NMR Restraints Grid
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NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
616874 |
5x3c   |
36056 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | ambi |
# Restraints file 1: all.tbl
assign (resid 24 and name HN) (resid 36 and name HN) 2.65 0.85 0.85 ! 0.9853 0:1 Long 2.58, 2.80 A
assign (resid 13 and name HN) (resid 12 and name HN) 2.65 0.85 0.85 ! 0.9837 1:1 Seq 1.97, 2.25 A
assign (resid 23 and name HN) (resid 22 and name HN) 2.65 0.85 0.85 ! 0.0000 2:1 Seq 2.22, 2.37 A
assign (resid 32 and name HN) (resid 31 and name HN) 2.30 0.50 0.50 ! 0.9402 3:1 Seq 1.91, 2.06 A
assign (resid 31 and name HD*) (resid 31 and name HN) 2.65 0.85 0.85 ! 0.0000 4:1 Intra 2.17, 3.75 A
assign (resid 18 and name HN) (resid 17 and name HN) 2.65 0.85 0.85 ! 0.9435 5:1 Seq 2.19, 2.51 A
assign (resid 12 and name HN) (resid 13 and name HN) 2.65 0.85 0.85 ! 0.9866 6:1 Seq 1.97, 2.25 A
assign (resid 22 and name HN) (resid 23 and name HN) 2.65 0.85 0.85 ! 0.0000 7:1 Seq 2.22, 2.37 A
assign (resid 31 and name HN) (resid 32 and name HN) 2.30 0.50 0.50 ! 0.9404 8:1 Seq 1.91, 2.06 A
assign (resid 9 and name HN) (resid 8 and name HN) 2.30 0.50 0.50 ! 0.9980 12:1 Seq 2.08, 2.17 A
assign (resid 31 and name HN) (resid 31 and name HD*) 2.65 0.85 0.85 ! 0.6828 14:1 Ambig 2.17, 3.75 A
or (resid 10 and name HN) (resid 7 and name HE21) ! 0.3139 14:1 ----- 2.47, 2.99 A
assign (resid 17 and name HN) (resid 18 and name HN) 2.65 0.85 0.85 ! 0.9989 15:1 Seq 2.19, 2.51 A
assign (resid 14 and name HN) (resid 13 and name HD*) 3.65 1.85 1.85 ! 0.9164 16:1 Seq 3.22, 4.36 A
assign (resid 31 and name HE*) (resid 31 and name HD*) 2.30 0.50 0.50 ! 0.0000 28:1 Intra 2.41, 3.68 A
assign (resid 32 and name HE*) (resid 32 and name HD*) 2.30 0.50 0.50 ! 0.9888 30:1 Intra 2.44, 3.68 A
assign (resid 13 and name HE*) (resid 13 and name HD*) 2.30 0.50 0.50 ! 0.9797 31:1 Intra 2.44, 3.68 A
assign (resid 8 and name HN) (resid 9 and name HN) 2.30 0.50 0.50 ! 0.9980 32:1 Seq 2.08, 2.17 A
assign (resid 31 and name HD*) (resid 31 and name HE*) 2.30 0.50 0.50 ! 0.0000 36:1 Intra 2.41, 3.68 A
assign (resid 32 and name HD*) (resid 32 and name HE*) 2.30 0.50 0.50 ! 0.9888 38:1 Intra 2.44, 3.68 A
assign (resid 13 and name HD*) (resid 13 and name HE*) 2.30 0.50 0.50 ! 0.0000 39:1 Intra 2.44, 3.68 A
assign (resid 24 and name HN) (resid 35 and name HA) 3.65 1.85 1.85 ! 0.0000 40:1 Long 3.81, 4.07 A
assign (resid 24 and name HN) (resid 23 and name HA) 2.65 0.85 0.85 ! 0.0000 41:1 Seq 2.16, 2.27 A
assign (resid 34 and name HN) (resid 33 and name HA) 2.30 0.50 0.50 ! 0.9986 42:1 Seq 2.25, 2.30 A
assign (resid 36 and name HN) (resid 35 and name HA) 2.30 0.50 0.50 ! 0.8821 43:1 Seq 2.05, 2.09 A
assign (resid 34 and name HN) (resid 34 and name HA) 3.65 1.85 1.85 ! 0.0000 44:1 Intra 2.88, 2.91 A
assign (resid 36 and name HN) (resid 23 and name HA) 3.15 1.35 1.35 ! 0.5181 45:1 Ambig 4.11, 4.45 A
or (resid 26 and name HN) (resid 34 and name HA) ! 0.3769 45:1 ----- 4.33, 4.50 A
assign (resid 3 and name HN) (resid 101 and name H1) 3.65 1.85 1.85 ! 0.9605 46:1 Long 2.17, 3.96 A
assign (resid 28 and name HN) (resid 33 and name HA) 2.30 0.50 0.50 ! 0.9858 47:1 Long 1.90, 1.99 A
assign (resid 14 and name HN) (resid 15 and name HN) 2.65 0.85 0.85 ! 0.0000 48:1 Seq 2.18, 2.39 A
assign (resid 35 and name HN) (resid 35 and name HA) 3.15 1.35 1.35 ! 0.0000 49:1 Intra 2.84, 2.87 A
assign (resid 29 and name HN) (resid 29 and name HA) 2.65 0.85 0.85 ! 0.7742 51:1 Ambig 2.90, 2.91 A
or (resid 31 and name HN) (resid 29 and name HA) ! 0.1318 51:1 ----- 3.90, 4.15 A
assign (resid 23 and name HN) (resid 23 and name HA) 3.15 1.35 1.35 ! 0.9826 54:1 Intra 2.91, 2.92 A
assign (resid 8 and name HN) (resid 8 and name HA) 3.15 1.35 1.35 ! 0.8801 55:1 Intra 2.93, 2.95 A
assign (resid 29 and name HD21) (resid 29 and name HA) 3.65 1.85 1.85 ! 0.0000 56:1 Intra 2.97, 3.97 A
assign (resid 9 and name HN) (resid 8 and name HA) 3.15 1.35 1.35 ! 0.8026 58:1 Seq 3.46, 3.53 A
assign (resid 13 and name HE*) (resid 8 and name HA) 2.65 0.85 0.85 ! 0.9300 59:1 Long 2.30, 4.13 A
assign (resid 24 and name HN) (resid 24 and name HA) 2.65 0.85 0.85 ! 0.8440 61:1 Intra 2.91, 2.93 A
assign (resid 26 and name HN) (resid 25 and name HA) 2.30 0.50 0.50 ! 0.9245 62:1 Seq 2.12, 2.15 A
assign (resid 12 and name HN) (resid 12 and name HA1) 2.65 0.85 0.85 ! 0.9140 63:1 Intra 2.91, 2.93 A
assign (resid 3 and name HN) (resid 2 and name HA) 2.30 0.50 0.50 ! 0.5822 64:1 Ambig 2.08, 2.25 A
or (resid 4 and name HN) (resid 3 and name HA) ! 0.3336 64:1 ----- 2.29, 2.54 A
assign (resid 27 and name HN) (resid 26 and name HA) 2.30 0.50 0.50 ! 0.9683 65:1 Seq 1.99, 2.04 A
assign (resid 25 and name HN) (resid 24 and name HA) 2.30 0.50 0.50 ! 0.8580 67:1 Seq 2.11, 2.26 A
assign (resid 5 and name HN) (resid 4 and name HA) 2.30 0.50 0.50 ! 0.0000 68:1 Seq 2.09, 2.13 A
assign (resid 4 and name HN) (resid 4 and name HA) 3.15 1.35 1.35 ! 0.9714 69:1 Intra 2.74, 2.78 A
assign (resid 31 and name HN) (resid 31 and name HA) 2.65 0.85 0.85 ! 0.9460 70:1 Intra 2.90, 2.92 A
assign (resid 22 and name HN) (resid 22 and name HA1) 2.65 0.85 0.85 ! 0.0000 71:1 Intra 2.92, 2.93 A
assign (resid 10 and name HN) (resid 9 and name HA2) 2.30 0.50 0.50 ! 0.9518 72:1 Seq 2.72, 2.79 A
assign (resid 22 and name HN) (resid 21 and name HA) 2.30 0.50 0.50 ! 0.0000 73:1 Seq 2.08, 2.15 A
assign (resid 5 and name HN) (resid 5 and name HA) 2.65 0.85 0.85 ! 0.0000 74:1 Intra 2.20, 2.23 A
assign (resid 21 and name HN) (resid 19 and name HA) 4.15 2.35 2.35 ! 0.5591 75:1 Ambig 5.81, 6.23 A
or (resid 35 and name HN) (resid 19 and name HA) ! 0.4409 75:1 ----- 6.04, 6.25 A
assign (resid 17 and name HN) (resid 17 and name HA) 3.15 1.35 1.35 ! 0.0000 76:1 Intra 2.85, 2.88 A
assign (resid 14 and name HN) (resid 13 and name HA) 2.30 0.50 0.50 ! 0.9944 78:1 Seq 2.13, 2.19 A
assign (resid 17 and name HN) (resid 16 and name HA) 2.30 0.50 0.50 ! 0.9893 80:1 Seq 2.12, 2.17 A
assign (resid 14 and name HN) (resid 14 and name HA) 3.15 1.35 1.35 ! 0.0000 81:1 Intra 2.86, 2.90 A
assign (resid 11 and name HN) (resid 31 and name HA) 2.30 0.50 0.50 ! 0.0000 85:1 Long 1.79, 2.04 A
assign (resid 11 and name HN) (resid 10 and name HA2) 2.65 0.85 0.85 ! 0.9854 86:1 Seq 2.34, 2.42 A
assign (resid 7 and name HN) (resid 7 and name HA) 3.15 1.35 1.35 ! 0.0000 88:1 Intra 2.81, 2.85 A
assign (resid 21 and name HN) (resid 20 and name HA) 2.30 0.50 0.50 ! 0.9829 90:1 Seq 2.10, 2.28 A
assign (resid 19 and name HN) (resid 18 and name HA) 2.30 0.50 0.50 ! 0.7396 91:1 Ambig 2.06, 2.14 A
or (resid 2 and name HN) (resid 1 and name HB) ! 0.2421 91:1 ----- 2.49, 3.76 A
assign (resid 20 and name HN) (resid 19 and name HA) 3.15 1.35 1.35 ! 0.0000 92:1 Seq 2.19, 2.29 A
assign (resid 23 and name HN) (resid 22 and name HA1) 3.15 1.35 1.35 ! 0.0000 94:1 Seq 3.02, 3.14 A
assign (resid 23 and name HN) (resid 21 and name HA) 3.15 1.35 1.35 ! 0.9867 98:1 Mid 3.05, 3.33 A
assign (resid 20 and name HN) (resid 20 and name HA) 2.65 0.85 0.85 ! 0.5584 99:1 Ambig 2.76, 2.81 A
or (resid 20 and name HN) (resid 1 and name HB) ! 0.4367 99:1 ----- 2.88, 4.76 A
assign (resid 13 and name HN) (resid 13 and name HA) 2.65 0.85 0.85 ! 0.5368 100:1 Ambig 2.79, 2.83 A
or (resid 32 and name HN) (resid 32 and name HA) ! 0.4397 100:1 ----- 2.88, 2.90 A
assign (resid 32 and name HN) (resid 31 and name HA) 3.15 1.35 1.35 ! 0.8953 102:1 Seq 3.41, 3.48 A
assign (resid 8 and name HN) (resid 7 and name HA) 2.30 0.50 0.50 ! 0.9033 103:1 Seq 2.02, 2.09 A
assign (resid 34 and name HE21) (resid 5 and name HA) 3.65 1.85 1.85 ! 0.0000 104:1 Long 1.93, 2.73 A
assign (resid 7 and name HE21) (resid 32 and name HA) 3.15 1.35 1.35 ! 0.9688 105:1 Long 2.04, 3.02 A
assign (resid 32 and name HD*) (resid 32 and name HA) 2.65 0.85 0.85 ! 0.7374 106:1 Ambig 2.54, 3.49 A
or (resid 7 and name HE22) (resid 32 and name HA) ! 0.1871 106:1 ----- 3.20, 3.79 A
assign (resid 13 and name HD*) (resid 13 and name HA) 2.65 0.85 0.85 ! 0.9732 107:1 Intra 2.31, 3.47 A
assign (resid 18 and name HN) (resid 16 and name HA) 3.65 1.85 1.85 ! 0.0000 108:1 Mid 3.15, 3.48 A
assign (resid 4 and name HD2) (resid 36 and name HA) 3.15 1.35 1.35 ! 0.0000 109:1 Long 2.02, 2.23 A
assign (resid 31 and name HD*) (resid 31 and name HA) 2.65 0.85 0.85 ! 0.0000 110:1 Intra 2.61, 3.52 A
assign (resid 7 and name HE21) (resid 10 and name HA2) 3.65 1.85 1.85 ! 0.8349 111:1 Mid 3.88, 4.21 A
assign (resid 13 and name HD*) (resid 9 and name HA2) 2.65 0.85 0.85 ! 0.9939 112:1 Mid 2.51, 4.51 A
assign (resid 18 and name HN) (resid 18 and name HA) 3.15 1.35 1.35 ! 0.9788 113:1 Intra 2.86, 2.90 A
assign (resid 33 and name HN) (resid 32 and name HA) 2.30 0.50 0.50 ! 0.9988 114:1 Seq 2.04, 2.08 A
assign (resid 32 and name HE*) (resid 7 and name HA) 3.15 1.35 1.35 ! 0.0000 115:1 Long 3.23, 4.67 A
assign (resid 9 and name HN) (resid 9 and name HA2) 2.65 0.85 0.85 ! 0.7970 116:1 Ambig 2.90, 2.93 A
or (resid 9 and name HN) (resid 7 and name HA) ! 0.2030 116:1 ----- 3.64, 3.79 A
