----- 4.79, 4.89 A assign (resid 99 and name HA) (resid 99 and name HB*) 2.30 0.50 0.50 ! 0.9083 2892:20 Ambig 2.40, 2.77 A or (resid 96 and name HB*) (resid 99 and name HB*) ! 0.0367 2892:20 ----- 4.10, 5.76 A assign (resid 87 and name HD2) (resid 87 and name HB2) 2.65 0.85 0.85 ! 0.5529 2895:20 Ambig 2.90, 3.75 A or (resid 134 and name HA) (resid 134 and name HB) ! 0.4201 2895:20 ----- 3.04, 3.05 A assign (resid 87 and name HD1) (resid 86 and name HG1) 4.15 2.35 2.35 ! 0.6605 2896:20 Ambig 5.31, 5.78 A or (resid 76 and name HB2) (resid 78 and name HB2) ! 0.2224 2896:20 ----- 6.36, 7.42 A or (resid 127 and name HD2) (resid 131 and name HB2) ! 0.1171 2896:20 ----- 7.08, 7.52 A assign (resid 82 and name HB*) (resid 146 and name HB1) 3.15 1.35 1.35 ! 0.7450 2899:20 Ambig 2.93, 4.76 A or (resid 167 and name HG2*) (resid 35 and name HB1) ! 0.1300 2899:20 ----- 3.92, 5.22 A or (resid 169 and name HG2*) (resid 35 and name HB1) ! 0.0931 2899:20 ----- 4.14, 7.17 A assign (resid 108 and name HB*) (resid 7 and name HB) 3.15 1.35 1.35 ! 0.7361 2900:20 Ambig 3.97, 5.05 A or (resid 176 and name HG*) (resid 7 and name HB) ! 0.2639 2900:20 ----- 4.71, 5.99 A assign (resid 115 and name HB*) (resid 116 and name HB) 3.15 1.35 1.35 ! 0.6686 2901:20 Ambig 4.36, 5.50 A or (resid 120 and name HG*) (resid 116 and name HB) ! 0.3314 2901:20 ----- 4.90, 5.56 A assign (resid 102 and name HG2*) (resid 102 and name HB) 2.30 0.50 0.50 ! 0.0000 2902:20 Intra 2.42, 2.64 A assign (resid 102 and name HG1*) (resid 102 and name HB) 2.30 0.50 0.50 ! 0.9140 2903:20 Ambig 2.43, 2.64 A or (resid 98 and name HG1*) (resid 102 and name HB) ! 0.0384 2903:20 ----- 4.12, 5.64 A assign (resid 134 and name HG1*) (resid 134 and name HB) 2.30 0.50 0.50 ! 0.0000 2904:20 Intra 2.43, 2.64 A assign (resid 130 and name HG2*) (resid 130 and name HB) 2.30 0.50 0.50 ! 0.5069 2905:20 Ambig 2.39, 2.64 A or (resid 130 and name HG1*) (resid 130 and name HB) ! 0.4766 2905:20 ----- 2.41, 2.63 A assign (resid 178 and name HG2*) (resid 5 and name HD*) 2.30 0.50 0.50 ! 0.6353 2906:20 Ambig 2.04, 4.37 A or (resid 7 and name HG1*) (resid 176 and name HD*) ! 0.1311 2906:20 ----- 2.65, 5.97 A or (resid 98 and name HG1*) (resid 99 and name HD*) ! 0.1063 2906:20 ----- 2.75, 6.97 A or (resid 178 and name HG2*) (resid 176 and name HD*) ! 0.0680 2906:20 ----- 2.96, 4.95 A assign (resid 23 and name HG2*) (resid 23 and name HB) 2.30 0.50 0.50 ! 0.9953 2907:20 Intra 2.39, 2.63 A assign (resid 136 and name HG2) (resid 136 and name HB1) 3.15 1.35 1.35 ! 0.0000 2908:20 Intra 2.36, 2.77 A assign (resid 108 and name HN) (resid 107 and name HB2) 3.15 1.35 1.35 ! 0.9275 2910:20 Seq 2.77, 3.02 A assign (resid 103 and name HA) (resid 103 and name HB2) 2.65 0.85 0.85 ! 0.9712 2911:20 Intra 2.44, 2.79 A assign (resid 146 and name HA) (resid 146 and name HD*) 3.15 1.35 1.35 ! 0.9962 2913:20 Intra 2.05, 4.11 A assign (resid 177 and name HA) (resid 177 and name HB) 2.65 0.85 0.85 ! 0.9806 2914:20 Intra 3.02, 3.03 A assign (resid 119 and name HA) (resid 119 and name HG12) 3.15 1.35 1.35 ! 0.7284 2918:20 Ambig 2.25, 2.98 A or (resid 116 and name HA) (resid 119 and name HG12) ! 0.2650 2918:20 ----- 2.67, 3.15 A assign (resid 92 and name HA2) (resid 95 and name HD*) 3.15 1.35 1.35 ! 0.6796 2920:20 Ambig 4.72, 5.37 A or (resid 97 and name HB*) (resid 95 and name HD*) ! 0.1850 2920:20 ----- 5.86, 7.64 A or (resid 98 and name HA) (resid 95 and name HD*) ! 0.1354 2920:20 ----- 6.17, 7.06 A assign (resid 179 and name HE*) (resid 179 and name HD*) 2.30 0.50 0.50 ! 0.0000 2922:20 Intra 2.39, 2.67 A assign (resid 70 and name HG*) (resid 70 and name HB1) 2.30 0.50 0.50 ! 0.0000 2924:20 Intra 2.29, 2.63 A assign (resid 135 and name HB1) (resid 136 and name HD*) 3.65 1.85 1.85 ! 0.9132 2926:20 Ambig 2.32, 4.72 A or (resid 139 and name HB1) (resid 136 and name HD*) ! 0.0697 2926:20 ----- 3.56, 5.67 A assign (resid 139 and name HB2) (resid 136 and name HD*) 3.65 1.85 1.85 ! 0.8486 2927:20 Ambig 2.37, 4.42 A or (resid 158 and name HB*) (resid 136 and name HD*) ! 0.1514 2927:20 ----- 3.17, 5.41 A assign (resid 109 and name HB2) (resid 106 and name HB*) 3.15 1.35 1.35 ! 0.7381 2928:20 Ambig 3.70, 4.87 A or (resid 103 and name HG2) (resid 106 and name HB*) ! 0.2619 2928:20 ----- 4.40, 5.59 A assign (resid 127 and name HG2) (resid 127 and name HB2) 2.30 0.50 0.50 ! 0.8913 2929:20 Ambig 2.30, 2.32 A or (resid 121 and name HB*) (resid 124 and name HB2) ! 0.0488 2929:20 ----- 3.74, 4.74 A assign (resid 29 and name HB*) (resid 24 and name HG1) 3.15 1.35 1.35 ! 0.0000 2930:20 Long 3.38, 4.45 A assign (resid 2 and name HN) (resid 2 and name HG12) 3.65 1.85 1.85 ! 0.9904 2931:20 Intra 2.07, 2.70 A assign (resid 97 and name HZ2) (resid 154 and name HD2*) 3.15 1.35 1.35 ! 0.0000 2933:20 Long 3.67, 4.98 A assign (resid 140 and name HN) (resid 140 and name HG) 3.15 1.35 1.35 ! 0.9662 2934:20 Intra 2.60, 2.72 A assign (resid 129 and name HD*) (resid 33 and name HD1*) 3.15 1.35 1.35 ! 0.9855 2936:20 Long 2.83, 5.77 A assign (resid 48 and name HA) (resid 48 and name HG11) 3.65 1.85 1.85 ! 0.0000 2940:20 Intra 2.49, 3.17 A assign (resid 172 and name HE*) (resid 172 and name HG*) 2.65 0.85 0.85 ! 0.5102 2942:20 Ambig 2.36, 3.25 A or (resid 121 and name HE*) (resid 121 and name HG2) ! 0.4898 2942:20 ----- 2.37, 3.05 A assign (resid 22 and name HB2) (resid 22 and name HG1) 2.30 0.50 0.50 ! 0.9249 2943:20 Intra 2.66, 2.68 A assign (resid 22 and name HB2) (resid 22 and name HG2) 2.65 0.85 0.85 ! 0.5693 2944:20 Ambig 2.30, 2.32 A or (resid 24 and name HG1) (resid 22 and name HG2) ! 