assign (resid 13 and name HE*) (resid 17 and name HA) 3.65 1.85 1.85 ! 0.0000 117:1 Mid 2.11, 5.01 A
assign (resid 13 and name HE*) (resid 17 and name HB) 3.65 1.85 1.85 ! 0.5722 118:1 Ambig 4.25, 7.16 A
or (resid 13 and name HE*) (resid 13 and name HA) ! 0.3625 118:1 ----- 4.59, 5.30 A
assign (resid 13 and name HE*) (resid 9 and name HA2) 3.65 1.85 1.85 ! 0.8662 119:1 Mid 4.23, 5.89 A
assign (resid 24 and name HN) (resid 24 and name HB) 3.15 1.35 1.35 ! 0.0000 120:1 Intra 3.65, 3.70 A
assign (resid 34 and name HN) (resid 27 and name HA) 3.65 1.85 1.85 ! 0.9791 121:1 Long 3.88, 4.02 A
assign (resid 36 and name HN) (resid 23 and name HB) 2.65 0.85 0.85 ! 0.9817 122:1 Long 3.07, 3.24 A
assign (resid 12 and name HN) (resid 11 and name HA) 2.30 0.50 0.50 ! 0.9922 123:1 Seq 2.09, 2.12 A
assign (resid 12 and name HN) (resid 12 and name HA2) 2.65 0.85 0.85 ! 0.9990 124:1 Intra 2.37, 2.42 A
assign (resid 34 and name HN) (resid 33 and name HB1) 2.65 0.85 0.85 ! 0.0000 125:1 Seq 3.09, 3.23 A
assign (resid 6 and name HN) (resid 5 and name HA) 2.65 0.85 0.85 ! 0.8180 126:1 Seq 2.15, 3.05 A
assign (resid 28 and name HN) (resid 27 and name HA) 2.30 0.50 0.50 ! 0.8389 127:1 Seq 2.16, 2.23 A
assign (resid 25 and name HN) (resid 24 and name HB) 2.65 0.85 0.85 ! 0.0000 128:1 Seq 2.71, 2.92 A
assign (resid 4 and name HN) (resid 3 and name HB2) 3.15 1.35 1.35 ! 0.7587 129:1 Ambig 2.00, 2.76 A
or (resid 3 and name HN) (resid 3 and name HB2) ! 0.2413 129:1 ----- 2.43, 3.07 A
assign (resid 22 and name HN) (resid 21 and name HB*) 3.15 1.35 1.35 ! 0.0000 130:1 Seq 3.00, 3.76 A
assign (resid 10 and name HN) (resid 10 and name HA1) 2.30 0.50 0.50 ! 0.9002 131:1 Intra 2.26, 2.29 A
assign (resid 4 and name HN) (resid 3 and name HB1) 2.65 0.85 0.85 ! 0.7168 132:1 Ambig 1.96, 2.99 A
or (resid 3 and name HN) (resid 3 and name HB1) ! 0.1535 132:1 ----- 2.54, 3.22 A
assign (resid 6 and name HN) (resid 6 and name HA1) 2.65 0.85 0.85 ! 0.0000 133:1 Intra 2.29, 2.40 A
assign (resid 22 and name HN) (resid 22 and name HA2) 2.65 0.85 0.85 ! 0.0000 134:1 Intra 2.36, 2.41 A
assign (resid 3 and name HN) (resid 101 and name H5) 3.65 1.85 1.85 ! 0.6679 135:1 Ambig 2.56, 4.79 A
or (resid 4 and name HN) (resid 101 and name H5) ! 0.2909 135:1 ----- 2.94, 5.74 A
assign (resid 7 and name HN) (resid 6 and name HA2) 2.65 0.85 0.85 ! 0.9970 136:1 Seq 2.24, 2.32 A
assign (resid 21 and name HN) (resid 21 and name HB*) 2.65 0.85 0.85 ! 0.0000 139:1 Intra 2.43, 3.02 A
assign (resid 11 and name HN) (resid 10 and name HA1) 2.30 0.50 0.50 ! 0.4433 141:1 Ambig 2.78, 2.90 A
or (resid 11 and name HN) (resid 11 and name HA) ! 0.4173 141:1 ----- 2.81, 2.83 A
assign (resid 35 and name HN) (resid 6 and name HA1) 3.65 1.85 1.85 ! 0.0000 142:1 Long 4.10, 4.34 A
assign (resid 7 and name HN) (resid 6 and name HA1) 2.65 0.85 0.85 ! 0.0000 143:1 Seq 2.79, 2.94 A
assign (resid 31 and name HN) (resid 30 and name HD2) 3.15 1.35 1.35 ! 0.9868 144:1 Seq 2.19, 2.43 A
assign (resid 19 and name HN) (resid 19 and name HB1) 3.15 1.35 1.35 ! 0.7053 145:1 Ambig 3.57, 3.62 A
or (resid 2 and name HN) (resid 19 and name HB1) ! 0.1347 145:1 ----- 4.70, 5.10 A
assign (resid 14 and name HN) (resid 14 and name HB1) 3.15 1.35 1.35 ! 0.9453 146:1 Intra 2.69, 2.99 A
assign (resid 20 and name HN) (resid 3 and name HB2) 4.15 2.35 2.35 ! 0.0000 149:1 Long 4.77, 5.88 A
assign (resid 23 and name HN) (resid 23 and name HB) 3.15 1.35 1.35 ! 0.9415 150:1 Intra 3.76, 3.80 A
assign (resid 23 and name HN) (resid 22 and name HA2) 3.15 1.35 1.35 ! 0.9203 152:1 Seq 3.24, 3.39 A
assign (resid 20 and name HN) (resid 19 and name HB1) 3.15 1.35 1.35 ! 0.9746 153:1 Seq 2.42, 2.63 A
assign (resid 13 and name HN) (resid 11 and name HA) 2.65 0.85 0.85 ! 0.6407 154:1 Ambig 3.09, 3.24 A
or (resid 13 and name HN) (resid 10 and name HA1) ! 0.1368 154:1 ----- 4.00, 4.23 A
or (resid 32 and name HN) (resid 10 and name HA1) ! 0.1043 154:1 ----- 4.19, 4.32 A
assign (resid 13 and name HN) (resid 12 and name HA2) 3.15 1.35 1.35 ! 0.7403 155:1 Ambig 3.15, 3.32 A
or (resid 32 and name HN) (resid 30 and name HD2) ! 0.2295 155:1 ----- 3.83, 4.07 A
assign (resid 29 and name HD21) (resid 30 and name HD2) 4.15 2.35 2.35 ! 0.0000 156:1 Seq 5.11, 5.59 A
assign (resid 7 and name HE21) (resid 10 and name HA1) 3.65 1.85 1.85 ! 0.9949 157:1 Mid 2.17, 2.62 A
assign (resid 13 and name HD*) (resid 9 and name HA1) 3.15 1.35 1.35 ! 0.7484 158:1 Ambig 4.12, 6.00 A
or (resid 13 and name HD*) (resid 10 and name HA1) ! 0.1998 158:1 ----- 5.13, 5.57 A
assign (resid 31 and name HD*) (resid 30 and name HD2) 3.15 1.35 1.35 ! 0.9829 159:1 Seq 2.50, 4.59 A
assign (resid 9 and name HN) (resid 9 and name HA1) 2.65 0.85 0.85 ! 0.9328 160:1 Intra 2.58, 2.65 A
assign (resid 9 and name HN) (resid 33 and name HB1) 3.65 1.85 1.85 ! 0.0000 161:1 Long 3.17, 3.36 A
assign (resid 33 and name HN) (resid 33 and name HB1) 3.15 1.35 1.35 ! 0.0000 162:1 Intra 3.75, 3.78 A
assign (resid 13 and name HE*) (resid 15 and name HA2) 3.65 1.85 1.85 ! 0.0000 163:1 Mid 4.43, 5.13 A
assign (resid 13 and name HE*) (resid 15 and name HA1) 3.15 1.35 1.35 ! 0.0000 164:1 Mid 2.97, 3.65 A
assign (resid 26 and name HN) (resid 25 and name HB2) 3.65 1.85 1.85 ! 0.8079 165:1 Seq 4.31, 4.41 A
assign (resid 36 and name HN) (resid 35 and name HB1) 3.15 1.35 1.35 ! 0.9424 166:1 Seq 3.31, 3.48 A
assign (resid 36 and name HN) (resid 35 and name HB2) 3.65 1.85 1.85 ! 0.7133 167:1 Ambig 4.12, 4.24 A
or (resid 26 and name HN) (resid 33 and name HB2) ! 0.1911 167:1 ----- 5.13, 5.34 A
assign (resid 34 and name HN) (resid 33 and name HB2) 3.15 1.35 1.35 ! 0.9008 168:1 Seq 3.92, 4.03 A
assign (resid 5 and name HN) (resid 4 and name HB*) 3.65 1.85 1.85 ! 0.0000 169:1 Seq 4.02, 4.16 A
assign (resid 4 and name HN) (resid 4 and name HB*) 2.65 0.85 0.85 ! 0.9968 170:1 Intra 2.32, 2.51 A
assign (resid 25 and name HN) (resid 25 and name HB2) 2.30 0.50 0.50 ! 0.0000 171:1 Intra 2.55, 2.64 A
assign (resid 25 and name HN) (resid 25 and name HB1) 2.30 0.50 0.50 ! 0.9941 172:1 Intra 2.47, 2.51 A
assign (resid 31 and name HN) (resid 31 and name HB2) 2.65 0.85 0.85 ! 0.5175 173:1 Ambig 2.43, 2.58 A
or (resid 10 and name HN) (resid 13 and name HB1) ! 0.4496 173:1 ----- 2.49, 2.62 A
assign (resid 5 and name HN) (resid 35 and name HB2) 3.65 1.85 1.85 ! 0.0000 174:1 Long 2.64, 3.00 A
assign (resid 31 and name HN) (resid 31 and name HB1) 3.15 1.35 1.35 ! 0.6513 175:1 Ambig 3.65, 3.72 A
or (resid 19 and name HN) (resid 8 and name HB2) ! 0.1924 175:1 ----- 4.47, 4.74 A
assign (resid 11 and name HN) (resid 31 and name HB1) 3.65 1.85 1.85 ! 0.0000 176:1 Long 4.11, 4.37 A
assign (resid 31 and name HN) (resid 29 and name HB*) 2.65 0.85 0.85 ! 0.4824 177:1 Ambig 2.40, 2.93 A
or (resid 29 and name HN) (resid 29 and name HB*) ! 0.4376 177:1 ----- 2.44, 3.09 A
assign (resid 35 and name HN) (resid 35 and name HB1) 3.15 1.35 1.35 ! 0.9900 178:1 Intra 3.55, 3.61 A
assign (resid 35 and name HN) (resid 8 and name HB1) 3.65 1.85 1.85 ! 0.9854 179:1 Long 3.22, 3.56 A
assign (resid 14 and name HN) (resid 13 and name HB1) 3.65 1.85 1.85 ! 0.5515 180:1 Ambig 4.27, 4.34 A
or (resid 11 and name HN) (resid 31 and name HB2) ! 0.2807 180:1 ----- 4.78, 5.01 A
assign (resid 35 and name HN) (resid 35 and name HB2) 2.65 0.85 0.85 ! 0.9960 181:1 Intra 2.46, 2.53 A
assign (resid 29 and name HN) (resid 32 and name HB*) 3.15 1.35 1.35 ! 0.7874 182:1 Ambig 2.93, 4.05 A
or (resid 28 and name HN) (resid 33 and name HB2) ! 0.0664 182:1 ----- 4.42, 4.62 A
assign (resid 14 and name HN) (resid 13 and name HB2) 3.65 1.85 1.85 ! 0.6581 183:1 Ambig 4.30, 4.47 A
or (resid 11 and name HN) (resid 13 and name HB2) ! 0.3045 183:1 ----- 4.89, 5.12 A
assign (resid 20 and name HN) (resid 35 and name HB1) 3.65 1.85 1.85 ! 0.0000 185:1 Long 3.95, 4.32 A
assign (resid 8 and name HN) (resid 8 and name HB2) 3.15 1.35 1.35 ! 0.5534 186:1 Ambig 3.62, 3.68 A
or (resid 32 and name HN) (resid 31 and name HB1) ! 0.4077 186:1 ----- 3.81, 3.96 A
assign (resid 32 and name HN) (resid 29 and name HB*) 3.65 1.85 1.85 ! 0.9988 187:1 Mid 1.78, 2.56 A
assign (resid 29 and name HD21) (resid 29 and name HB*) 2.30 0.50 0.50 ! 0.0000 188:1 Intra 2.14, 2.79 A
assign (resid 13 and name HN) (resid 13 and name HB1) 2.30 0.50 0.50 ! 0.5580 189:1 Ambig 2.44, 2.54 A
or (resid 32 and name HN) (resid 31 and name HB2) ! 0.2328 189:1 ----- 2.83, 2.95 A
or (resid 8 and name HN) (resid 8 and name HB1) ! 0.2034 189:1 ----- 2.89, 2.98 A
assign (resid 29 and name HD21) (resid 32 and name HB*) 3.65 1.85 1.85 ! 0.0000 190:1 Mid 1.99, 3.06 A
assign (resid 13 and name HN) (resid 13 and name HB2) 2.30 0.50 0.50 ! 0.5407 191:1 Ambig 2.57, 2.68 A
or (resid 32 and name HN) (resid 32 and name HB*) ! 0.4483 191:1 ----- 2.65, 2.85 A
assign (resid 31 and name HD*) (resid 31 and name HB1) 2.30 0.50 0.50 ! 0.0000 192:1 Intra 2.33, 3.05 A
assign (resid 4 and name HD2) (resid 4 and name HB*) 3.15 1.35 1.35 ! 0.0000 193:1 Intra 2.78, 3.43 A
assign (resid 31 and name HD*) (resid 29 and name HB*) 3.65 1.85 1.85 ! 0.0000 194:1 Mid 3.44, 5.87 A
assign (resid 29 and name HD22) (resid 29 and name HB*) 2.65 0.85 0.85 ! 0.0000 195:1 Intra 3.43, 3.73 A
assign (resid 7 and name HE21) (resid 31 and name HB2) 3.65 1.85 1.85 ! 0.4430 196:1 Ambig 4.98, 5.78 A
or (resid 18 and name HN) (resid 8 and name HB1) ! 0.3375 196:1 ----- 5.21, 5.91 A
or (resid 18 and name HN) (resid 25 and name HB1) ! 0.1829 196:1 ----- 5.77, 7.12 A
assign (resid 31 and name HD*) (resid 31 and name HB2) 2.30 0.50 0.50 ! 0.0000 197:1 Intra 2.28, 3.05 A
assign (resid 7 and name HE21) (resid 13 and name HB1) 3.15 1.35 1.35 ! 0.9205 198:1 Long 3.27, 4.16 A
assign (resid 13 and name HD*) (resid 13 and name HB1) 2.30 0.50 0.50 ! 0.9969 199:1 Intra 2.25, 3.01 A
assign (resid 29 and name HD22) (resid 32 and name HB*) 2.65 0.85 0.85 ! 0.9998 200:1 Mid 1.81, 4.03 A
assign (resid 32 and name HD*) (resid 32 and name HB*) 2.30 0.50 0.50 ! 0.7404 201:1 Ambig 2.33, 3.05 A
or (resid 7 and name HE22) (resid 13 and name HB2) ! 0.2368 201:1 ----- 2.82, 3.26 A
assign (resid 7 and name HE21) (resid 13 and name HB2) 3.15 1.35 1.35 ! 0.9921 202:1 Long 1.80, 2.73 A
assign (resid 13 and name HD*) (resid 13 and name HB2) 2.30 0.50 0.50 ! 0.0000 203:1 Intra 2.53, 3.09 A
assign (resid 31 and name HE*) (resid 31 and name HB1) 3.65 1.85 1.85 ! 0.0000 204:1 Intra 4.60, 5.05 A
assign (resid 31 and name HE*) (resid 31 and name HB2) 3.15 1.35 1.35 ! 0.0000 206:1 Intra 4.57, 5.05 A
assign (resid 33 and name HN) (resid 33 and name HB2) 2.65 0.85 0.85 ! 0.9446 207:1 Intra 2.62, 2.69 A
assign (resid 9 and name HN) (resid 33 and name HB2) 2.65 0.85 0.85 ! 0.9998 208:1 Long 1.79, 1.86 A
assign (resid 32 and name HE*) (resid 32 and name HB*) 3.15 1.35 1.35 ! 0.9213 209:1 Intra 4.61, 5.05 A
assign (resid 13 and name HE*) (resid 13 and name HB1) 3.65 1.85 1.85 ! 0.5356 210:1 Ambig 4.56, 5.03 A
or (resid 13 and name HE*) (resid 8 and name HB1) ! 0.4644 210:1 ----- 4.67, 6.33 A
assign (resid 13 and name HE*) (resid 13 and name HB2) 3.65 1.85 1.85 ! 0.0000 211:1 Intra 4.73, 5.08 A
assign (resid 26 and name HN) (resid 26 and name HG1) 3.15 1.35 1.35 ! 0.6042 212:1 Ambig 2.74, 2.97 A
or (resid 36 and name HN) (resid 26 and name HG1) ! 0.3958 212:1 ----- 2.94, 3.30 A
assign (resid 36 and name HN) (resid 26 and name HG2) 3.15 1.35 1.35 ! 0.5118 213:1 Ambig 2.65, 4.76 A
or (resid 26 and name HN) (resid 26 and name HG2) ! 0.4738 213:1 ----- 2.68, 3.76 A
assign (resid 26 and name HN) (resid 26 and name HB1) 3.15 1.35 1.35 ! 0.9029 214:1 Intra 3.61, 3.71 A
assign (resid 3 and name HN) (resid 2 and name HG1) 3.15 1.35 1.35 ! 0.9943 215:1 Seq 2.20, 2.64 A
assign (resid 27 and name HN) (resid 26 and name HG1) 3.65 1.85 1.85 ! 0.8775 216:1 Seq 4.92, 5.10 A
assign (resid 25 and name HN) (resid 19 and name HB2) 3.65 1.85 1.85 ! 0.8584 217:1 Long 3.31, 3.77 A
assign (resid 27 and name HN) (resid 26 and name HB1) 2.65 0.85 0.85 ! 0.8069 218:1 Seq 3.23, 3.43 A
assign (resid 17 and name HN) (resid 16 and name HB1) 3.15 1.35 1.35 ! 0.0000 219:1 Seq 3.88, 4.13 A
assign (resid 7 and name HN) (resid 2 and name HG2) 3.65 1.85 1.85 ! 0.8927 220:1 Long 3.14, 4.15 A
assign (resid 19 and name HN) (resid 19 and name HB2) 2.65 0.85 0.85 ! 0.6374 221:1 Ambig 2.39, 2.47 A
or (resid 10 and name HN) (resid 7 and name HG1) ! 0.2764 221:1 ----- 2.75, 3.46 A
assign (resid 35 and name HN) (resid 2 and name HG2) 3.65 1.85 1.85 ! 0.7154 222:1 Ambig 4.11, 4.38 A
or (resid 21 and name HN) (resid 19 and name HB2) ! 0.0994 222:1 ----- 5.71, 6.17 A
assign (resid 35 and name HN) (resid 34 and name HG*) 3.15 1.35 1.35 ! 0.0000 224:1 Seq 2.63, 4.03 A
assign (resid 7 and name HN) (resid 7 and name HB2) 2.65 0.85 0.85 ! 0.0000 225:1 Intra 2.56, 2.66 A
assign (resid 2 and name HE21) (resid 2 and name HG1) 3.65 1.85 1.85 ! 0.0000 226:1 Intra 2.21, 3.31 A
assign (resid 2 and name HE21) (resid 2 and name HG2) 3.15 1.35 1.35 ! 0.9752 227:1 Intra 2.14, 2.23 A
assign (resid 20 and name HN) (resid 19 and name HB2) 3.65 1.85 1.85 ! 0.9660 228:1 Seq 3.49, 3.73 A
assign (resid 8 and name HN) (resid 7 and name HG1) 2.65 0.85 0.85 ! 0.7383 230:1 Ambig 2.91, 3.25 A
or (resid 8 and name HN) (resid 2 and name HG2) ! 0.2306 230:1 ----- 3.53, 3.92 A
assign (resid 8 and name HN) (resid 7 and name HB2) 3.65 1.85 1.85 ! 0.8638 231:1 Seq 4.05, 4.24 A
assign (resid 34 and name HE21) (resid 34 and name HG*) 3.15 1.35 1.35 ! 0.0000 232:1 Intra 2.20, 3.00 A
assign (resid 26 and name HE21) (resid 26 and name HG1) 3.15 1.35 1.35 ! 0.0000 233:1 Intra 2.18, 2.32 A
assign (resid 2 and name HE22) (resid 2 and name HG2) 3.65 1.85 1.85 ! 0.9841 234:1 Intra 3.40, 3.48 A
assign (resid 7 and name HE21) (resid 7 and name HG1) 2.65 0.85 0.85 ! 0.0000 235:1 Intra 2.15, 2.52 A
assign (resid 32 and name HD*) (resid 7 and name HG1) 2.65 0.85 0.85 ! 0.7332 236:1 Ambig 2.89, 4.61 A
or (resid 7 and name HE22) (resid 7 and name HG1) ! 0.2668 236:1 ----- 3.42, 3.58 A
assign (resid 26 and name HE21) (resid 26 and name HG2) 3.65 1.85 1.85 ! 0.0000 237:1 Intra 2.19, 2.82 A
assign (resid 32 and name HD*) (resid 7 and name HB2) 3.65 1.85 1.85 ! 0.9264 238:1 Long 2.58, 4.67 A
assign (resid 26 and name HE22) (resid 26 and name HG1) 3.65 1.85 1.85 ! 0.0000 239:1 Intra 3.45, 3.51 A
assign (resid 33 and name HN) (resid 7 and name HG1) 3.15 1.35 1.35 ! 0.9584 240:1 Long 2.05, 2.23 A
assign (resid 9 and name HN) (resid 7 and name HG1) 2.65 0.85 0.85 ! 0.9697 241:1 Mid 2.87, 3.38 A
assign (resid 32 and name HE*) (resid 7 and name HG1) 3.65 1.85 1.85 ! 0.0000 242:1 Long 3.55, 5.19 A
assign (resid 34 and name HE22) (resid 34 and name HG*) 3.15 1.35 1.35 ! 0.0000 243:1 Intra 3.45, 3.82 A
assign (resid 32 and name HE*) (resid 7 and name HB2) 2.65 0.85 0.85 ! 0.0000 244:1 Long 2.05, 4.15 A
assign (resid 13 and name HE*) (resid 16 and name HG1) 3.65 1.85 1.85 ! 0.5224 245:1 Ambig 4.83, 6.24 A
or (resid 13 and name HE*) (resid 7 and name HB2) ! 0.4776 245:1 ----- 4.90, 6.11 A
assign (resid 24 and name HN) (resid 36 and name HB*) 3.65 1.85 1.85 ! 0.0000 246:1 Long 3.84, 4.49 A
assign (resid 34 and name HN) (resid 34 and name HG*) 3.15 1.35 1.35 ! 0.0000 247:1 Intra 2.39, 3.03 A
assign (resid 26 and name HN) (resid 26 and name HB2) 2.65 0.85 0.85 ! 0.9302 248:1 Intra 2.41, 2.57 A
assign (resid 34 and name HN) (resid 34 and name HB*) 2.65 0.85 0.85 ! 0.6615 249:1 Ambig 2.39, 3.49 A
or (resid 34 and name HN) (resid 28 and name HG) ! 0.3378 249:1 ----- 2.67, 2.85 A
assign (resid 12 and name HN) (resid 11 and name HG11) 3.65 1.85 1.85 ! 0.7037 250:1 Ambig 5.00, 5.06 A
or (resid 34 and name HN) (resid 36 and name HB*) ! 0.2963 250:1 ----- 5.77, 6.60 A
assign (resid 36 and name HN) (resid 36 and name HB*) 2.65 0.85 0.85 ! 0.9569 251:1 Intra 2.46, 3.17 A
assign (resid 12 and name HN) (resid 11 and name HB) 3.65 1.85 1.85 ! 0.8818 252:1 Seq 4.15, 4.26 A
assign (resid 36 and name HN) (resid 36 and name HG) 3.15 1.35 1.35 ! 0.7934 253:1 Ambig 2.95, 3.13 A
or (resid 26 and name HN) (resid 36 and name HG) ! 0.2066 253:1 ----- 3.69, 4.18 A
assign (resid 2 and name HN) (resid 2 and name HB2) 3.15 1.35 1.35 ! 0.8480 254:1 Intra 2.18, 2.62 A
assign (resid 3 and name HN) (resid 2 and name HB2) 3.65 1.85 1.85 ! 0.9090 255:1 Seq 3.33, 3.99 A
assign (resid 27 and name HN) (resid 27 and name HB) 2.30 0.50 0.50 ! 0.9090 256:1 Intra 2.45, 2.50 A
assign (resid 5 and name HN) (resid 5 and name HB*) 2.65 0.85 0.85 ! 0.0000 257:1 Intra 3.18, 3.68 A
assign (resid 6 and name HN) (resid 5 and name HB*) 3.15 1.35 1.35 ! 0.0000 258:1 Seq 3.49, 4.25 A
assign (resid 17 and name HN) (resid 18 and name HB) 3.65 1.85 1.85 ! 0.6286 259:1 Ambig 4.12, 4.48 A
or (resid 17 and name HN) (resid 16 and name HG2) ! 0.1967 259:1 ----- 5.00, 5.09 A
assign (resid 29 and name HN) (resid 28 and name HB2) 2.65 0.85 0.85 ! 0.7383 260:1 Ambig 1.84, 1.88 A
or (resid 28 and name HN) (resid 28 and name HB2) ! 0.1319 260:1 ----- 2.45, 2.55 A
assign (resid 28 and name HN) (resid 28 and name HG) 2.65 0.85 0.85 ! 0.7171 261:1 Ambig 2.29, 2.44 A
or (resid 29 and name HN) (resid 28 and name HB1) ! 0.1932 261:1 ----- 2.84, 3.02 A
assign (resid 7 and name HN) (resid 7 and name HB1) 2.65 0.85 0.85 ! 0.9810 262:1 Intra 2.37, 2.53 A
assign (resid 35 and name HN) (resid 34 and name HB*) 3.15 1.35 1.35 ! 0.9979 263:1 Seq 2.33, 3.24 A
assign (resid 11 and name HN) (resid 11 and name HG11) 2.65 0.85 0.85 ! 0.0000 265:1 Intra 2.09, 2.18 A
assign (resid 4 and name HE1) (resid 5 and name HB*) 3.15 1.35 1.35 ! 0.9714 266:1 Seq 3.36, 4.80 A
assign (resid 21 and name HN) (resid 20 and name HB*) 2.65 0.85 0.85 ! 0.9809 267:1 Seq 2.17, 3.54 A
assign (resid 20 and name HN) (resid 20 and name HB*) 2.30 0.50 0.50 ! 0.0000 270:1 Intra 2.44, 2.87 A
assign (resid 29 and name HD21) (resid 28 and name HB2) 3.65 1.85 1.85 ! 0.9980 271:1 Seq 2.49, 3.25 A
assign (resid 8 and name HN) (resid 7 and name HB1) 3.65 1.85 1.85 ! 0.5087 272:1 Ambig 4.09, 4.22 A
or (resid 8 and name HN) (resid 34 and name HB*) ! 0.4258 272:1 ----- 4.21, 4.68 A
assign (resid 34 and name HE21) (resid 34 and name HB*) 3.65 1.85 1.85 ! 0.9900 273:1 Intra 1.89, 2.99 A