0.4307 2944:20 ----- 2.41, 2.86 A assign (resid 179 and name HE*) (resid 179 and name HG1) 3.15 1.35 1.35 ! 0.9977 2945:20 Intra 2.44, 3.18 A assign (resid 5 and name HE*) (resid 5 and name HG1) 3.15 1.35 1.35 ! 0.0000 2946:20 Intra 2.38, 3.11 A assign (resid 22 and name HB1) (resid 22 and name HG1) 2.65 0.85 0.85 ! 0.0000 2948:20 Intra 2.30, 2.32 A assign (resid 179 and name HB2) (resid 179 and name HG1) 2.30 0.50 0.50 ! 0.5076 2949:20 Ambig 2.36, 2.52 A or (resid 179 and name HD*) (resid 179 and name HG1) ! 0.4924 2949:20 ----- 2.37, 2.68 A assign (resid 71 and name HB2) (resid 71 and name HG2) 2.65 0.85 0.85 ! 0.8464 2950:20 Ambig 2.44, 2.71 A or (resid 40 and name HB2) (resid 71 and name HG2) ! 0.1536 2950:20 ----- 3.24, 4.75 A assign (resid 2 and name HD1*) (resid 2 and name HG11) 2.65 0.85 0.85 ! 0.0000 2953:20 Intra 2.40, 2.62 A assign (resid 154 and name HB1) (resid 154 and name HD2*) 3.15 1.35 1.35 ! 0.0000 2955:20 Intra 2.39, 3.01 A assign (resid 8 and name HN) (resid 7 and name HG2*) 3.15 1.35 1.35 ! 0.5604 2957:20 Ambig 4.12, 4.82 A or (resid 105 and name HN) (resid 7 and name HG2*) ! 0.2889 2957:20 ----- 4.61, 6.13 A or (resid 105 and name HN) (resid 109 and name HD1*) ! 0.0871 2957:20 ----- 5.62, 6.58 A assign (resid 5 and name HN) (resid 3 and name HG2*) 3.15 1.35 1.35 ! 0.7380 2958:20 Ambig 4.34, 5.60 A or (resid 12 and name HN) (resid 3 and name HG2*) ! 0.2620 2958:20 ----- 5.16, 5.99 A assign (resid 143 and name HN) (resid 155 and name HG2*) 3.65 1.85 1.85 ! 0.9062 2959:20 Ambig 3.46, 4.49 A or (resid 5 and name HN) (resid 177 and name HG1*) ! 0.0938 2959:20 ----- 5.04, 6.55 A assign (resid 135 and name HN) (resid 134 and name HG1*) 3.15 1.35 1.35 ! 0.0000 2960:20 Seq 3.58, 4.43 A assign (resid 174 and name HN) (resid 171 and name HG1*) 2.65 0.85 0.85 ! 0.9989 2961:20 Mid 1.78, 2.91 A assign (resid 24 and name HN) (resid 23 and name HG2*) 3.15 1.35 1.35 ! 0.6443 2962:20 Ambig 4.36, 5.12 A or (resid 170 and name HN) (resid 23 and name HG2*) ! 0.3557 2962:20 ----- 4.82, 5.46 A assign (resid 100 and name HN) (resid 102 and name HG2*) 3.65 1.85 1.85 ! 0.6870 2964:20 Ambig 5.47, 6.73 A or (resid 97 and name HZ3) (resid 102 and name HG2*) ! 0.3130 2964:20 ----- 6.23, 7.41 A assign (resid 131 and name HN) (resid 130 and name HG2*) 3.15 1.35 1.35 ! 0.0000 2966:20 Seq 3.84, 4.55 A assign (resid 143 and name HD*) (resid 155 and name HG2*) 2.65 0.85 0.85 ! 0.8417 2967:20 Ambig 3.59, 5.67 A or (resid 101 and name HD*) (resid 133 and name HD2*) ! 0.1249 2967:20 ----- 4.93, 7.80 A assign (resid 132 and name HH2) (resid 133 and name HD2*) 3.65 1.85 1.85 ! 0.0000 2968:20 Seq 4.72, 6.17 A assign (resid 158 and name HA) (resid 140 and name HD2*) 3.15 1.35 1.35 ! 0.0000 2969:20 Long 3.25, 4.79 A assign (resid 144 and name HA) (resid 154 and name HD1*) 3.15 1.35 1.35 ! 0.6007 2971:20 Ambig 3.50, 5.17 A or (resid 142 and name HA) (resid 154 and name HD1*) ! 0.2255 2971:20 ----- 4.13, 5.35 A or (resid 143 and name HA) (resid 154 and name HD1*) ! 0.1738 2971:20 ----- 4.31, 5.54 A assign (resid 131 and name HG*) (resid 134 and name HG2*) 3.65 1.85 1.85 ! 0.0000 2972:20 Mid 5.19, 6.79 A assign (resid 130 and name HB) (resid 134 and name HG2*) 3.15 1.35 1.35 ! 0.8116 2973:20 Ambig 4.58, 5.56 A or (resid 131 and name HB1) (resid 134 and name HG2*) ! 0.1884 2973:20 ----- 5.84, 6.94 A assign (resid 136 and name HE2) (resid 140 and name HD2*) 4.15 2.35 2.35 ! 0.5591 2974:20 Ambig 5.47, 7.52 A or (resid 141 and name HG1) (resid 140 and name HD2*) ! 0.4409 2974:20 ----- 5.69, 7.45 A assign (resid 169 and name HB) (resid 140 and name HD2*) 3.15 1.35 1.35 ! 0.9595 2975:20 Long 3.06, 3.92 A assign (resid 7 and name HB) (resid 7 and name HG2*) 2.30 0.50 0.50 ! 0.8654 2976:20 Ambig 2.41, 2.63 A or (resid 106 and name HB*) (resid 102 and name HG1*) ! 0.1292 2976:20 ----- 3.31, 5.55 A assign (resid 178 and name HB) (resid 3 and name HG1*) 2.30 0.50 0.50 ! 0.5708 2977:20 Ambig 2.13, 3.10 A or (resid 3 and name HB) (resid 3 and name HG1*) ! 0.3034 2977:20 ----- 2.37, 2.61 A or (resid 19 and name HB2) (resid 75 and name HG2*) ! 0.0998 2977:20 ----- 2.85, 4.39 A assign (resid 3 and name HB) (resid 3 and name HG2*) 2.30 0.50 0.50 ! 0.0000 2978:20 Intra 2.39, 2.63 A assign (resid 150 and name HB2) (resid 154 and name HD1*) 3.15 1.35 1.35 ! 0.9395 2979:20 Mid 3.18, 5.01 A assign (resid 143 and name HB1) (resid 155 and name HG2*) 3.15 1.35 1.35 ! 0.8639 2980:20 Ambig 3.66, 4.74 A or (resid 171 and name HB) (resid 133 and name HD2*) ! 0.0993 2980:20 ----- 5.25, 6.85 A assign (resid 14 and name HA) (resid 75 and name HG1*) 3.15 1.35 1.35 ! 0.5801 2981:20 Ambig 3.35, 4.77 A or (resid 168 and name HB1) (resid 75 and name HG1*) ! 0.3112 2981:20 ----- 3.71, 5.23 A or (resid 81 and name HB*) (resid 75 and name HG1*) ! 0.0875 2981:20 ----- 4.59, 6.53 A assign (resid 35 and name HB1) (resid 23 and name HG2*) 2.65 0.85 0.85 ! 0.5081 2983:20 Ambig 1.92, 4.16 A or (resid 35 and name HB2) (resid 23 and name HG2*) ! 0.4905 2983:20 ----- 1.93, 3.22 A assign (resid 86 and name HB2) (resid 154 and name HD1*) 3.65 1.85 1.85 ! 0.0000 2984:20 Long 2.59, 4.20 A assign (resid 171 and name HG2*) (resid 105 and name HG1*) 3.65 1.85 1.85 ! 0.9123 2985:20 Ambig 3.22, 5.99 A or (resid 102 and name HG2*) (resid 105 and name HG1*) ! 0.0506 2985:20 ----- 5.22, 7.21 A assign (resid 119 and name HD1*) (resid 114 and name HG2*) 2.65 0.85 0.85 ! 0.8966 2986:20 Ambig 3.25, 4.87 A or (resid 119 and name HG11) (resid 114 and name HG2*) ! 