assign (resid 34 and name HE21) (resid 5 and name HB*) 3.65 1.85 1.85 ! 0.0000 274:1 Long 2.95, 4.47 A
assign (resid 18 and name HN) (resid 18 and name HB) 2.65 0.85 0.85 ! 0.8675 275:1 Intra 2.67, 2.92 A
assign (resid 18 and name HN) (resid 16 and name HB2) 3.65 1.85 1.85 ! 0.0000 277:1 Mid 2.65, 3.15 A
assign (resid 29 and name HD22) (resid 28 and name HB2) 3.65 1.85 1.85 ! 0.9114 278:1 Seq 3.40, 4.11 A
assign (resid 32 and name HD*) (resid 28 and name HB2) 2.65 0.85 0.85 ! 0.0000 279:1 Mid 2.60, 4.71 A
assign (resid 29 and name HD22) (resid 28 and name HB1) 3.65 1.85 1.85 ! 0.9213 280:1 Seq 3.69, 4.31 A
assign (resid 32 and name HD*) (resid 28 and name HG) 2.65 0.85 0.85 ! 0.5597 281:1 Ambig 3.67, 5.68 A
or (resid 32 and name HD*) (resid 28 and name HB1) ! 0.4403 281:1 ----- 3.82, 6.14 A
assign (resid 26 and name HE21) (resid 36 and name HB*) 3.65 1.85 1.85 ! 0.0000 282:1 Long 1.80, 3.33 A
assign (resid 4 and name HD2) (resid 5 and name HB*) 3.65 1.85 1.85 ! 0.0000 283:1 Seq 4.63, 6.17 A
assign (resid 32 and name HE*) (resid 28 and name HB2) 3.65 1.85 1.85 ! 0.0000 284:1 Mid 4.17, 6.01 A
assign (resid 9 and name HN) (resid 7 and name HB1) 3.65 1.85 1.85 ! 0.0000 285:1 Mid 4.94, 5.18 A
assign (resid 32 and name HE*) (resid 34 and name HB*) 2.65 0.85 0.85 ! 0.9575 286:1 Mid 2.23, 4.20 A
assign (resid 26 and name HE22) (resid 36 and name HB*) 3.65 1.85 1.85 ! 0.0000 287:1 Long 2.57, 3.42 A
assign (resid 34 and name HE22) (resid 5 and name HB*) 3.65 1.85 1.85 ! 0.0000 288:1 Long 2.81, 4.03 A
assign (resid 13 and name HE*) (resid 7 and name HB1) 3.15 1.35 1.35 ! 0.0000 289:1 Long 3.27, 4.58 A
assign (resid 24 and name HN) (resid 24 and name HG2*) 3.15 1.35 1.35 ! 0.0000 290:1 Intra 2.94, 3.83 A
assign (resid 24 and name HN) (resid 23 and name HG2*) 3.15 1.35 1.35 ! 0.0000 291:1 Seq 3.74, 4.62 A
assign (resid 12 and name HN) (resid 11 and name HG2*) 2.65 0.85 0.85 ! 0.8219 292:1 Seq 2.96, 3.68 A
assign (resid 36 and name HN) (resid 23 and name HG2*) 3.15 1.35 1.35 ! 0.7107 293:1 Ambig 4.24, 5.38 A
or (resid 26 and name HN) (resid 27 and name HG2*) ! 0.1908 293:1 ----- 5.28, 6.18 A
assign (resid 36 and name HN) (resid 36 and name HD2*) 2.65 0.85 0.85 ! 0.3648 294:1 Ambig 3.98, 4.83 A
or (resid 26 and name HN) (resid 36 and name HD1*) ! 0.2486 294:1 ----- 4.25, 5.57 A
or (resid 36 and name HN) (resid 36 and name HD1*) ! 0.2294 294:1 ----- 4.30, 5.05 A
assign (resid 25 and name HN) (resid 24 and name HG2*) 3.15 1.35 1.35 ! 0.0000 295:1 Seq 3.69, 4.63 A
assign (resid 27 and name HN) (resid 27 and name HG2*) 2.30 0.50 0.50 ! 0.9881 296:1 Intra 2.00, 2.98 A
assign (resid 5 and name HN) (resid 36 and name HD2*) 3.65 1.85 1.85 ! 0.9822 297:1 Long 2.94, 4.26 A
assign (resid 27 and name HN) (resid 27 and name HG1*) 3.15 1.35 1.35 ! 0.0000 298:1 Intra 4.37, 4.51 A
assign (resid 11 and name HN) (resid 11 and name HB) 2.65 0.85 0.85 ! 0.9925 300:1 Intra 2.43, 2.50 A
assign (resid 2 and name HN) (resid 1 and name HG2*) 3.65 1.85 1.85 ! 0.9359 301:1 Seq 2.32, 3.71 A
assign (resid 17 and name HN) (resid 17 and name HG2*) 2.65 0.85 0.85 ! 0.0000 302:1 Intra 2.47, 3.48 A
assign (resid 21 and name HN) (resid 1 and name HG2*) 3.65 1.85 1.85 ! 0.0000 303:1 Long 3.40, 5.29 A
assign (resid 31 and name HN) (resid 30 and name HB2) 3.15 1.35 1.35 ! 0.9922 304:1 Seq 3.07, 3.38 A
assign (resid 11 and name HN) (resid 11 and name HG12) 3.15 1.35 1.35 ! 0.0000 305:1 Intra 3.34, 3.43 A
assign (resid 17 and name HN) (resid 18 and name HG1*) 4.15 2.35 2.35 ! 0.9417 306:1 Seq 3.45, 4.70 A
assign (resid 21 and name HN) (resid 18 and name HG2*) 3.65 1.85 1.85 ! 0.5006 307:1 Ambig 4.97, 6.58 A
or (resid 35 and name HN) (resid 23 and name HG2*) ! 0.2279 307:1 ----- 5.67, 7.06 A
or (resid 21 and name HN) (resid 23 and name HG2*) ! 0.1723 307:1 ----- 5.94, 7.35 A
assign (resid 4 and name HE1) (resid 36 and name HD2*) 3.65 1.85 1.85 ! 0.9561 308:1 Long 3.70, 4.67 A
assign (resid 28 and name HN) (resid 27 and name HG1*) 2.65 0.85 0.85 ! 0.6916 309:1 Ambig 3.54, 4.33 A
or (resid 29 and name HN) (resid 27 and name HG1*) ! 0.1996 309:1 ----- 4.35, 5.09 A
assign (resid 23 and name HN) (resid 23 and name HG2*) 3.15 1.35 1.35 ! 0.0000 310:1 Intra 2.91, 3.92 A
assign (resid 8 and name HN) (resid 7 and name HG2) 3.15 1.35 1.35 ! 0.9630 311:1 Seq 3.02, 3.24 A
assign (resid 34 and name HE21) (resid 36 and name HD2*) 3.65 1.85 1.85 ! 0.6086 312:1 Ambig 1.84, 4.30 A
or (resid 34 and name HE21) (resid 36 and name HD1*) ! 0.3835 312:1 ----- 1.99, 5.48 A
assign (resid 31 and name HD*) (resid 11 and name HB) 2.65 0.85 0.85 ! 0.0000 313:1 Long 2.57, 4.03 A
assign (resid 18 and name HN) (resid 1 and name HG2*) 3.65 1.85 1.85 ! 0.4868 314:1 Ambig 4.48, 6.41 A
or (resid 18 and name HN) (resid 17 and name HG2*) ! 0.4576 314:1 ----- 4.53, 5.20 A
assign (resid 13 and name HD*) (resid 17 and name HG2*) 3.15 1.35 1.35 ! 0.0000 315:1 Mid 2.01, 5.16 A
assign (resid 31 and name HD*) (resid 30 and name HB2) 3.15 1.35 1.35 ! 0.0000 316:1 Seq 3.24, 4.53 A
assign (resid 26 and name HE21) (resid 24 and name HG2*) 3.65 1.85 1.85 ! 0.0000 317:1 Mid 3.54, 5.09 A
assign (resid 2 and name HE22) (resid 7 and name HG2) 4.15 2.35 2.35 ! 0.0000 318:1 Long 5.55, 6.01 A
assign (resid 7 and name HE21) (resid 7 and name HG2) 2.65 0.85 0.85 ! 0.0000 319:1 Intra 2.19, 2.67 A
assign (resid 7 and name HE22) (resid 7 and name HG2) 3.15 1.35 1.35 ! 0.7861 320:1 Ambig 3.45, 3.65 A
or (resid 32 and name HD*) (resid 7 and name HG2) ! 0.2139 320:1 ----- 4.29, 6.18 A
assign (resid 13 and name HD*) (resid 7 and name HG2) 3.65 1.85 1.85 ! 0.0000 321:1 Long 2.87, 3.88 A
assign (resid 4 and name HD2) (resid 23 and name HG2*) 3.65 1.85 1.85 ! 0.0000 322:1 Long 2.17, 3.29 A
assign (resid 18 and name HN) (resid 18 and name HG21) 2.65 0.85 0.85 ! 0.9913 323:1 Ambig 2.00, 2.97 A
or (resid 18 and name HN) (resid 18 and name HG11) ! 0.0000 323:1 ----- 0.00, 0.00 A
assign (resid 32 and name HD*) (resid 28 and name HD1*) 3.15 1.35 1.35 ! 0.0000 325:1 Mid 2.05, 5.47 A
assign (resid 31 and name HD*) (resid 11 and name HG2*) 3.15 1.35 1.35 ! 0.0000 326:1 Long 3.29, 6.00 A
assign (resid 32 and name HD*) (resid 28 and name HD2*) 3.65 1.85 1.85 ! 0.0000 327:1 Mid 5.56, 7.84 A
assign (resid 4 and name HD2) (resid 36 and name HD2*) 3.65 1.85 1.85 ! 0.9938 328:1 Long 2.47, 4.14 A
assign (resid 31 and name HE*) (resid 11 and name HB) 3.15 1.35 1.35 ! 0.0000 329:1 Long 2.68, 4.24 A
assign (resid 31 and name HE*) (resid 30 and name HB2) 3.65 1.85 1.85 ! 0.0000 330:1 Seq 3.49, 4.66 A
assign (resid 33 and name HN) (resid 7 and name HG2) 3.65 1.85 1.85 ! 0.0000 331:1 Long 3.35, 3.64 A
assign (resid 9 and name HN) (resid 7 and name HG2) 2.65 0.85 0.85 ! 0.0000 332:1 Mid 2.83, 3.19 A
assign (resid 32 and name HE*) (resid 28 and name HD1*) 3.15 1.35 1.35 ! 0.0000 333:1 Mid 2.24, 5.39 A
assign (resid 31 and name HE*) (resid 11 and name HG2*) 2.65 0.85 0.85 ! 0.7532 334:1 Ambig 2.80, 5.43 A
or (resid 34 and name HE22) (resid 28 and name HD1*) ! 0.2468 334:1 ----- 3.37, 4.79 A
assign (resid 26 and name HE22) (resid 36 and name HD1*) 4.15 2.35 2.35 ! 0.9112 335:1 Long 3.06, 4.63 A
assign (resid 13 and name HE*) (resid 17 and name HG2*) 2.65 0.85 0.85 ! 0.0000 337:1 Mid 2.82, 5.87 A
assign (resid 13 and name HE*) (resid 7 and name HG2) 3.65 1.85 1.85 ! 0.0000 338:1 Long 3.70, 4.38 A
assign (resid 11 and name HN) (resid 11 and name HD1*) 3.15 1.35 1.35 ! 0.0000 339:1 Intra 3.87, 4.43 A
assign (resid 31 and name HD*) (resid 11 and name HD1*) 3.65 1.85 1.85 ! 0.0000 340:1 Long 4.20, 6.06 A
assign (resid 31 and name HE*) (resid 11 and name HD1*) 3.15 1.35 1.35 ! 0.0000 341:1 Long 3.62, 5.46 A
assign (resid 24 and name HA) (resid 24 and name HN) 3.65 1.85 1.85 ! 0.0000 342:1 Intra 2.91, 2.93 A
assign (resid 25 and name HA) (resid 26 and name HN) 3.65 1.85 1.85 ! 0.9106 343:1 Seq 2.12, 2.15 A
assign (resid 12 and name HA1) (resid 12 and name HN) 3.65 1.85 1.85 ! 0.0000 344:1 Intra 2.91, 2.93 A
assign (resid 24 and name HB) (resid 24 and name HN) 3.65 1.85 1.85 ! 0.0000 345:1 Intra 3.65, 3.70 A
assign (resid 23 and name HB) (resid 24 and name HN) 2.65 0.85 0.85 ! 0.0000 346:1 Seq 2.52, 2.76 A
assign (resid 23 and name HB) (resid 36 and name HN) 3.15 1.35 1.35 ! 0.9817 347:1 Long 3.07, 3.24 A
assign (resid 11 and name HA) (resid 12 and name HN) 2.30 0.50 0.50 ! 0.9909 348:1 Seq 2.09, 2.12 A
assign (resid 12 and name HA2) (resid 12 and name HN) 2.65 0.85 0.85 ! 0.9990 349:1 Intra 2.37, 2.42 A
assign (resid 33 and name HB1) (resid 34 and name HN) 2.65 0.85 0.85 ! 0.7865 350:1 Ambig 3.09, 3.23 A
or (resid 33 and name HB1) (resid 26 and name HN) ! 0.2088 350:1 ----- 3.85, 4.06 A
assign (resid 25 and name HB2) (resid 26 and name HN) 3.65 1.85 1.85 ! 0.7457 351:1 Ambig 4.31, 4.41 A
or (resid 25 and name HB2) (resid 36 and name HN) ! 0.1773 351:1 ----- 5.48, 5.70 A
assign (resid 33 and name HB2) (resid 34 and name HN) 3.15 1.35 1.35 ! 0.4798 352:1 Ambig 3.92, 4.03 A
or (resid 35 and name HB2) (resid 36 and name HN) ! 0.3557 352:1 ----- 4.12, 4.24 A