0.1034 2986:20 ----- 4.66, 6.37 A assign (resid 75 and name HG1*) (resid 36 and name HG1*) 3.15 1.35 1.35 ! 0.0000 2988:20 Long 1.97, 4.06 A assign (resid 33 and name HD1*) (resid 23 and name HG2*) 2.65 0.85 0.85 ! 0.7865 2989:20 Ambig 3.27, 5.29 A or (resid 30 and name HG1*) (resid 23 and name HG2*) ! 0.2135 2989:20 ----- 4.07, 5.97 A assign (resid 2 and name HG11) (resid 177 and name HG1*) 3.15 1.35 1.35 ! 0.5402 2992:20 Ambig 4.63, 5.93 A or (resid 2 and name HB) (resid 177 and name HG1*) ! 0.4598 2992:20 ----- 4.76, 5.55 A assign (resid 133 and name HB1) (resid 133 and name HD2*) 2.65 0.85 0.85 ! 0.8884 2993:20 Ambig 2.49, 3.12 A or (resid 136 and name HB2) (resid 133 and name HD2*) ! 0.0682 2993:20 ----- 3.82, 5.49 A assign (resid 169 and name HG1*) (resid 133 and name HD2*) 2.65 0.85 0.85 ! 0.5997 2994:20 Ambig 2.44, 3.53 A or (resid 171 and name HG2*) (resid 133 and name HD2*) ! 0.3958 2994:20 ----- 2.61, 4.62 A assign (resid 14 and name HG1*) (resid 13 and name HG2*) 3.15 1.35 1.35 ! 0.0000 2996:20 Seq 1.93, 4.06 A assign (resid 8 and name HN) (resid 7 and name HG1*) 3.15 1.35 1.35 ! 0.5588 2997:20 Ambig 4.01, 4.79 A or (resid 105 and name HN) (resid 7 and name HG1*) ! 0.4412 2997:20 ----- 4.17, 5.41 A assign (resid 176 and name HN) (resid 7 and name HG1*) 3.65 1.85 1.85 ! 0.6688 2998:20 Ambig 5.21, 6.36 A or (resid 9 and name HN) (resid 7 and name HG1*) ! 0.3312 2998:20 ----- 5.86, 6.80 A assign (resid 160 and name HN) (resid 167 and name HG2*) 3.15 1.35 1.35 ! 0.9398 3000:20 Long 3.54, 4.64 A assign (resid 13 and name HN) (resid 3 and name HG2*) 3.15 1.35 1.35 ! 0.0000 3001:20 Long 3.36, 4.50 A assign (resid 119 and name HN) (resid 114 and name HG1*) 3.15 1.35 1.35 ! 0.9799 3002:20 Long 2.96, 4.66 A assign (resid 172 and name HN) (resid 171 and name HG2*) 3.15 1.35 1.35 ! 0.8262 3003:20 Ambig 4.48, 5.12 A or (resid 133 and name HN) (resid 171 and name HG2*) ! 0.1738 3003:20 ----- 5.81, 6.97 A assign (resid 3 and name HN) (resid 3 and name HG2*) 3.15 1.35 1.35 ! 0.6657 3006:20 Ambig 4.45, 4.76 A or (resid 178 and name HN) (resid 3 and name HG2*) ! 0.3343 3006:20 ----- 5.00, 6.01 A assign (resid 56 and name HN) (resid 55 and name HB*) 3.15 1.35 1.35 ! 0.0000 3007:20 Seq 2.12, 3.71 A assign (resid 178 and name HN) (resid 178 and name HG2*) 2.30 0.50 0.50 ! 0.9848 3009:20 Intra 2.51, 3.53 A assign (resid 23 and name HN) (resid 23 and name HG1*) 3.15 1.35 1.35 ! 0.0000 3010:20 Intra 4.35, 4.56 A assign (resid 175 and name HD*) (resid 171 and name HG2*) 3.15 1.35 1.35 ! 0.6332 3011:20 Ambig 3.92, 6.29 A or (resid 101 and name HD*) (resid 171 and name HG2*) ! 0.3452 3011:20 ----- 4.34, 6.65 A assign (resid 118 and name HN) (resid 116 and name HG1*) 3.65 1.85 1.85 ! 0.0000 3012:20 Mid 5.26, 6.14 A assign (resid 175 and name HD*) (resid 7 and name HG2*) 2.65 0.85 0.85 ! 0.7329 3013:20 Ambig 2.52, 5.37 A or (resid 101 and name HD*) (resid 98 and name HG1*) ! 0.1358 3013:20 ----- 3.33, 6.63 A or (resid 103 and name HN) (resid 102 and name HG1*) ! 0.0826 3013:20 ----- 3.62, 4.47 A assign (resid 175 and name HD*) (resid 13 and name HG2*) 2.30 0.50 0.50 ! 0.0000 3014:20 Long 2.05, 4.87 A assign (resid 85 and name HA) (resid 85 and name HB*) 2.30 0.50 0.50 ! 0.0000 3015:20 Intra 2.41, 2.63 A assign (resid 109 and name HA) (resid 109 and name HD1*) 2.30 0.50 0.50 ! 0.0000 3017:20 Intra 2.25, 3.33 A assign (resid 178 and name HA) (resid 177 and name HG1*) 3.65 1.85 1.85 ! 0.0000 3018:20 Seq 3.84, 5.07 A assign (resid 78 and name HD*) (resid 41 and name HG2*) 3.65 1.85 1.85 ! 0.8587 3019:20 Ambig 4.30, 6.72 A or (resid 155 and name HA) (resid 13 and name HG2*) ! 0.1413 3019:20 ----- 5.81, 7.52 A assign (resid 130 and name HA) (resid 130 and name HG1*) 2.30 0.50 0.50 ! 0.5423 3020:20 Ambig 2.47, 3.11 A or (resid 98 and name HA) (resid 98 and name HG1*) ! 0.4251 3020:20 ----- 2.58, 3.20 A assign (resid 132 and name HB2) (resid 30 and name HG2*) 3.15 1.35 1.35 ! 0.8173 3021:20 Ambig 3.89, 5.06 A or (resid 23 and name HA) (resid 30 and name HG2*) ! 0.1827 3021:20 ----- 4.99, 5.96 A assign (resid 105 and name HA) (resid 7 and name HG1*) 3.15 1.35 1.35 ! 0.0000 3022:20 Long 2.89, 4.44 A assign (resid 174 and name HA1) (resid 7 and name HG1*) 4.90 3.10 3.10 ! 0.6640 3023:20 Ambig 6.66, 7.90 A or (resid 6 and name HB1) (resid 7 and name HG1*) ! 0.3360 3023:20 ----- 7.46, 7.90 A assign (resid 7 and name HB) (resid 7 and name HG1*) 2.65 0.85 0.85 ! 0.9486 3024:20 Intra 2.43, 2.64 A assign (resid 31 and name HG2) (resid 30 and name HG1*) 3.15 1.35 1.35 ! 0.7832 3025:20 Ambig 3.93, 4.91 A or (resid 31 and name HG1) (resid 30 and name HG1*) ! 0.1560 3025:20 ----- 5.14, 5.92 A assign (resid 5 and name HD*) (resid 178 and name HG2*) 2.30 0.50 0.50 ! 0.5530 3026:20 Ambig 2.04, 4.37 A or (resid 176 and name HB*) (resid 178 and name HG2*) ! 0.2319 3026:20 ----- 2.36, 4.09 A or (resid 106 and name HG*) (resid 102 and name HG1*) ! 0.1365 3026:20 ----- 2.57, 5.38 A assign (resid 5 and name HD*) (resid 178 and name HG1*) 2.65 0.85 0.85 ! 0.7330 3027:20 Ambig 3.25, 5.53 A or (resid 105 and name HB) (resid 109 and name HD1*) ! 0.1428 3027:20 ----- 4.27, 5.20 A or (resid 179 and name HB1) (resid 178 and name HG1*) ! 0.0449 3027:20 ----- 5.18, 6.40 A assign (resid 87 and name HG*) (resid 87 and name HA) 3.15 1.35 1.35 ! 0.9928 3028:20 Intra 3.09, 3.87 A assign (resid 122 and name HN) (resid 122 and name HA) 2.65 0.85 0.85 ! 0.0000 3029:20 Intra 2.76, 2.81 A assign (resid 187 and name HB1) (resid 187 and name HA) 2.65 0.85 0.85 ! 0.9611 3030:20 Intra 2.48, 2.83 A assign (resid 20 and name HN) (resid 16 and name HA) 3.65 1.85 1.85 ! 