assign (resid 35 and name HB1) (resid 36 and name HN) 3.15 1.35 1.35 ! 0.9325 353:1 Seq 3.31, 3.48 A
assign (resid 13 and name HB1) (resid 12 and name HN) 3.65 1.85 1.85 ! 0.3459 354:1 Ambig 4.20, 4.55 A
or (resid 25 and name HB1) (resid 26 and name HN) ! 0.3307 354:1 ----- 4.24, 4.33 A
or (resid 8 and name HB1) (resid 26 and name HN) ! 0.1301 354:1 ----- 4.95, 5.47 A
assign (resid 26 and name HG2) (resid 36 and name HN) 3.65 1.85 1.85 ! 0.5081 355:1 Ambig 2.65, 4.76 A
or (resid 26 and name HG2) (resid 26 and name HN) ! 0.4704 355:1 ----- 2.68, 3.76 A
assign (resid 26 and name HG1) (resid 26 and name HN) 3.65 1.85 1.85 ! 0.5973 356:1 Ambig 2.74, 2.97 A
or (resid 26 and name HG1) (resid 36 and name HN) ! 0.3913 356:1 ----- 2.94, 3.30 A
assign (resid 26 and name HB1) (resid 26 and name HN) 3.15 1.35 1.35 ! 0.6937 357:1 Ambig 3.61, 3.71 A
or (resid 26 and name HB1) (resid 34 and name HN) ! 0.2071 357:1 ----- 4.41, 4.80 A
assign (resid 26 and name HB2) (resid 26 and name HN) 2.65 0.85 0.85 ! 0.8306 358:1 Intra 2.41, 2.57 A
assign (resid 34 and name HB*) (resid 34 and name HN) 2.65 0.85 0.85 ! 0.6416 359:1 Ambig 2.39, 3.49 A
or (resid 28 and name HG) (resid 34 and name HN) ! 0.3276 359:1 ----- 2.67, 2.85 A
assign (resid 36 and name HB*) (resid 36 and name HN) 2.65 0.85 0.85 ! 0.9386 360:1 Intra 2.46, 3.17 A
assign (resid 24 and name HG2*) (resid 24 and name HN) 3.15 1.35 1.35 ! 0.0000 362:1 Intra 2.94, 3.83 A
assign (resid 36 and name HG) (resid 36 and name HN) 3.65 1.85 1.85 ! 0.7132 363:1 Ambig 2.95, 3.13 A
or (resid 36 and name HG) (resid 26 and name HN) ! 0.1857 363:1 ----- 3.69, 4.18 A
assign (resid 11 and name HG2*) (resid 12 and name HN) 2.65 0.85 0.85 ! 0.9530 364:1 Seq 2.96, 3.68 A
assign (resid 36 and name HD2*) (resid 36 and name HN) 3.15 1.35 1.35 ! 0.3438 365:1 Ambig 3.98, 4.83 A
or (resid 36 and name HD1*) (resid 26 and name HN) ! 0.2343 365:1 ----- 4.25, 5.57 A
or (resid 36 and name HD1*) (resid 36 and name HN) ! 0.2162 365:1 ----- 4.30, 5.05 A
or (resid 36 and name HD1*) (resid 34 and name HN) ! 0.1194 365:1 ----- 4.75, 5.62 A
assign (resid 24 and name HA) (resid 25 and name HN) 3.65 1.85 1.85 ! 0.0000 366:1 Seq 2.11, 2.26 A
assign (resid 21 and name HA) (resid 22 and name HN) 2.65 0.85 0.85 ! 0.0000 367:1 Seq 2.08, 2.15 A
assign (resid 4 and name HA) (resid 5 and name HN) 3.65 1.85 1.85 ! 0.0000 368:1 Seq 2.09, 2.13 A
assign (resid 7 and name HA) (resid 6 and name HN) 3.65 1.85 1.85 ! 0.6793 369:1 Ambig 4.09, 5.14 A
or (resid 7 and name HA) (resid 10 and name HN) ! 0.2726 369:1 ----- 4.77, 5.24 A
assign (resid 9 and name HA2) (resid 10 and name HN) 3.65 1.85 1.85 ! 0.9878 370:1 Seq 2.72, 2.79 A
assign (resid 21 and name HA) (resid 21 and name HN) 3.65 1.85 1.85 ! 0.0000 371:1 Intra 2.67, 2.74 A
assign (resid 20 and name HA) (resid 21 and name HN) 2.65 0.85 0.85 ! 0.9829 372:1 Seq 2.10, 2.28 A
assign (resid 31 and name HA) (resid 11 and name HN) 3.65 1.85 1.85 ! 0.0000 373:1 Long 1.79, 2.04 A
assign (resid 21 and name HB*) (resid 22 and name HN) 3.65 1.85 1.85 ! 0.0000 374:1 Seq 3.00, 3.76 A
assign (resid 5 and name HA) (resid 5 and name HN) 3.15 1.35 1.35 ! 0.9849 375:1 Intra 2.20, 2.23 A
assign (resid 24 and name HB) (resid 25 and name HN) 3.15 1.35 1.35 ! 0.0000 376:1 Seq 2.71, 2.92 A
assign (resid 3 and name HB2) (resid 4 and name HN) 3.15 1.35 1.35 ! 0.7587 377:1 Ambig 2.00, 2.76 A
or (resid 3 and name HB2) (resid 3 and name HN) ! 0.2413 377:1 ----- 2.43, 3.07 A
assign (resid 6 and name HA2) (resid 6 and name HN) 3.15 1.35 1.35 ! 0.0000 378:1 Intra 2.76, 2.90 A
assign (resid 18 and name HA) (resid 19 and name HN) 2.65 0.85 0.85 ! 0.5570 379:1 Ambig 2.06, 2.14 A
or (resid 5 and name HA) (resid 6 and name HN) ! 0.4399 379:1 ----- 2.15, 3.05 A
assign (resid 27 and name HA) (resid 28 and name HN) 2.30 0.50 0.50 ! 0.8260 380:1 Seq 2.16, 2.23 A
assign (resid 10 and name HA1) (resid 10 and name HN) 2.30 0.50 0.50 ! 0.9053 381:1 Intra 2.26, 2.29 A
assign (resid 1 and name HA) (resid 2 and name HN) 3.65 1.85 1.85 ! 0.9339 382:1 Seq 2.16, 2.35 A
assign (resid 21 and name HB*) (resid 21 and name HN) 2.65 0.85 0.85 ! 0.0000 383:1 Intra 2.43, 3.02 A
assign (resid 10 and name HA1) (resid 11 and name HN) 2.65 0.85 0.85 ! 0.9893 385:1 Seq 2.78, 2.90 A
assign (resid 6 and name HA2) (resid 7 and name HN) 3.15 1.35 1.35 ! 0.0000 386:1 Seq 2.24, 2.32 A
assign (resid 22 and name HA2) (resid 22 and name HN) 2.65 0.85 0.85 ! 0.0000 387:1 Intra 2.36, 2.41 A
assign (resid 3 and name HB1) (resid 4 and name HN) 3.15 1.35 1.35 ! 0.7168 388:1 Ambig 1.96, 2.99 A
or (resid 3 and name HB1) (resid 3 and name HN) ! 0.1535 388:1 ----- 2.54, 3.22 A
assign (resid 101 and name H5) (resid 3 and name HN) 4.15 2.35 2.35 ! 0.6796 389:1 Ambig 2.56, 4.79 A
or (resid 101 and name H5) (resid 4 and name HN) ! 0.2959 389:1 ----- 2.94, 5.74 A
assign (resid 30 and name HD2) (resid 31 and name HN) 3.15 1.35 1.35 ! 0.9936 390:1 Seq 2.19, 2.43 A
assign (resid 6 and name HA1) (resid 6 and name HN) 2.65 0.85 0.85 ! 0.9990 391:1 Intra 2.29, 2.40 A
assign (resid 19 and name HB1) (resid 19 and name HN) 3.15 1.35 1.35 ! 0.8181 392:1 Intra 3.57, 3.62 A
assign (resid 33 and name HB1) (resid 28 and name HN) 3.15 1.35 1.35 ! 0.5276 393:1 Ambig 3.31, 3.58 A
or (resid 33 and name HB1) (resid 27 and name HN) ! 0.3533 393:1 ----- 3.54, 3.68 A
assign (resid 14 and name HB1) (resid 14 and name HN) 3.15 1.35 1.35 ! 0.9453 394:1 Intra 2.69, 2.99 A
assign (resid 6 and name HA1) (resid 7 and name HN) 3.15 1.35 1.35 ! 0.0000 395:1 Seq 2.79, 2.94 A
assign (resid 4 and name HB*) (resid 5 and name HN) 3.65 1.85 1.85 ! 0.0000 396:1 Seq 4.02, 4.16 A
assign (resid 25 and name HB2) (resid 25 and name HN) 2.65 0.85 0.85 ! 0.0000 397:1 Intra 2.55, 2.64 A
assign (resid 4 and name HB*) (resid 4 and name HN) 2.65 0.85 0.85 ! 0.9968 398:1 Intra 2.32, 2.51 A
assign (resid 31 and name HB1) (resid 31 and name HN) 3.15 1.35 1.35 ! 0.9421 399:1 Intra 3.65, 3.72 A
assign (resid 29 and name HB*) (resid 31 and name HN) 2.65 0.85 0.85 ! 0.5198 400:1 Ambig 2.40, 2.93 A
or (resid 29 and name HB*) (resid 29 and name HN) ! 0.4715 400:1 ----- 2.44, 3.09 A
assign (resid 35 and name HB1) (resid 5 and name HN) 3.65 1.85 1.85 ! 0.7866 401:1 Ambig 3.82, 4.33 A
or (resid 35 and name HB1) (resid 25 and name HN) ! 0.2134 401:1 ----- 4.75, 5.32 A
assign (resid 35 and name HB2) (resid 5 and name HN) 3.15 1.35 1.35 ! 0.9929 402:1 Long 2.64, 3.00 A
assign (resid 25 and name HB1) (resid 25 and name HN) 2.30 0.50 0.50 ! 0.9904 403:1 Intra 2.47, 2.51 A
assign (resid 35 and name HB1) (resid 6 and name HN) 3.65 1.85 1.85 ! 0.7427 404:1 Ambig 4.53, 5.02 A
or (resid 35 and name HB1) (resid 19 and name HN) ! 0.2573 404:1 ----- 5.41, 5.60 A
assign (resid 35 and name HB2) (resid 6 and name HN) 2.65 0.85 0.85 ! 0.3659 405:1 Ambig 2.79, 3.29 A
or (resid 33 and name HB2) (resid 10 and name HN) ! 0.2792 405:1 ----- 2.92, 3.12 A
or (resid 32 and name HB*) (resid 29 and name HN) ! 0.2722 405:1 ----- 2.93, 4.05 A
assign (resid 31 and name HB2) (resid 31 and name HN) 2.65 0.85 0.85 ! 0.5133 406:1 Ambig 2.43, 2.58 A
or (resid 13 and name HB1) (resid 10 and name HN) ! 0.4460 406:1 ----- 2.49, 2.62 A
assign (resid 13 and name HB2) (resid 10 and name HN) 3.65 1.85 1.85 ! 0.9990 407:1 Mid 2.36, 2.58 A
assign (resid 35 and name HB1) (resid 35 and name HN) 3.15 1.35 1.35 ! 0.9900 408:1 Intra 3.55, 3.61 A
assign (resid 35 and name HB2) (resid 35 and name HN) 2.65 0.85 0.85 ! 0.9946 409:1 Intra 2.46, 2.53 A
assign (resid 13 and name HB1) (resid 14 and name HN) 3.65 1.85 1.85 ! 0.5515 410:1 Ambig 4.27, 4.34 A
or (resid 31 and name HB2) (resid 11 and name HN) ! 0.2807 410:1 ----- 4.78, 5.01 A
assign (resid 2 and name HG1) (resid 3 and name HN) 3.15 1.35 1.35 ! 0.9943 411:1 Seq 2.20, 2.64 A
assign (resid 19 and name HB2) (resid 19 and name HN) 2.65 0.85 0.85 ! 0.6712 412:1 Ambig 2.39, 2.47 A
or (resid 7 and name HG1) (resid 10 and name HN) ! 0.2910 412:1 ----- 2.75, 3.46 A
assign (resid 34 and name HG*) (resid 35 and name HN) 3.15 1.35 1.35 ! 0.9958 413:1 Seq 2.63, 4.03 A
assign (resid 26 and name HB1) (resid 27 and name HN) 3.15 1.35 1.35 ! 0.7994 414:1 Ambig 3.23, 3.43 A
or (resid 26 and name HB1) (resid 28 and name HN) ! 0.1115 414:1 ----- 4.49, 4.87 A
assign (resid 27 and name HB) (resid 27 and name HN) 2.30 0.50 0.50 ! 0.4811 415:1 Ambig 2.45, 2.50 A
or (resid 16 and name HB2) (resid 2 and name HN) ! 0.4679 415:1 ----- 2.46, 3.54 A
assign (resid 16 and name HG2) (resid 2 and name HN) 3.65 1.85 1.85 ! 0.3397 416:1 Ambig 3.94, 4.46 A
or (resid 18 and name HB) (resid 19 and name HN) ! 0.2755 416:1 ----- 4.08, 4.16 A
or (resid 18 and name HB) (resid 17 and name HN) ! 0.2606 416:1 ----- 4.12, 4.48 A
assign (resid 28 and name HB2) (resid 29 and name HN) 2.65 0.85 0.85 ! 0.7291 417:1 Ambig 1.84, 1.88 A
or (resid 28 and name HB2) (resid 28 and name HN) ! 0.1303 417:1 ----- 2.45, 2.55 A
assign (resid 28 and name HB1) (resid 29 and name HN) 2.65 0.85 0.85 ! 0.8011 418:1 Seq 2.84, 3.02 A
assign (resid 7 and name HB2) (resid 7 and name HN) 2.65 0.85 0.85 ! 0.0000 419:1 Intra 2.56, 2.66 A