0.8544 3031:20 Ambig 4.57, 5.11 A or (resid 19 and name HN) (resid 16 and name HA) ! 0.1456 3031:20 ----- 6.14, 6.65 A assign (resid 171 and name HG2*) (resid 105 and name HG2*) 3.65 1.85 1.85 ! 0.9520 3032:20 Long 2.54, 5.60 A assign (resid 12 and name HG*) (resid 3 and name HG2*) 3.15 1.35 1.35 ! 0.9678 3033:20 Long 1.99, 3.64 A assign (resid 71 and name HG2) (resid 71 and name HD*) 2.65 0.85 0.85 ! 0.0000 3034:20 Intra 2.33, 2.72 A assign (resid 179 and name HG2) (resid 179 and name HD*) 2.30 0.50 0.50 ! 0.5079 3035:20 Ambig 2.39, 2.67 A or (resid 95 and name HG1) (resid 95 and name HD*) ! 0.4905 3035:20 ----- 2.41, 2.74 A assign (resid 40 and name HB1) (resid 71 and name HD*) 3.15 1.35 1.35 ! 0.9862 3036:20 Long 2.29, 4.88 A assign (resid 18 and name HB1) (resid 18 and name HD2*) 2.30 0.50 0.50 ! 0.9719 3038:20 Intra 2.50, 3.14 A assign (resid 14 and name HG2*) (resid 20 and name HD1*) 2.65 0.85 0.85 ! 0.9814 3039:20 Long 2.05, 4.66 A assign (resid 120 and name HE*) (resid 116 and name HG2*) 3.65 1.85 1.85 ! 0.0000 3040:20 Mid 5.06, 6.70 A assign (resid 118 and name HB1) (resid 114 and name HG1*) 2.65 0.85 0.85 ! 0.9932 3041:20 Mid 2.43, 2.99 A assign (resid 30 and name HG2*) (resid 31 and name HG1) 4.15 2.35 2.35 ! 0.0000 3043:20 Seq 6.44, 7.39 A assign (resid 169 and name HA) (resid 35 and name HA) 3.15 1.35 1.35 ! 0.9229 3044:20 Long 2.75, 3.16 A assign (resid 71 and name HD*) (resid 42 and name HA) 2.65 0.85 0.85 ! 0.7589 3045:20 Ambig 1.90, 4.54 A or (resid 71 and name HG1) (resid 42 and name HA) ! 0.2411 3045:20 ----- 2.30, 3.17 A assign (resid 88 and name HB*) (resid 88 and name HA) 3.15 1.35 1.35 ! 0.9399 3047:20 Intra 2.47, 2.78 A assign (resid 96 and name HN) (resid 99 and name HD*) 3.15 1.35 1.35 ! 0.6781 3048:20 Ambig 4.42, 5.83 A or (resid 121 and name HN) (resid 120 and name HD*) ! 0.3219 3048:20 ----- 5.00, 5.35 A assign (resid 120 and name HE*) (resid 120 and name HA) 3.65 1.85 1.85 ! 0.0000 3049:20 Intra 4.18, 4.55 A assign (resid 133 and name HD2*) (resid 169 and name HG2*) 3.15 1.35 1.35 ! 0.7824 3051:20 Ambig 4.50, 6.16 A or (resid 155 and name HG2*) (resid 169 and name HG2*) ! 0.2176 3051:20 ----- 5.57, 7.35 A assign (resid 140 and name HD2*) (resid 169 and name HG2*) 2.65 0.85 0.85 ! 0.9325 3052:20 Long 2.12, 3.75 A assign (resid 19 and name HB2) (resid 39 and name HB*) 3.15 1.35 1.35 ! 0.6748 3053:20 Ambig 2.97, 4.81 A or (resid 31 and name HB2) (resid 128 and name HG2*) ! 0.1674 3053:20 ----- 3.74, 5.27 A or (resid 35 and name HB1) (resid 169 and name HG2*) ! 0.0913 3053:20 ----- 4.14, 7.17 A assign (resid 98 and name HB) (resid 98 and name HG2*) 2.30 0.50 0.50 ! 0.9784 3054:20 Intra 2.42, 2.63 A assign (resid 169 and name HB) (resid 169 and name HG2*) 2.30 0.50 0.50 ! 0.9391 3055:20 Intra 2.37, 2.61 A assign (resid 81 and name HD*) (resid 12 and name HB2) 3.65 1.85 1.85 ! 0.0000 3056:20 Long 3.60, 6.14 A assign (resid 7 and name HN) (resid 175 and name HA) 3.65 1.85 1.85 ! 0.0000 3057:20 Long 3.51, 3.79 A assign (resid 74 and name HB1) (resid 41 and name HG2*) 2.30 0.50 0.50 ! 0.7410 3058:20 Ambig 2.50, 3.52 A or (resid 168 and name HB1) (resid 36 and name HG2*) ! 0.1420 3058:20 ----- 3.30, 4.39 A or (resid 14 and name HA) (resid 13 and name HG2*) ! 0.0275 3058:20 ----- 4.33, 5.40 A or (resid 74 and name HB1) (resid 75 and name HG2*) ! 0.0168 3058:20 ----- 4.70, 5.78 A assign (resid 177 and name HG1*) (resid 179 and name HE*) 3.15 1.35 1.35 ! 0.4459 3063:20 Ambig 2.32, 5.98 A or (resid 75 and name HG1*) (resid 168 and name HB2) ! 0.2899 3063:20 ----- 2.50, 4.39 A or (resid 2 and name HG2*) (resid 179 and name HE*) ! 0.2556 3063:20 ----- 2.55, 6.37 A assign (resid 116 and name HG1*) (resid 120 and name HE*) 3.15 1.35 1.35 ! 0.9823 3064:20 Mid 2.11, 3.78 A assign (resid 2 and name HD1*) (resid 179 and name HE*) 3.65 1.85 1.85 ! 0.9979 3065:20 Long 2.11, 4.97 A assign (resid 98 and name HG1*) (resid 95 and name HD*) 3.15 1.35 1.35 ! 0.0000 3066:20 Mid 4.52, 6.00 A assign (resid 160 and name HG*) (resid 160 and name HD*) 2.30 0.50 0.50 ! 0.9318 3067:20 Intra 2.37, 2.70 A assign (resid 63 and name HA) (resid 63 and name HG*) 2.65 0.85 0.85 ! 0.9678 3069:20 Intra 2.53, 3.20 A assign (resid 30 and name HG1*) (resid 128 and name HG2*) 3.15 1.35 1.35 ! 0.6939 3070:20 Ambig 2.17, 3.26 A or (resid 33 and name HD1*) (resid 128 and name HG2*) ! 0.2948 3070:20 ----- 2.51, 4.48 A assign (resid 36 and name HG2*) (resid 168 and name HB2) 2.65 0.85 0.85 ! 0.9695 3071:20 Long 2.34, 3.34 A assign (resid 129 and name HN) (resid 128 and name HA) 3.65 1.85 1.85 ! 0.9779 3072:20 Seq 3.53, 3.56 A assign (resid 134 and name HB) (resid 134 and name HA) 2.65 0.85 0.85 ! 0.0000 3075:20 Intra 3.04, 3.05 A assign (resid 133 and name HN) (resid 132 and name HA) 3.15 1.35 1.35 ! 0.0000 3086:20 Seq 3.48, 3.52 A assign (resid 122 and name HD*) (resid 173 and name HB*) 2.65 0.85 0.85 ! 0.0000 3087:20 Long 2.80, 4.84 A assign (resid 120 and name HN) (resid 117 and name HA) 3.15 1.35 1.35 ! 0.6439 3092:20 Ambig 3.05, 3.37 A or (resid 111 and name HN) (resid 110 and name HA) ! 0.3561 3092:20 ----- 3.37, 3.47 A assign (resid 117 and name HB*) (resid 117 and name HA) 2.30 0.50 0.50 ! 0.9716 3094:20 Intra 2.38, 2.74 A assign (resid 120 and name HG*) (resid 117 and name HA) 2.65 0.85 0.85 ! 0.6234 3095:20 Ambig 2.28, 2.88 A or (resid 110 and name HG*) (resid 110 and name HA) ! 0.3367 3095:20 ----- 2.52, 3.25 A assign (resid 3 and name HG2*) (resid 3 and name HA) 2.30 0.50 0.50 ! 