assign (resid 5 and name HB*) (resid 5 and name HN) 3.15 1.35 1.35 ! 0.0000 420:1 Intra 3.18, 3.68 A
assign (resid 5 and name HB*) (resid 6 and name HN) 3.15 1.35 1.35 ! 0.0000 421:1 Seq 3.49, 4.25 A
assign (resid 11 and name HG11) (resid 11 and name HN) 2.65 0.85 0.85 ! 0.0000 422:1 Intra 2.09, 2.18 A
assign (resid 7 and name HB1) (resid 7 and name HN) 2.65 0.85 0.85 ! 0.9810 423:1 Intra 2.37, 2.53 A
assign (resid 24 and name HG2*) (resid 25 and name HN) 3.15 1.35 1.35 ! 0.0000 424:1 Seq 3.69, 4.63 A
assign (resid 17 and name HG2*) (resid 17 and name HN) 3.15 1.35 1.35 ! 0.9756 426:1 Intra 2.47, 3.48 A
assign (resid 20 and name HB*) (resid 21 and name HN) 2.65 0.85 0.85 ! 0.0000 427:1 Seq 2.17, 3.54 A
assign (resid 11 and name HB) (resid 11 and name HN) 2.65 0.85 0.85 ! 0.9925 428:1 Intra 2.43, 2.50 A
assign (resid 18 and name HG2*) (resid 19 and name HN) 2.65 0.85 0.85 ! 0.6467 429:1 Ambig 2.55, 3.43 A
or (resid 18 and name HG1*) (resid 2 and name HN) ! 0.2080 429:1 ----- 3.08, 4.49 A
assign (resid 27 and name HG2*) (resid 27 and name HN) 2.30 0.50 0.50 ! 0.9891 430:1 Intra 2.00, 2.98 A
assign (resid 11 and name HG2*) (resid 11 and name HN) 3.65 1.85 1.85 ! 0.8216 431:1 Intra 4.35, 4.53 A
assign (resid 27 and name HG1*) (resid 28 and name HN) 2.65 0.85 0.85 ! 0.5618 432:1 Ambig 3.54, 4.33 A
or (resid 27 and name HG1*) (resid 29 and name HN) ! 0.1622 432:1 ----- 4.35, 5.09 A
or (resid 27 and name HG1*) (resid 27 and name HN) ! 0.1586 432:1 ----- 4.37, 4.51 A
assign (resid 11 and name HD1*) (resid 11 and name HN) 3.15 1.35 1.35 ! 0.0000 433:1 Intra 3.87, 4.43 A
assign (resid 20 and name HA) (resid 20 and name HN) 3.65 1.85 1.85 ! 0.5611 434:1 Ambig 2.76, 2.81 A
or (resid 1 and name HB) (resid 20 and name HN) ! 0.4389 434:1 ----- 2.88, 4.76 A
assign (resid 21 and name HA) (resid 23 and name HN) 3.65 1.85 1.85 ! 0.0000 435:1 Mid 3.05, 3.33 A
assign (resid 7 and name HA) (resid 8 and name HN) 2.65 0.85 0.85 ! 0.9882 436:1 Seq 2.02, 2.09 A
assign (resid 11 and name HA) (resid 13 and name HN) 3.15 1.35 1.35 ! 0.6445 437:1 Ambig 3.09, 3.24 A
or (resid 10 and name HA1) (resid 13 and name HN) ! 0.1375 437:1 ----- 4.00, 4.23 A
or (resid 10 and name HA1) (resid 32 and name HN) ! 0.1049 437:1 ----- 4.19, 4.32 A
assign (resid 19 and name HB1) (resid 20 and name HN) 3.15 1.35 1.35 ! 0.0000 438:1 Seq 2.42, 2.63 A
assign (resid 22 and name HA2) (resid 23 and name HN) 3.15 1.35 1.35 ! 0.9203 439:1 Seq 3.24, 3.39 A
assign (resid 12 and name HA2) (resid 13 and name HN) 3.15 1.35 1.35 ! 0.9608 440:1 Seq 3.15, 3.32 A
assign (resid 8 and name HB2) (resid 8 and name HN) 3.65 1.85 1.85 ! 0.0000 441:1 Intra 3.62, 3.68 A
assign (resid 31 and name HB1) (resid 32 and name HN) 3.65 1.85 1.85 ! 0.9128 442:1 Seq 3.81, 3.96 A
assign (resid 29 and name HB*) (resid 29 and name HD21) 2.30 0.50 0.50 ! 0.0000 443:1 Intra 2.14, 2.79 A
assign (resid 13 and name HB1) (resid 13 and name HN) 2.30 0.50 0.50 ! 0.5580 445:1 Ambig 2.44, 2.54 A
or (resid 31 and name HB2) (resid 32 and name HN) ! 0.2328 445:1 ----- 2.83, 2.95 A
or (resid 8 and name HB1) (resid 8 and name HN) ! 0.2034 445:1 ----- 2.89, 2.98 A
assign (resid 32 and name HB*) (resid 32 and name HN) 2.30 0.50 0.50 ! 0.9900 447:1 Intra 2.65, 2.85 A
assign (resid 13 and name HB2) (resid 13 and name HN) 2.65 0.85 0.85 ! 0.9881 448:1 Intra 2.57, 2.68 A
assign (resid 32 and name HB*) (resid 29 and name HD21) 3.15 1.35 1.35 ! 0.0000 449:1 Mid 1.99, 3.06 A
assign (resid 31 and name HB2) (resid 29 and name HD21) 4.15 2.35 2.35 ! 0.0000 450:1 Mid 4.59, 5.79 A
assign (resid 2 and name HG1) (resid 2 and name HE21) 3.65 1.85 1.85 ! 0.0000 451:1 Intra 2.21, 3.31 A
assign (resid 19 and name HB2) (resid 20 and name HN) 3.15 1.35 1.35 ! 0.0000 452:1 Seq 3.49, 3.73 A
assign (resid 2 and name HG2) (resid 2 and name HE21) 3.15 1.35 1.35 ! 0.0000 453:1 Intra 2.14, 2.23 A
assign (resid 7 and name HG1) (resid 8 and name HN) 2.65 0.85 0.85 ! 0.7383 454:1 Ambig 2.91, 3.25 A
or (resid 2 and name HG2) (resid 8 and name HN) ! 0.2306 454:1 ----- 3.53, 3.92 A
assign (resid 16 and name HG2) (resid 2 and name HE21) 3.65 1.85 1.85 ! 0.0000 455:1 Long 2.54, 3.82 A
assign (resid 20 and name HB*) (resid 20 and name HN) 2.30 0.50 0.50 ! 0.0000 456:1 Intra 2.44, 2.87 A
assign (resid 23 and name HG2*) (resid 23 and name HN) 3.15 1.35 1.35 ! 0.0000 457:1 Intra 2.91, 3.92 A
assign (resid 7 and name HG2) (resid 8 and name HN) 3.15 1.35 1.35 ! 0.9630 458:1 Seq 3.02, 3.24 A
assign (resid 31 and name HA) (resid 31 and name HD*) 3.65 1.85 1.85 ! 0.9350 459:1 Intra 2.61, 3.52 A
assign (resid 9 and name HA2) (resid 13 and name HD*) 3.15 1.35 1.35 ! 0.9403 460:1 Mid 2.51, 4.51 A
assign (resid 18 and name HA) (resid 18 and name HN) 3.15 1.35 1.35 ! 0.0000 461:1 Intra 2.86, 2.90 A
assign (resid 10 and name HA1) (resid 33 and name HN) 3.65 1.85 1.85 ! 0.0000 462:1 Long 3.00, 3.43 A
assign (resid 10 and name HA1) (resid 7 and name HE22) 3.15 1.35 1.35 ! 0.6218 463:1 Ambig 3.49, 3.64 A
or (resid 9 and name HA1) (resid 13 and name HD*) ! 0.2295 463:1 ----- 4.12, 6.00 A
assign (resid 4 and name HB*) (resid 4 and name HD2) 3.65 1.85 1.85 ! 0.0000 464:1 Intra 2.78, 3.43 A
assign (resid 31 and name HB1) (resid 31 and name HD*) 2.65 0.85 0.85 ! 0.9662 465:1 Intra 2.33, 3.05 A
assign (resid 29 and name HB*) (resid 31 and name HD*) 3.65 1.85 1.85 ! 0.9668 466:1 Mid 3.44, 5.87 A
assign (resid 29 and name HB*) (resid 29 and name HD22) 2.65 0.85 0.85 ! 0.0000 467:1 Intra 3.43, 3.73 A
assign (resid 31 and name HB2) (resid 31 and name HD*) 2.30 0.50 0.50 ! 0.8896 468:1 Intra 2.28, 3.05 A
assign (resid 32 and name HB*) (resid 7 and name HE21) 3.65 1.85 1.85 ! 0.6493 469:1 Ambig 4.02, 5.48 A
or (resid 33 and name HB2) (resid 7 and name HE21) ! 0.2654 469:1 ----- 4.66, 4.95 A
assign (resid 13 and name HB2) (resid 7 and name HE21) 3.15 1.35 1.35 ! 0.9991 470:1 Long 1.80, 2.73 A
assign (resid 32 and name HB*) (resid 32 and name HD*) 2.30 0.50 0.50 ! 0.9702 472:1 Intra 2.33, 3.05 A
assign (resid 13 and name HB2) (resid 13 and name HD*) 2.30 0.50 0.50 ! 0.6592 473:1 Ambig 2.53, 3.09 A
or (resid 13 and name HB2) (resid 7 and name HE22) ! 0.3408 473:1 ----- 2.82, 3.26 A
assign (resid 13 and name HB1) (resid 13 and name HD*) 2.30 0.50 0.50 ! 0.9744 474:1 Intra 2.25, 3.01 A
assign (resid 34 and name HG*) (resid 34 and name HE21) 2.65 0.85 0.85 ! 0.0000 475:1 Intra 2.20, 3.00 A
assign (resid 7 and name HG1) (resid 7 and name HE21) 2.65 0.85 0.85 ! 0.9951 476:1 Intra 2.15, 2.52 A
assign (resid 26 and name HG1) (resid 26 and name HE21) 3.15 1.35 1.35 ! 0.0000 477:1 Intra 2.18, 2.32 A
assign (resid 7 and name HG1) (resid 32 and name HD*) 2.65 0.85 0.85 ! 0.6917 478:1 Ambig 2.89, 4.61 A
or (resid 7 and name HG1) (resid 7 and name HE22) ! 0.2517 478:1 ----- 3.42, 3.58 A
assign (resid 18 and name HB) (resid 18 and name HN) 2.65 0.85 0.85 ! 0.9459 479:1 Intra 2.67, 2.92 A
assign (resid 16 and name HB2) (resid 18 and name HN) 3.65 1.85 1.85 ! 0.6565 480:1 Ambig 2.65, 3.15 A
or (resid 26 and name HB2) (resid 26 and name HE21) ! 0.3435 480:1 ----- 2.96, 4.08 A
assign (resid 28 and name HB2) (resid 32 and name HD*) 3.15 1.35 1.35 ! 0.0000 481:1 Mid 2.60, 4.71 A
assign (resid 28 and name HB1) (resid 32 and name HD*) 3.15 1.35 1.35 ! 0.0000 482:1 Mid 3.82, 6.14 A
assign (resid 16 and name HG2) (resid 13 and name HD*) 4.15 2.35 2.35 ! 0.0000 483:1 Mid 5.67, 6.97 A
assign (resid 5 and name HB*) (resid 34 and name HE21) 3.65 1.85 1.85 ! 0.0000 484:1 Long 2.95, 4.47 A
assign (resid 28 and name HG) (resid 32 and name HD*) 3.65 1.85 1.85 ! 0.0000 485:1 Mid 3.67, 5.68 A
assign (resid 34 and name HB*) (resid 32 and name HD*) 3.65 1.85 1.85 ! 0.3987 486:1 Ambig 3.54, 5.59 A
or (resid 7 and name HB1) (resid 13 and name HD*) ! 0.3566 486:1 ----- 3.61, 5.12 A
or (resid 7 and name HB1) (resid 32 and name HD*) ! 0.1428 486:1 ----- 4.20, 6.24 A
assign (resid 11 and name HB) (resid 31 and name HD*) 3.15 1.35 1.35 ! 0.9959 487:1 Long 2.57, 4.03 A
assign (resid 17 and name HG2*) (resid 13 and name HD*) 3.15 1.35 1.35 ! 0.9992 488:1 Mid 2.01, 5.16 A
assign (resid 23 and name HG2*) (resid 4 and name HD2) 3.15 1.35 1.35 ! 0.0000 489:1 Long 2.17, 3.29 A
assign (resid 7 and name HG2) (resid 7 and name HE21) 2.65 0.85 0.85 ! 0.0000 490:1 Intra 2.19, 2.67 A
assign (resid 18 and name HG21) (resid 18 and name HN) 2.65 0.85 0.85 ! 0.9913 491:1 Ambig 2.00, 2.97 A
or (resid 18 and name HG11) (resid 18 and name HN) ! 0.0000 491:1 ----- 0.00, 0.00 A
assign (resid 28 and name HD1*) (resid 32 and name HD*) 3.15 1.35 1.35 ! 0.0000 492:1 Mid 2.05, 5.47 A
assign (resid 7 and name HG2) (resid 13 and name HD*) 3.15 1.35 1.35 ! 0.7046 493:1 Ambig 2.87, 3.88 A
or (resid 7 and name HG2) (resid 7 and name HE22) ! 0.2322 493:1 ----- 3.45, 3.65 A
assign (resid 11 and name HD1*) (resid 31 and name HD*) 3.65 1.85 1.85 ! 0.0000 494:1 Long 4.20, 6.06 A
assign (resid 9 and name HA2) (resid 9 and name HN) 3.65 1.85 1.85 ! 0.0000 495:1 Intra 2.90, 2.93 A