0.9212 3096:20 Intra 2.41, 3.06 A assign (resid 116 and name HG1*) (resid 117 and name HA) 2.65 0.85 0.85 ! 0.9578 3097:20 Seq 3.29, 4.60 A assign (resid 109 and name HD1*) (resid 106 and name HA) 3.15 1.35 1.35 ! 0.9949 3098:20 Mid 2.13, 3.83 A assign (resid 109 and name HD1*) (resid 106 and name HA) 3.15 1.35 1.35 ! 0.5932 3099:20 Ambig 2.13, 3.83 A or (resid 155 and name HG1*) (resid 155 and name HA) ! 0.3251 3099:20 ----- 2.36, 2.81 A or (resid 155 and name HB) (resid 155 and name HA) ! 0.0772 3099:20 ----- 2.99, 3.02 A assign (resid 124 and name HN) (resid 121 and name HA) 2.65 0.85 0.85 ! 0.7816 3100:20 Ambig 2.95, 3.25 A or (resid 123 and name HN) (resid 121 and name HA) ! 0.1318 3100:20 ----- 3.97, 4.23 A or (resid 125 and name HN) (resid 121 and name HA) ! 0.0866 3100:20 ----- 4.26, 4.50 A assign (resid 103 and name HB2) (resid 100 and name HA) 2.65 0.85 0.85 ! 0.0000 3101:20 Mid 1.97, 2.57 A assign (resid 127 and name HB2) (resid 127 and name HD1) 3.15 1.35 1.35 ! 0.5873 3102:20 Ambig 3.85, 3.88 A or (resid 123 and name HB1) (resid 127 and name HD1) ! 0.3850 3102:20 ----- 4.13, 4.71 A assign (resid 23 and name HG2*) (resid 33 and name HB2) 3.15 1.35 1.35 ! 0.9182 3103:20 Ambig 2.31, 3.36 A or (resid 33 and name HD2*) (resid 33 and name HB2) ! 0.0711 3103:20 ----- 3.53, 3.85 A assign (resid 23 and name HG2*) (resid 33 and name HB1) 3.15 1.35 1.35 ! 0.5534 3104:20 Ambig 2.19, 3.14 A or (resid 33 and name HD2*) (resid 33 and name HB1) ! 0.4440 3104:20 ----- 2.28, 2.95 A assign (resid 142 and name HD*) (resid 142 and name HB2) 3.15 1.35 1.35 ! 0.0000 3105:20 Intra 2.30, 3.03 A assign (resid 97 and name HA) (resid 100 and name HB1) 3.15 1.35 1.35 ! 0.3695 3106:20 Ambig 3.64, 4.29 A or (resid 132 and name HA) (resid 135 and name HB1) ! 0.3479 3106:20 ----- 3.67, 4.06 A or (resid 136 and name HA) (resid 135 and name HB1) ! 0.2479 3106:20 ----- 3.89, 4.19 A assign (resid 37 and name HN) (resid 37 and name HB2) 3.15 1.35 1.35 ! 0.9893 3107:20 Intra 2.42, 2.61 A assign (resid 83 and name HN) (resid 83 and name HB1) 3.15 1.35 1.35 ! 0.9694 3108:20 Intra 3.57, 3.66 A assign (resid 114 and name HG1*) (resid 118 and name HB1) 3.15 1.35 1.35 ! 0.9940 3110:20 Mid 2.43, 2.99 A assign (resid 169 and name HN) (resid 169 and name HB) 3.65 1.85 1.85 ! 0.9978 3111:20 Intra 2.26, 2.35 A assign (resid 29 and name HN) (resid 28 and name HG1) 3.15 1.35 1.35 ! 0.0000 3112:20 Seq 3.31, 3.67 A assign (resid 178 and name HA) (resid 178 and name HB) 2.65 0.85 0.85 ! 0.9842 3115:20 Intra 3.02, 3.04 A assign (resid 121 and name HE*) (resid 124 and name HG*) 3.65 1.85 1.85 ! 0.6244 3116:20 Ambig 2.28, 6.37 A or (resid 5 and name HE*) (resid 12 and name HG*) ! 0.2544 3116:20 ----- 2.64, 5.10 A or (resid 160 and name HE*) (resid 161 and name HG*) ! 0.1165 3116:20 ----- 3.01, 7.52 A assign (resid 86 and name HG1) (resid 86 and name HB2) 2.30 0.50 0.50 ! 0.6049 3117:20 Ambig 2.24, 2.37 A or (resid 86 and name HG2) (resid 86 and name HB2) ! 0.3904 3117:20 ----- 2.41, 2.48 A assign (resid 120 and name HE*) (resid 120 and name HB*) 3.15 1.35 1.35 ! 0.0000 3118:20 Intra 4.18, 4.72 A assign (resid 154 and name HD1*) (resid 86 and name HG2) 3.65 1.85 1.85 ! 0.0000 3119:20 Long 3.70, 5.13 A assign (resid 30 and name HN) (resid 29 and name HB*) 3.15 1.35 1.35 ! 0.0000 3121:20 Seq 2.60, 3.38 A assign (resid 130 and name HN) (resid 130 and name HB) 3.15 1.35 1.35 ! 0.0000 3122:20 Intra 2.58, 2.64 A assign (resid 117 and name HG1) (resid 117 and name HB*) 2.30 0.50 0.50 ! 0.0000 3124:20 Intra 2.32, 2.75 A assign (resid 21 and name HA) (resid 22 and name HG1) 3.15 1.35 1.35 ! 0.8755 3125:20 Ambig 4.52, 4.57 A or (resid 34 and name HA) (resid 22 and name HG1) ! 0.1245 3125:20 ----- 6.25, 6.66 A assign (resid 71 and name HA) (resid 71 and name HG1) 3.65 1.85 1.85 ! 0.0000 3126:20 Intra 2.36, 2.79 A assign (resid 78 and name HD*) (resid 78 and name HG1) 2.65 0.85 0.85 ! 0.9984 3127:20 Intra 2.25, 2.65 A assign (resid 33 and name HD1*) (resid 33 and name HG) 2.65 0.85 0.85 ! 0.8986 3128:20 Ambig 2.35, 2.62 A or (resid 30 and name HG1*) (resid 33 and name HG) ! 0.0958 3128:20 ----- 3.41, 4.73 A assign (resid 132 and name HZ2) (resid 169 and name HG1*) 3.65 1.85 1.85 ! 0.0000 3130:20 Long 4.16, 5.50 A assign (resid 4 and name HD*) (resid 177 and name HG1*) 3.15 1.35 1.35 ! 0.0000 3131:20 Long 3.82, 5.78 A assign (resid 74 and name HB2) (resid 41 and name HG2*) 2.65 0.85 0.85 ! 0.8711 3132:20 Ambig 3.02, 4.22 A or (resid 74 and name HB2) (resid 75 and name HG2*) ! 0.1145 3132:20 ----- 4.24, 5.40 A assign (resid 169 and name HB) (resid 169 and name HG1*) 2.65 0.85 0.85 ! 0.9838 3133:20 Intra 2.40, 2.64 A assign (resid 7 and name HN) (resid 7 and name HG2*) 2.30 0.50 0.50 ! 0.9298 3134:20 Intra 1.98, 3.09 A assign (resid 40 and name HA) (resid 73 and name HA) 2.65 0.85 0.85 ! 0.0000 3135:20 Long 2.12, 2.49 A assign (resid 165 and name HB2) (resid 165 and name HA) 2.65 0.85 0.85 ! 0.9174 3136:20 Ambig 2.56, 3.01 A or (resid 165 and name HB2) (resid 73 and name HA) ! 0.0826 3136:20 ----- 3.82, 4.70 A assign (resid 31 and name HD1) (resid 29 and name HG1) 2.65 0.85 0.85 ! 0.0000 3137:20 Mid 2.86, 3.33 A assign (resid 81 and name HA) (resid 81 and name HD*) 2.65 0.85 0.85 ! 0.9870 2:25 Intra 2.85, 3.51 A assign (resid 138 and name HN) (resid 137 and name HD*) 2.65 0.85 0.85 ! 0.5142 3:25 Ambig 3.27, 4.65 A or (resid 174 and name HN) (resid 175 and name HD*) ! 0.3794 3:25 ----- 3.44, 5.39 A or (resid 13 and name HN) (resid 175 and name HD*) ! 0.0689 3:25 ----- 4.58, 6.70 A assign (resid 7 and name HN) (resid 175 and name HD*) 2.65 0.85 0.85 ! 