assign (resid 9 and name HA1) (resid 9 and name HN) 3.15 1.35 1.35 ! 0.9328 496:1 Intra 2.58, 2.65 A
assign (resid 33 and name HB1) (resid 33 and name HN) 3.15 1.35 1.35 ! 0.0000 497:1 Intra 3.75, 3.78 A
assign (resid 33 and name HB1) (resid 9 and name HN) 3.65 1.85 1.85 ! 0.0000 498:1 Long 3.17, 3.36 A
assign (resid 15 and name HA1) (resid 13 and name HE*) 3.15 1.35 1.35 ! 0.0000 499:1 Mid 2.97, 3.65 A
assign (resid 33 and name HB2) (resid 33 and name HN) 2.65 0.85 0.85 ! 0.9970 500:1 Intra 2.62, 2.69 A
assign (resid 8 and name HB1) (resid 9 and name HN) 3.65 1.85 1.85 ! 0.5308 501:1 Ambig 4.10, 4.25 A
or (resid 13 and name HB1) (resid 9 and name HN) ! 0.4096 501:1 ----- 4.28, 4.53 A
assign (resid 33 and name HB2) (resid 9 and name HN) 3.15 1.35 1.35 ! 0.0000 502:1 Long 1.79, 1.86 A
assign (resid 32 and name HB*) (resid 32 and name HE*) 3.65 1.85 1.85 ! 0.9213 503:1 Intra 4.61, 5.05 A
assign (resid 13 and name HB1) (resid 13 and name HE*) 3.65 1.85 1.85 ! 0.5356 504:1 Ambig 4.56, 5.03 A
or (resid 8 and name HB1) (resid 13 and name HE*) ! 0.4644 504:1 ----- 4.67, 6.33 A
assign (resid 34 and name HG*) (resid 34 and name HE22) 3.15 1.35 1.35 ! 0.9486 505:1 Intra 3.45, 3.82 A
assign (resid 7 and name HG1) (resid 33 and name HN) 3.15 1.35 1.35 ! 0.9994 506:1 Long 2.05, 2.23 A
assign (resid 7 and name HG1) (resid 9 and name HN) 2.65 0.85 0.85 ! 0.9697 507:1 Mid 2.87, 3.38 A
assign (resid 7 and name HG1) (resid 32 and name HE*) 3.65 1.85 1.85 ! 0.0000 508:1 Long 3.55, 5.19 A
assign (resid 7 and name HB2) (resid 32 and name HE*) 3.15 1.35 1.35 ! 0.0000 509:1 Long 2.05, 4.15 A
assign (resid 5 and name HB*) (resid 34 and name HE22) 3.65 1.85 1.85 ! 0.0000 510:1 Long 2.81, 4.03 A
assign (resid 34 and name HB*) (resid 32 and name HE*) 2.65 0.85 0.85 ! 0.9575 511:1 Mid 2.23, 4.20 A
assign (resid 7 and name HB1) (resid 13 and name HE*) 3.15 1.35 1.35 ! 0.0000 512:1 Long 3.27, 4.58 A
assign (resid 17 and name HG2*) (resid 13 and name HE*) 2.65 0.85 0.85 ! 0.0000 513:1 Mid 2.82, 5.87 A
assign (resid 11 and name HG2*) (resid 31 and name HE*) 3.15 1.35 1.35 ! 0.0000 514:1 Long 2.80, 5.43 A
assign (resid 7 and name HG2) (resid 9 and name HN) 2.65 0.85 0.85 ! 0.0000 515:1 Mid 2.83, 3.19 A
assign (resid 11 and name HD1*) (resid 31 and name HE*) 3.15 1.35 1.35 ! 0.0000 516:1 Long 3.62, 5.46 A
assign (resid 27 and name HA) (resid 33 and name HA) 2.65 0.85 0.85 ! 0.9988 517:1 Long 2.34, 2.52 A
assign (resid 30 and name HD1) (resid 29 and name HA) 2.65 0.85 0.85 ! 0.9483 518:1 Seq 2.03, 2.11 A
assign (resid 101 and name H2) (resid 101 and name H1) 3.15 1.35 1.35 ! 0.9987 519:1 Intra 2.50, 2.70 A
assign (resid 23 and name HB) (resid 23 and name HA) 2.65 0.85 0.85 ! 0.9983 520:1 Intra 2.46, 2.50 A
assign (resid 33 and name HB1) (resid 33 and name HA) 2.65 0.85 0.85 ! 0.9962 521:1 Intra 2.43, 2.46 A
assign (resid 14 and name HB1) (resid 15 and name HN) 3.15 1.35 1.35 ! 0.9304 522:1 Seq 4.36, 4.47 A
assign (resid 15 and name HA1) (resid 15 and name HN) 2.65 0.85 0.85 ! 0.9768 523:1 Intra 2.27, 2.32 A
assign (resid 33 and name HB1) (resid 35 and name HA) 4.15 2.35 2.35 ! 0.0000 524:1 Mid 6.23, 6.36 A
assign (resid 3 and name HB1) (resid 101 and name H1) 3.15 1.35 1.35 ! 0.9385 525:1 Long 2.33, 2.69 A
assign (resid 30 and name HD2) (resid 29 and name HA) 2.65 0.85 0.85 ! 0.8601 526:1 Seq 3.21, 3.32 A
assign (resid 8 and name HB2) (resid 8 and name HA) 2.65 0.85 0.85 ! 0.9984 527:1 Intra 2.42, 2.45 A
assign (resid 29 and name HB*) (resid 29 and name HA) 2.30 0.50 0.50 ! 0.0000 529:1 Intra 2.42, 2.74 A
assign (resid 33 and name HB2) (resid 33 and name HA) 2.65 0.85 0.85 ! 0.9420 530:1 Intra 3.04, 3.05 A
assign (resid 8 and name HB1) (resid 8 and name HA) 2.30 0.50 0.50 ! 0.9456 531:1 Intra 2.36, 2.39 A
assign (resid 35 and name HB1) (resid 35 and name HA) 2.65 0.85 0.85 ! 0.0000 533:1 Intra 2.40, 2.43 A
assign (resid 35 and name HB2) (resid 35 and name HA) 2.65 0.85 0.85 ! 0.9934 534:1 Intra 3.00, 3.02 A
assign (resid 30 and name HG2) (resid 29 and name HA) 3.65 1.85 1.85 ! 0.0000 535:1 Seq 4.66, 4.75 A
assign (resid 28 and name HG) (resid 33 and name HA) 3.15 1.35 1.35 ! 0.0000 536:1 Long 2.64, 2.98 A
assign (resid 23 and name HG2*) (resid 23 and name HA) 2.65 0.85 0.85 ! 0.9917 538:1 Intra 2.41, 3.06 A
assign (resid 27 and name HG1*) (resid 29 and name HA) 3.15 1.35 1.35 ! 0.0000 539:1 Mid 3.92, 5.17 A
assign (resid 3 and name HB2) (resid 3 and name HA) 3.15 1.35 1.35 ! 0.9588 540:1 Intra 2.44, 2.72 A
assign (resid 24 and name HB) (resid 24 and name HA) 2.65 0.85 0.85 ! 0.9163 541:1 Intra 2.50, 2.54 A
assign (resid 3 and name HB1) (resid 3 and name HA) 2.65 0.85 0.85 ! 0.8440 544:1 Intra 2.30, 2.43 A
assign (resid 14 and name HB2) (resid 14 and name HA) 2.65 0.85 0.85 ! 0.9986 545:1 Intra 2.52, 2.56 A
assign (resid 14 and name HB1) (resid 14 and name HA) 2.65 0.85 0.85 ! 0.9627 546:1 Intra 2.27, 2.33 A
assign (resid 16 and name HD2) (resid 16 and name HA) 3.65 1.85 1.85 ! 0.9561 547:1 Intra 4.06, 4.08 A
assign (resid 8 and name HB2) (resid 17 and name HA) 3.15 1.35 1.35 ! 0.9342 550:1 Long 2.87, 3.22 A
assign (resid 8 and name HB2) (resid 17 and name HB) 3.65 1.85 1.85 ! 0.8701 551:1 Long 4.20, 4.62 A
assign (resid 25 and name HB2) (resid 25 and name HA) 2.65 0.85 0.85 ! 0.9695 552:1 Intra 2.46, 2.48 A
assign (resid 4 and name HB*) (resid 4 and name HA) 2.65 0.85 0.85 ! 0.0000 553:1 Intra 2.44, 2.76 A
assign (resid 31 and name HB1) (resid 31 and name HA) 2.65 0.85 0.85 ! 0.0000 554:1 Intra 2.40, 2.46 A
assign (resid 35 and name HB2) (resid 2 and name HB1) 3.15 1.35 1.35 ! 0.5367 555:1 Ambig 3.40, 4.52 A
or (resid 32 and name HB*) (resid 28 and name HB2) ! 0.4633 555:1 ----- 3.48, 4.60 A
assign (resid 8 and name HB1) (resid 17 and name HA) 3.65 1.85 1.85 ! 0.4198 556:1 Ambig 4.19, 4.58 A
or (resid 8 and name HB1) (resid 19 and name HA) ! 0.3297 556:1 ----- 4.36, 4.55 A
or (resid 25 and name HB1) (resid 17 and name HA) ! 0.1180 556:1 ----- 5.18, 6.06 A
assign (resid 13 and name HB1) (resid 13 and name HA) 3.15 1.35 1.35 ! 0.7306 557:1 Ambig 3.01, 3.03 A
or (resid 31 and name HB2) (resid 32 and name HA) ! 0.0709 557:1 ----- 4.45, 4.62 A
assign (resid 32 and name HB*) (resid 32 and name HA) 2.65 0.85 0.85 ! 0.9569 558:1 Intra 2.45, 2.75 A
assign (resid 13 and name HB2) (resid 13 and name HA) 2.30 0.50 0.50 ! 0.9873 559:1 Intra 2.41, 2.53 A
assign (resid 35 and name HB1) (resid 25 and name HA) 3.65 1.85 1.85 ! 0.7077 560:1 Ambig 3.90, 4.22 A
or (resid 35 and name HB1) (resid 24 and name HA) ! 0.2923 560:1 ----- 4.52, 4.96 A
assign (resid 25 and name HB1) (resid 25 and name HA) 2.65 0.85 0.85 ! 0.6716 561:1 Ambig 3.01, 3.03 A
or (resid 8 and name HB1) (resid 25 and name HA) ! 0.2093 561:1 ----- 3.66, 4.11 A
assign (resid 35 and name HB1) (resid 4 and name HA) 3.65 1.85 1.85 ! 0.0000 562:1 Long 2.91, 3.29 A
assign (resid 35 and name HB2) (resid 4 and name HA) 3.15 1.35 1.35 ! 0.9958 563:1 Long 2.06, 2.36 A
assign (resid 31 and name HB2) (resid 31 and name HA) 2.65 0.85 0.85 ! 0.9714 564:1 Intra 3.00, 3.02 A
assign (resid 33 and name HB2) (resid 9 and name HA2) 3.15 1.35 1.35 ! 0.6914 565:1 Ambig 3.73, 3.79 A
or (resid 33 and name HB2) (resid 7 and name HA) ! 0.2710 565:1 ----- 4.36, 4.55 A
assign (resid 26 and name HG1) (resid 26 and name HA) 3.65 1.85 1.85 ! 0.0000 566:1 Intra 2.94, 3.16 A
assign (resid 26 and name HG2) (resid 26 and name HA) 2.65 0.85 0.85 ! 0.0000 567:1 Intra 2.44, 2.54 A
assign (resid 16 and name HB1) (resid 16 and name HA) 2.30 0.50 0.50 ! 0.0000 568:1 Intra 2.26, 2.30 A
assign (resid 19 and name HB2) (resid 24 and name HA) 2.65 0.85 0.85 ! 0.7012 569:1 Ambig 2.97, 3.35 A
or (resid 26 and name HG2) (resid 25 and name HA) ! 0.1388 569:1 ----- 3.90, 5.01 A
assign (resid 7 and name HG1) (resid 7 and name HA) 2.65 0.85 0.85 ! 0.9452 570:1 Intra 2.49, 2.58 A
assign (resid 30 and name HB1) (resid 30 and name HA) 2.30 0.50 0.50 ! 0.0000 571:1 Intra 2.27, 2.30 A
assign (resid 28 and name HB1) (resid 28 and name HA) 2.65 0.85 0.85 ! 0.0000 572:1 Intra 2.41, 2.47 A
assign (resid 28 and name HG) (resid 28 and name HA) 3.65 1.85 1.85 ! 0.0000 573:1 Intra 3.20, 3.31 A
assign (resid 28 and name HB2) (resid 28 and name HA) 2.65 0.85 0.85 ! 0.9615 574:1 Intra 3.02, 3.04 A
assign (resid 2 and name HB2) (resid 2 and name HA) 3.15 1.35 1.35 ! 0.9793 575:1 Intra 2.47, 2.58 A
assign (resid 26 and name HB1) (resid 26 and name HA) 2.65 0.85 0.85 ! 0.9442 576:1 Intra 2.44, 2.47 A
assign (resid 26 and name HB2) (resid 26 and name HA) 2.65 0.85 0.85 ! 0.6185 577:1 Ambig 3.00, 3.01 A
or (resid 16 and name HB2) (resid 2 and name HA) ! 0.3136 577:1 ----- 3.36, 4.92 A
assign (resid 16 and name HG2) (resid 16 and name HA) 3.15 1.35 1.35 ! 0.8642 578:1 Intra 3.82, 3.86 A
assign (resid 16 and name HB2) (resid 16 and name HA) 2.65 0.85 0.85 ! 0.9296 579:1 Intra 2.74, 2.76 A
assign (resid 30 and name HG2) (resid 30 and name HA) 3.65 1.85 1.85 ! 0.0000 580:1 Intra 4.08, 4.12 A
assign (resid 7 and name HB2) (resid 7 and name HA) 2.65 0.85 0.85 ! 0.9989 581:1 Intra 2.37, 2.46 A