0.7883 4:25 Ambig 2.39, 4.68 A or (resid 102 and name HN) (resid 101 and name HD*) ! 0.1849 4:25 ----- 3.04, 4.38 A assign (resid 175 and name HA) (resid 175 and name HD*) 3.15 1.35 1.35 ! 0.9990 7:25 Intra 2.01, 3.42 A assign (resid 125 and name HA) (resid 129 and name HD*) 3.65 1.85 1.85 ! 0.0000 9:25 Mid 4.87, 5.97 A assign (resid 101 and name HA) (resid 101 and name HD*) 2.65 0.85 0.85 ! 0.8768 11:25 Ambig 2.43, 3.52 A or (resid 90 and name HB1) (resid 94 and name HD*) ! 0.1218 11:25 ----- 3.37, 7.06 A assign (resid 129 and name HB1) (resid 129 and name HD*) 3.15 1.35 1.35 ! 0.9138 12:25 Ambig 2.93, 3.10 A or (resid 174 and name HA1) (resid 129 and name HD*) ! 0.0765 12:25 ----- 4.44, 5.47 A assign (resid 129 and name HB2) (resid 129 and name HD*) 2.65 0.85 0.85 ! 0.0000 13:25 Intra 2.24, 3.00 A assign (resid 137 and name HA) (resid 137 and name HD*) 2.30 0.50 0.50 ! 0.3885 14:25 Ambig 2.51, 3.55 A or (resid 94 and name HA) (resid 94 and name HD*) ! 0.3766 14:25 ----- 2.53, 3.54 A or (resid 134 and name HA) (resid 137 and name HD*) ! 0.1710 14:25 ----- 2.88, 4.60 A assign (resid 137 and name HB1) (resid 137 and name HD*) 3.15 1.35 1.35 ! 0.8508 15:25 Ambig 2.30, 3.05 A or (resid 102 and name HA) (resid 101 and name HD*) ! 0.0899 15:25 ----- 3.34, 4.96 A assign (resid 126 and name HA) (resid 129 and name HD*) 3.65 1.85 1.85 ! 0.0000 16:25 Mid 2.29, 3.59 A assign (resid 175 and name HB*) (resid 175 and name HD*) 2.30 0.50 0.50 ! 0.5587 17:25 Ambig 2.25, 3.06 A or (resid 137 and name HB2) (resid 137 and name HD*) ! 0.4413 17:25 ----- 2.34, 3.05 A assign (resid 4 and name HB1) (resid 175 and name HD*) 2.30 0.50 0.50 ! 0.4330 18:25 Ambig 2.26, 4.34 A or (resid 101 and name HB2) (resid 101 and name HD*) ! 0.3066 18:25 ----- 2.40, 3.06 A or (resid 94 and name HB2) (resid 94 and name HD*) ! 0.2544 18:25 ----- 2.47, 3.05 A assign (resid 125 and name HB2) (resid 129 and name HD*) 3.65 1.85 1.85 ! 0.9215 19:25 Mid 4.83, 5.69 A assign (resid 101 and name HB1) (resid 101 and name HD*) 2.30 0.50 0.50 ! 0.9849 20:25 Intra 2.30, 3.03 A assign (resid 130 and name HG2*) (resid 129 and name HD*) 2.65 0.85 0.85 ! 0.3591 21:25 Ambig 3.65, 6.00 A or (resid 109 and name HD1*) (resid 129 and name HD*) ! 0.3477 21:25 ----- 3.67, 6.23 A or (resid 102 and name HG1*) (resid 129 and name HD*) ! 0.2603 21:25 ----- 3.85, 7.42 A assign (resid 33 and name HD2*) (resid 129 and name HD*) 4.15 2.35 2.35 ! 0.0000 22:25 Long 2.13, 4.71 A assign (resid 75 and name HG1*) (resid 81 and name HD*) 4.15 2.35 2.35 ! 0.0000 23:25 Long 4.35, 6.78 A assign (resid 13 and name HG2*) (resid 175 and name HD*) 2.30 0.50 0.50 ! 0.5584 25:25 Ambig 2.05, 4.87 A or (resid 8 and name HD1*) (resid 101 and name HD*) ! 0.2574 25:25 ----- 2.33, 5.09 A or (resid 133 and name HD1*) (resid 101 and name HD*) ! 0.0764 25:25 ----- 2.86, 5.80 A or (resid 8 and name HG2*) (resid 101 and name HD*) ! 0.0477 25:25 ----- 3.09, 6.89 A assign (resid 102 and name HG2*) (resid 101 and name HD*) 2.30 0.50 0.50 ! 0.7604 26:25 Ambig 2.51, 5.48 A or (resid 98 and name HG2*) (resid 94 and name HD*) ! 0.1123 26:25 ----- 3.46, 4.84 A or (resid 171 and name HG2*) (resid 175 and name HD*) ! 0.0528 26:25 ----- 3.92, 6.29 A assign (resid 158 and name HA) (resid 159 and name HD*) 4.15 2.35 2.35 ! 0.8637 28:25 Ambig 2.89, 4.88 A or (resid 158 and name HA) (resid 158 and name HD*) ! 0.1363 28:25 ----- 3.93, 4.26 A assign (resid 158 and name HB*) (resid 158 and name HD*) 2.30 0.50 0.50 ! 0.6929 30:25 Ambig 2.24, 3.05 A or (resid 139 and name HB2) (resid 158 and name HD*) ! 0.2879 30:25 ----- 2.59, 4.65 A assign (resid 140 and name HD2*) (resid 158 and name HD*) 2.65 0.85 0.85 ! 0.5761 31:25 Ambig 2.47, 4.88 A or (resid 136 and name HD*) (resid 158 and name HD*) ! 0.2291 31:25 ----- 2.88, 5.11 A or (resid 136 and name HG1) (resid 158 and name HD*) ! 0.1790 31:25 ----- 3.00, 4.92 A assign (resid 81 and name HN) (resid 81 and name HD*) 4.15 2.35 2.35 ! 0.0000 32:25 Intra 2.36, 3.73 A assign (resid 122 and name HA) (resid 122 and name HD*) 3.65 1.85 1.85 ! 0.0000 35:25 Intra 2.08, 3.42 A assign (resid 75 and name HA) (resid 81 and name HD*) 3.15 1.35 1.35 ! 0.9240 36:25 Long 2.94, 5.78 A assign (resid 80 and name HB*) (resid 81 and name HD*) 2.30 0.50 0.50 ! 0.0000 38:25 Seq 2.40, 4.49 A assign (resid 119 and name HA) (resid 122 and name HD*) 3.65 1.85 1.85 ! 0.6325 39:25 Ambig 2.56, 4.13 A or (resid 173 and name HB*) (resid 122 and name HD*) ! 0.3675 39:25 ----- 2.80, 4.84 A assign (resid 122 and name HB2) (resid 122 and name HD*) 2.30 0.50 0.50 ! 0.0000 40:25 Intra 2.22, 3.01 A assign (resid 81 and name HB*) (resid 81 and name HD*) 2.65 0.85 0.85 ! 0.9709 42:25 Intra 2.33, 3.04 A assign (resid 75 and name HG1*) (resid 81 and name HD*) 4.15 2.35 2.35 ! 0.0000 45:25 Long 4.35, 6.78 A assign (resid 114 and name HG2*) (resid 122 and name HD*) 3.65 1.85 1.85 ! 0.7745 46:25 Ambig 2.87, 6.00 A or (resid 119 and name HG2*) (resid 122 and name HD*) ! 0.2255 46:25 ----- 3.53, 6.36 A assign (resid 142 and name HN) (resid 142 and name HD*) 4.15 2.35 2.35 ! 0.9533 53:25 Intra 2.60, 3.77 A assign (resid 97 and name HH2) (resid 156 and name HD*) 3.15 1.35 1.35 ! 0.0000 58:25 Long 3.76, 4.86 A assign (resid 56 and name HB2) (resid 56 and name HD*) 4.15 2.35 2.35 ! 0.0000 63:25 Intra 2.27, 3.02 A assign (resid 56 and name HB1) (resid 56 and name HD*) 3.15 1.35 1.35 ! 0.0000 64:25 Intra 2.36, 3.05 A assign (resid 88 and name HB*) (resid 142 and name HD*) 3.65 1.85 1.85 ! 0.0000 67:25 Long 2.35, 6.74 A assign (resid 140 and name HD1*) (resid 156 and name HD*) 3.15 1.35 1.35 ! 0.6833 74:25 Ambig 1.94, 4.40 A or (resid 140 and name HB1) (resid 156 and name HD*) ! 0.2307 74:25 ----- 2.33, 4.86 A or (resid 140 and name HD2*) (resid 156 and name HD*) ! 0.0861 74:25 ----- 2.74, 5.47 A assign (resid 154 and name HD2*) (resid 142 and name HD*) 3.65 1.85 1.85 ! 0.0000 81:25 Long 3.28, 4.96 A assign (resid 159 and name HN) (resid 159 and name HD*) 4.15 2.35 2.35 ! 0.6246 83:25 Ambig 2.29, 3.87 A or (resid 159 and name HN) (resid 158 and name HD*) ! 0.3754 83:25 ----- 2.49, 4.15 A assign (resid 158 and name HN) (resid 158 and name HD*) 3.65 1.85 1.85 ! 0.9855 84:25 Intra 2.08, 3.84 A assign (resid 4 and name HN) (resid 4 and name HD*) 4.15 2.35 2.35 ! 0.9958 85:25 Intra 2.29, 3.81 A assign (resid 4 and name HE*) (resid 4 and name HD*) 2.30 0.50 0.50 ! 0.0000 90:25 Intra 2.45, 3.69 A assign (resid 159 and name HA) (resid 159 and name HD*) 3.65 1.85 1.85 ! 0.9317 93:25 Intra 2.45, 3.54 A assign (resid 169 and name HG2*) (resid 158 and name HD*) 2.30 0.50 0.50 ! 0.9896 98:25 Long 2.08, 4.48 A assign (resid 177 and name HG2*) (resid 4 and name HD*) 4.15 2.35 2.35 ! 0.9915 100:25 Long 2.16, 5.05 A assign (resid 14 and name HG1*) (resid 4 and name HD*) 3.15 1.35 1.35 ! 0.0000 102:25 Long 2.20, 4.43 A assign (resid 97 and name HE1) (resid 97 and name HD1) 2.30 0.50 0.50 ! 0.0000 121:25 Intra 2.54, 2.55 A assign (resid 97 and name HA) (resid 97 and name HD1) 3.15 1.35 1.35 ! 0.9890 122:25 Intra 3.02, 3.20 A assign (resid 97 and name HB*) (resid 97 and name HD1) 2.65 0.85 0.85 ! 0.9948 123:25 Intra 2.64, 3.25 A assign (resid 132 and name HE1) (resid 132 and name HD1) 2.30 0.50 0.50 ! 0.0000 124:25 Intra 2.49, 2.56 A assign (resid 132 and name HA) (resid 132 and name HD1) 2.65 0.85 0.85 ! 0.9906 126:25 Intra 2.58, 2.81 A assign (resid 132 and name HB1) (resid 132 and name HD1) 3.65 1.85 1.85 ! 0.0000 128:25 Intra 3.84, 3.89 A assign (resid 25 and name HG*) (resid 132 and name HD1) 4.15 2.35 2.35 ! 0.7813 129:25 Ambig 2.77, 4.45 A or (resid 135 and name HB1) (resid 132 and name HD1) ! 0.2187 129:25 ----- 3.43, 4.55 A assign (resid 136 and name HE1) (resid 132 and name HD1) 3.15 1.35 1.35 ! 0.7761 130:25 Ambig 3.29, 4.27 A or (resid 25 and name HB*) (resid 132 and name HD1) ! 0.2001 130:25 ----- 4.12, 5.09 A assign (resid 30 and name HG1*) (resid 132 and name HD1) 3.15 1.35 1.35 ! 0.9070 133:25 Ambig 3.23, 4.65 A or (resid 33 and name HD1*) (resid 132 and name HD1) ! 0.0930 133:25 ----- 4.72, 5.36 A assign (resid 97 and name HZ2) (resid 97 and name HH2) 2.65 0.85 0.85 ! 0.0000 134:25 Intra 2.41, 2.44 A assign (resid 154 and name HN) (resid 97 and name HH2) 4.15 2.35 2.35 ! 0.9663 135:25 Long 3.77, 4.23 A assign (resid 97 and name HZ3) (resid 97 and name HH2) 3.15 1.35 1.35 ! 0.0000 136:25 Intra 2.43, 2.44 A assign (resid 132 and name HZ2) (resid 132 and name HH2) 2.30 0.50 0.50 ! 0.9989 137:25 Intra 2.45, 2.47 A assign (resid 169 and name HG2*) (resid 132 and name HH2) 3.65 1.85 1.85 ! 0.9932 138:25 Long 2.06, 3.61 A assign (resid 36 and name HN) (resid 35 and name HA) 4.15 2.35 2.35 ! 0.9862 170:25 Seq 2.21, 2.30 A assign (resid 4 and name HD*) (resid 4 and name HE*) 2.30 0.50 0.50 ! 0.0000 171:25 Intra 2.45, 3.69 A assign (resid 16 and name HB1) (resid 4 and name HE*) 3.65 1.85 1.85 ! 0.7023 180:25 Ambig 4.04, 7.60 A or (resid 4 and name HB2) (resid 4 and name HE*) ! 0.2977 180:25 ----- 4.66, 5.05 A assign (resid 35 and name HB2) (resid 35 and name HA) 4.15 2.35 2.35 ! 0.9771 182:25 Intra 2.41, 2.49 A assign (resid 177 and name HG2*) (resid 4 and name HE*) 2.30 0.50 0.50 ! 0.9965 184:25 Long 2.33, 4.59 A assign (resid 2 and name HG2*) (resid 4 and name HE*) 2.65 0.85 0.85 ! 0.7612 185:25 Ambig 2.86, 5.34 A or (resid 177 and name HG1*) (resid 4 and name HE*) ! 0.2388 185:25 ----- 3.47, 5.22 A assign (resid 20 and name HD1*) (resid 4 and name HE*) 2.65 0.85 0.85 ! 0.8411 187:25 Ambig 2.02, 4.89 A or (resid 20 and name HG2*) (resid 4 and name HE*) ! 0.1589 187:25 ----- 2.67, 5.34 A assign (resid 97 and name HE1) (resid 97 and name HZ2) 3.15 1.35 1.35 ! 0.0000 189:25 Intra 2.84, 2.87 A assign (resid 97 and name HH2) (resid 97 and name HZ2) 2.65 0.85 0.85 ! 0.0000 190:25 Intra 2.41, 2.44 A assign (resid 154 and name HG) (resid 97 and name HZ2) 3.65 1.85 1.85 ! 0.0000 191:25 Long 4.23, 4.73 A assign (resid 132 and name HE1) (resid 132 and name HZ2) 2.65 0.85 0.85 ! 0.0000 192:25 Intra 2.77, 2.84 A assign (resid 132 and name HH2) (resid 132 and name HZ2) 2.65 0.85 0.85 ! 0.0000 193:25 Intra 2.45, 2.47 A assign (resid 23 and name HG1*) (resid 132 and name HZ2) 3.65 1.85 1.85 ! 0.0000 194:25 Long 2.36, 3.31 A assign (resid 132 and name HB2) (resid 132 and name HD1) 3.15 1.35 1.35 ! 0.0000 196:25 Intra 2.71, 2.86 A assign (resid 136 and name HG1) (resid 132 and name HH2) 3.15 1.35 1.35 ! 0.4842 198:25 Ambig 3.87, 5.20 A or (resid 33 and name HD2*) (resid 132 and name HH2) ! 0.1687 198:25 ----- 4.61, 6.20 A or (resid 136 and name HD*) (resid 132 and name HH2) ! 0.1677 198:25 ----- 4.62, 6.58 A or (resid 140 and name HD2*) (resid 132 and name HH2) ! 0.1608 198:25 ----- 4.65, 6.58 A assign (resid 97 and name HB*) (resid 97 and name HE3) 3.15 1.35 1.35 ! 0.5406 199:25 Ambig 2.46, 3.32 A or (resid 98 and name HA) (resid 97 and name HE3) ! 0.4594 199:25 ----- 2.53, 2.83 A assign (resid 5 and name HN) (resid 175 and name HD*) 3.15 1.35 1.35 ! 0.4373 200:25 Ambig 4.02, 5.74 A or (resid 8 and name HN) (resid 175 and name HD*) ! 0.3054 200:25 ----- 4.27, 6.68 A or (resid 8 and name HN) (resid 101 and name HD*) ! 0.1768 200:25 ----- 4.68, 6.86 A or (resid 105 and name HN) (resid 101 and name HD*) ! 0.0805 200:25 ----- 5.33, 5.91 A assign (resid 101 and name HE*) (resid 101 and name HD*) 2.30 0.50 0.50 ! 0.7219 201:25 Ambig 2.45, 3.69 A or (resid 4 and name HD*) (resid 175 and name HD*) ! 0.2666 201:25 ----- 2.89, 6.29 A assign (resid 175 and name HN) (resid 175 and name HD*) 2.65 0.85 0.85 ! 0.8207 202:25 Ambig 2.50, 3.96 A or (resid 97 and name HE3) (resid 94 and name HD*) ! 0.1675 202:25 ----- 3.25, 4.69 A assign (resid 136 and name HB1) (resid 158 and name HD*) 3.15 1.35 1.35 ! 0.8916 204:25 Ambig 3.49, 4.93 A or (resid 166 and name HB2) (resid 159 and name HD*) ! 0.1084 204:25 ----- 4.96, 6.39 A assign (resid 159 and name HB2) (resid 159 and name HD*) 2.65 0.85 0.85 ! 0.9826 205:25 Intra 2.27, 3.06 A assign (resid 18 and name HD1*) (resid 81 and name HD*) 2.65 0.85 0.85 ! 0.8509 206:25 Ambig 2.56, 5.28 A or (resid 18 and name HD2*) (resid 81 and name HD*) ! 0.1491 206:25 ----- 3.42, 6.47 A assign (resid 20 and name HD1*) (resid 4 and name HD*) 3.15 1.35 1.35 ! 0.9426 207:25 Long 2.69, 5.46 A assign (resid 177 and name HG1*) (resid 4 and name HD*) 3.65 1.85 1.85 ! 0.0000 208:25 Long 3.82, 5.78 A assign (resid 14 and name HG2*) (resid 4 and name HD*) 3.15 1.35 1.35 ! 0.8149 209:25 Ambig 3.43, 6.94 A or (resid 13 and name HG2*) (resid 4 and name HD*) ! 0.1526 209:25 ----- 4.53, 5.41 A assign (resid 4 and name HB2) (resid 4 and name HD*) 3.15 1.35 1.35 ! 0.0000 211:25 Intra 2.40, 3.06 A assign (resid 175 and name HB*) (resid 4 and name HD*) 3.15 1.35 1.35 ! 0.0000 212:25 Long 2.06, 4.64 A assign (resid 105 and name HG2*) (resid 175 and name HD*) 3.15 1.35 1.35 ! 0.6911 213:25 Ambig 3.23, 6.43 A or (resid 105 and name HG2*) (resid 101 and name HD*) ! 0.3089 213:25 ----- 3.70, 4.97 A assign (resid 4 and name HA) (resid 4 and name HD*) 3.15 1.35 1.35 ! 0.9794 219:25 Intra 2.92, 3.54 A assign (resid 86 and name HN) (resid 143 and name HD*) 3.65 1.85 1.85 ! 0.5663 226:25 Ambig 4.35, 5.00 A or (resid 141 and name HN) (resid 143 and name HD*) ! 0.4337 226:25 ----- 4.55, 6.91 A assign (resid 143 and name HN) (resid 143 and name HD*) 3.65 1.85 1.85 ! 0.8412 227:25 Ambig 2.46, 4.22 A or (resid 144 and name HN) (resid 143 and name HD*) ! 0.1588 227:25 ----- 3.24, 4.52 A assign (resid 151 and name HB1) (resid 97 and name HD1) 3.65 1.85 1.85 ! 0.8244 232:25 Ambig 3.26, 4.03 A or (resid 100 and name HB1) (resid 97 and name HD1) ! 0.0833 232:25 ----- 4.78, 5.72 A or (resid 93 and name HG*) (resid 97 and name HD1) ! 0.0768 232:25 ----- 4.85, 7.92 A assign (resid 154 and name HB2) (resid 97 and name HH2) 3.65 1.85 1.85 ! 0.9382 233:25 Long 3.05, 4.68 A assign (resid 155 and name HA) (resid 97 and name HH2) 4.15 2.35 2.35 ! 0.9406 234:25 Long 4.47, 4.94 A assign (resid 23 and name HG1*) (resid 132 and name HH2) 3.15 1.35 1.35 ! 0.0000 235:25 Long 3.69, 4.76 A assign (resid 2 and name HB) (resid 4 and name HE*) 3.15 1.35 1.35 ! 0.5050 236:25 Ambig 3.94, 6.20 A or (resid 20 and name HB) (resid 4 and name HE*) ! 0.4165 236:25 ----- 4.07, 6.56 A assign (resid 172 and name HB2) (resid 4 and name HE*) 3.65 1.85 1.85 ! 0.0000 237:25 Long 4.12, 5.87 A assign (resid 13 and name HG2*) (resid 4 and name HE*) 4.15 2.35 2.35 ! 0.0000 238:25 Long 6.59, 7.48 A assign (resid 175 and name HB*) (resid 4 and name HE*) 3.15 1.35 1.35 ! 0.5168 239:25 Ambig 3.81, 6.25 A or (resid 172 and name HE*) (resid 4 and name HE*) ! 0.4832 239:25 ----- 3.85, 7.10 A assign (resid 101 and name HB2) (resid 97 and name HZ2) 3.65 1.85 1.85 ! 0.0000 240:25 Mid 3.83, 4.45 A assign (resid 33 and name HD1*) (resid 132 and name HZ2) 3.65 1.85 1.85 ! 0.5715 242:25 Ambig 4.98, 6.52 A or (resid 30 and name HG1*) (resid 132 and name HZ2) ! 0.2671 242:25 ----- 5.65, 7.15 A or (resid 133 and name HD2*) (resid 132 and name HZ2) ! 0.1614 242:25 ----- 6.15, 7.50 A assign (resid 136 and name HG1) (resid 132 and name HZ2) 3.15 1.35 1.35 ! 0.6578 243:25 Ambig 3.10, 4.31 A or (resid 136 and name HD*) (resid 132 and name HZ2) ! 0.2534 243:25 ----- 3.63, 5.14 A or (resid 140 and name HD2*) (resid 132 and name HZ2) ! 0.0388 243:25 ----- 4.97, 7.18 A assign (resid 128 and name HB) (resid 129 and name HD*) 3.65 1.85 1.85 ! 0.6482 245:25 Ambig 3.74, 5.19 A or (resid 32 and name HA2) (resid 129 and name HD*) ! 0.3354 245:25 ----- 4.17, 6.22 A assign (resid 30 and name HG2*) (resid 132 and name HD1) 2.65 0.85 0.85 ! 0.5841 251:25 Ambig 2.73, 4.34 A or (resid 136 and name HD*) (resid 132 and name HD1) ! 0.3809 251:25 ----- 2.94, 5.56 A assign (resid 6 and name HB2) (resid 101 and name HE*) 3.65 1.85 1.85 ! 0.0000 256:25 Long 5.10, 7.21 A assign (resid 101 and name HD*) (resid 101 and name HE*) 2.30 0.50 0.50 ! 0.9843 257:25 Intra 2.45, 3.69 A assign (resid 35 and name HB2) (resid 35 and name HA) 3.15 1.35 1.35 ! 0.5383 259:25 Ambig 2.41, 2.49 A or (resid 35 and name HB1) (resid 35 and name HA) ! 0.4444 259:25 ----- 2.48, 2.98 A assign (resid 154 and name HN) (resid 97 and name HZ2) 2.65 0.85 0.85 ! 0.9963 262:25 Long 1.98, 2.35 A assign (resid 4 and name HB1) (resid 4 and name HD*) 3.15 1.35 1.35 ! 0.0000 263:25 Intra 2.31, 3.04 A assign (resid 14 and name HA) (resid 4 and name HD*) 3.65 1.85 1.85 ! 0.9129 264:25 Ambig 4.86, 7.16 A or (resid 34 and name HB2) (resid 4 and name HD*) ! 0.0871 264:25 ----- 7.19, 7.97 A assign (resid 125 and name HB2) (resid 129 and name HD*) 3.65 1.85 1.85 ! 0.9215 265:25 Mid 4.83, 5.69 A
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