assign (resid 30 and name HG1) (resid 30 and name HA) 3.15 1.35 1.35 ! 0.0000 582:1 Intra 3.25, 3.45 A
assign (resid 18 and name HB) (resid 18 and name HA) 2.65 0.85 0.85 ! 0.9891 583:1 Intra 2.42, 2.45 A
assign (resid 7 and name HB1) (resid 7 and name HA) 3.15 1.35 1.35 ! 0.5330 586:1 Ambig 3.00, 3.02 A
or (resid 34 and name HB*) (resid 7 and name HA) ! 0.4635 586:1 ----- 3.07, 3.74 A
assign (resid 5 and name HB*) (resid 5 and name HA) 2.65 0.85 0.85 ! 0.0000 587:1 Intra 2.41, 2.64 A
assign (resid 17 and name HG2*) (resid 17 and name HA) 2.65 0.85 0.85 ! 0.0000 588:1 Intra 2.35, 2.98 A
assign (resid 17 and name HG2*) (resid 17 and name HB) 2.30 0.50 0.50 ! 0.9924 589:1 Intra 2.43, 2.65 A
assign (resid 24 and name HG2*) (resid 24 and name HA) 2.65 0.85 0.85 ! 0.9970 590:1 Intra 2.37, 3.01 A
assign (resid 30 and name HB2) (resid 30 and name HA) 2.65 0.85 0.85 ! 0.0000 591:1 Intra 2.83, 2.87 A
assign (resid 20 and name HB*) (resid 20 and name HA) 2.30 0.50 0.50 ! 0.7261 592:1 Ambig 2.42, 2.64 A
or (resid 20 and name HB*) (resid 1 and name HB) ! 0.2739 592:1 ----- 2.85, 4.99 A
assign (resid 17 and name HG2*) (resid 9 and name HA2) 3.65 1.85 1.85 ! 0.0000 593:1 Long 1.94, 3.53 A
assign (resid 1 and name HG2*) (resid 20 and name HA) 2.65 0.85 0.85 ! 0.6622 594:1 Ambig 2.17, 3.39 A
or (resid 1 and name HG2*) (resid 1 and name HB) ! 0.3327 594:1 ----- 2.44, 2.65 A
assign (resid 28 and name HD2*) (resid 28 and name HA) 2.65 0.85 0.85 ! 0.9971 595:1 Intra 2.14, 2.98 A
assign (resid 36 and name HD2*) (resid 36 and name HA) 2.30 0.50 0.50 ! 0.9894 596:1 Intra 2.07, 2.96 A
assign (resid 18 and name HG2*) (resid 18 and name HA) 2.30 0.50 0.50 ! 0.6385 597:1 Ambig 2.51, 3.13 A
or (resid 18 and name HG1*) (resid 1 and name HB) ! 0.1792 597:1 ----- 3.10, 5.26 A
assign (resid 3 and name HA) (resid 3 and name HB1) 3.65 1.85 1.85 ! 0.9295 598:1 Intra 2.30, 2.43 A
assign (resid 14 and name HA) (resid 14 and name HB1) 3.65 1.85 1.85 ! 0.9754 600:1 Intra 2.27, 2.33 A
assign (resid 25 and name HA) (resid 33 and name HB1) 3.65 1.85 1.85 ! 0.0000 601:1 Long 4.71, 4.92 A
assign (resid 21 and name HA) (resid 21 and name HB*) 3.15 1.35 1.35 ! 0.0000 602:1 Intra 2.28, 2.68 A
assign (resid 27 and name HA) (resid 33 and name HB1) 3.15 1.35 1.35 ! 0.8077 610:1 Long 1.99, 2.15 A
assign (resid 33 and name HB1) (resid 27 and name HA) 2.30 0.50 0.50 ! 0.8077 614:1 Long 1.99, 2.15 A
assign (resid 101 and name H5) (resid 101 and name H62) 2.65 0.85 0.85 ! 0.4009 618:1 Ambig 2.38, 2.55 A
or (resid 101 and name H4) (resid 101 and name H62) ! 0.3019 618:1 ----- 2.50, 3.35 A
or (resid 101 and name H5) (resid 101 and name H2) ! 0.2667 618:1 ----- 2.55, 4.00 A
assign (resid 29 and name HB*) (resid 30 and name HD1) 2.30 0.50 0.50 ! 0.0000 622:1 Seq 2.47, 3.37 A
assign (resid 29 and name HB*) (resid 30 and name HD2) 2.30 0.50 0.50 ! 0.0000 623:1 Seq 2.32, 3.12 A
assign (resid 35 and name HB1) (resid 23 and name HB) 2.65 0.85 0.85 ! 0.0000 624:1 Long 1.92, 2.25 A
assign (resid 33 and name HB2) (resid 9 and name HA1) 2.65 0.85 0.85 ! 0.8501 625:1 Ambig 2.81, 2.82 A
or (resid 33 and name HB2) (resid 10 and name HA1) ! 0.0000 625:1 ----- 0.00, 0.00 A
assign (resid 35 and name HB1) (resid 19 and name HB1) 2.65 0.85 0.85 ! 0.0000 626:1 Long 2.17, 2.35 A
assign (resid 2 and name HG1) (resid 6 and name HA1) 3.15 1.35 1.35 ! 0.0000 628:1 Mid 2.57, 2.95 A
assign (resid 34 and name HG*) (resid 5 and name HA) 3.15 1.35 1.35 ! 0.9834 629:1 Long 2.12, 3.79 A
assign (resid 30 and name HB1) (resid 30 and name HD1) 3.65 1.85 1.85 ! 0.8891 630:1 Intra 3.99, 4.03 A
assign (resid 16 and name HB1) (resid 16 and name HD2) 3.15 1.35 1.35 ! 0.0000 632:1 Intra 3.83, 3.88 A
assign (resid 16 and name HG1) (resid 16 and name HD2) 2.65 0.85 0.85 ! 0.0000 633:1 Intra 2.66, 2.69 A
assign (resid 27 and name HB) (resid 27 and name HA) 3.15 1.35 1.35 ! 0.9164 634:1 Intra 3.04, 3.04 A
assign (resid 30 and name HG2) (resid 30 and name HD1) 2.65 0.85 0.85 ! 0.7516 635:1 Ambig 2.67, 2.70 A
or (resid 16 and name HG1) (resid 1 and name HA) ! 0.2484 635:1 ----- 3.21, 4.42 A
assign (resid 30 and name HG1) (resid 30 and name HD1) 2.65 0.85 0.85 ! 0.0000 636:1 Intra 2.32, 2.34 A
assign (resid 30 and name HG2) (resid 30 and name HD2) 2.30 0.50 0.50 ! 0.5190 637:1 Ambig 2.28, 2.31 A
or (resid 16 and name HG1) (resid 16 and name HD1) ! 0.4810 637:1 ----- 2.30, 2.32 A
assign (resid 30 and name HG1) (resid 30 and name HD2) 2.65 0.85 0.85 ! 0.8189 638:1 Intra 2.98, 2.99 A
assign (resid 16 and name HG2) (resid 16 and name HD1) 2.65 0.85 0.85 ! 0.9962 639:1 Intra 2.98, 3.00 A
assign (resid 16 and name HG2) (resid 16 and name HD2) 2.65 0.85 0.85 ! 0.0000 640:1 Intra 2.31, 2.34 A
assign (resid 11 and name HG11) (resid 11 and name HA) 3.15 1.35 1.35 ! 0.9413 641:1 Intra 2.97, 3.03 A
assign (resid 24 and name HG2*) (resid 24 and name HB) 2.30 0.50 0.50 ! 0.0000 642:1 Intra 2.42, 2.64 A
assign (resid 1 and name HG2*) (resid 1 and name HA) 3.15 1.35 1.35 ! 0.0000 643:1 Intra 2.38, 3.27 A
assign (resid 27 and name HG2*) (resid 27 and name HA) 2.65 0.85 0.85 ! 0.0000 644:1 Intra 2.52, 3.19 A
assign (resid 18 and name HG1*) (resid 1 and name HA) 2.30 0.50 0.50 ! 0.6891 645:1 Ambig 2.08, 3.59 A
or (resid 23 and name HG2*) (resid 23 and name HB) ! 0.2975 645:1 ----- 2.40, 2.64 A
assign (resid 11 and name HG2*) (resid 11 and name HA) 2.65 0.85 0.85 ! 0.8510 646:1 Intra 2.55, 3.17 A
assign (resid 27 and name HG1*) (resid 27 and name HA) 2.65 0.85 0.85 ! 0.0000 647:1 Intra 2.47, 3.12 A
assign (resid 11 and name HD1*) (resid 11 and name HA) 3.65 1.85 1.85 ! 0.9170 648:1 Intra 4.41, 4.66 A
assign (resid 25 and name HA) (resid 25 and name HB1) 4.15 2.35 2.35 ! 0.7544 649:1 Ambig 3.01, 3.03 A
or (resid 25 and name HA) (resid 8 and name HB1) ! 0.2351 649:1 ----- 3.66, 4.11 A
assign (resid 31 and name HA) (resid 31 and name HB1) 3.65 1.85 1.85 ! 0.0000 650:1 Intra 2.40, 2.46 A
assign (resid 4 and name HA) (resid 4 and name HB*) 3.15 1.35 1.35 ! 0.0000 651:1 Intra 2.44, 2.76 A
assign (resid 9 and name HA2) (resid 33 and name HB2) 3.65 1.85 1.85 ! 0.6655 653:1 Ambig 3.73, 3.79 A
or (resid 7 and name HA) (resid 33 and name HB2) ! 0.2609 653:1 ----- 4.36, 4.55 A
assign (resid 30 and name HD1) (resid 29 and name HB*) 2.65 0.85 0.85 ! 0.0000 654:1 Seq 2.47, 3.37 A
assign (resid 23 and name HB) (resid 35 and name HB1) 3.15 1.35 1.35 ! 0.0000 655:1 Long 1.92, 2.25 A
assign (resid 3 and name HB2) (resid 101 and name H1) 3.65 1.85 1.85 ! 0.0000 656:1 Long 2.25, 2.80 A
assign (resid 9 and name HA1) (resid 33 and name HB2) 3.15 1.35 1.35 ! 0.8111 657:1 Long 2.81, 2.82 A
assign (resid 30 and name HD2) (resid 29 and name HB*) 2.30 0.50 0.50 ! 0.0000 658:1 Seq 2.32, 3.12 A
assign (resid 16 and name HA) (resid 16 and name HB1) 3.65 1.85 1.85 ! 0.0000 670:1 Intra 2.26, 2.30 A
assign (resid 7 and name HA) (resid 7 and name HG1) 3.65 1.85 1.85 ! 0.9601 671:1 Intra 2.49, 2.58 A
assign (resid 30 and name HA) (resid 30 and name HB1) 3.15 1.35 1.35 ! 0.9910 672:1 Intra 2.27, 2.30 A
assign (resid 7 and name HA) (resid 7 and name HB2) 3.65 1.85 1.85 ! 0.0000 673:1 Intra 2.37, 2.46 A
assign (resid 30 and name HD1) (resid 30 and name HG2) 2.65 0.85 0.85 ! 0.7516 674:1 Ambig 2.67, 2.70 A
or (resid 1 and name HA) (resid 16 and name HG1) ! 0.2484 674:1 ----- 3.21, 4.42 A
assign (resid 16 and name HD2) (resid 16 and name HB1) 3.15 1.35 1.35 ! 0.0000 675:1 Intra 3.83, 3.88 A
assign (resid 16 and name HD1) (resid 16 and name HG1) 2.30 0.50 0.50 ! 0.0000 677:1 Intra 2.30, 2.32 A
assign (resid 35 and name HB1) (resid 19 and name HB2) 3.65 1.85 1.85 ! 0.9329 678:1 Long 3.23, 3.62 A
assign (resid 11 and name HD1*) (resid 30 and name HB1) 3.15 1.35 1.35 ! 0.0000 688:1 Long 2.57, 3.57 A
assign (resid 30 and name HA) (resid 30 and name HG1) 3.65 1.85 1.85 ! 0.8868 689:1 Intra 3.25, 3.45 A
assign (resid 7 and name HA) (resid 7 and name HB1) 3.65 1.85 1.85 ! 0.5323 690:1 Ambig 3.00, 3.02 A
or (resid 7 and name HA) (resid 34 and name HB*) ! 0.4629 690:1 ----- 3.07, 3.74 A
assign (resid 18 and name HA) (resid 18 and name HB) 3.15 1.35 1.35 ! 0.9910 692:1 Intra 2.42, 2.45 A
assign (resid 27 and name HA) (resid 27 and name HB) 3.15 1.35 1.35 ! 0.9164 693:1 Intra 3.04, 3.04 A
assign (resid 30 and name HD1) (resid 30 and name HG1) 2.65 0.85 0.85 ! 0.6977 694:1 Ambig 2.32, 2.34 A
or (resid 1 and name HA) (resid 16 and name HB2) ! 0.2892 694:1 ----- 2.68, 3.20 A
assign (resid 11 and name HA) (resid 11 and name HG11) 2.65 0.85 0.85 ! 0.9936 695:1 Intra 2.97, 3.03 A
assign (resid 5 and name HA) (resid 5 and name HB*) 2.65 0.85 0.85 ! 0.0000 696:1 Intra 2.41, 2.64 A
assign (resid 20 and name HA) (resid 20 and name HB*) 2.65 0.85 0.85 ! 0.7261 697:1 Ambig 2.42, 2.64 A
or (resid 1 and name HB) (resid 20 and name HB*) ! 0.2739 697:1 ----- 2.85, 4.99 A
assign (resid 16 and name HD2) (resid 16 and name HG2) 2.65 0.85 0.85 ! 0.9845 698:1 Intra 2.31, 2.34 A
assign (resid 16 and name HD2) (resid 16 and name HG1) 3.15 1.35 1.35 ! 0.0000 699:1 Intra 2.66, 2.69 A
assign (resid 30 and name HD2) (resid 30 and name HG1) 2.65 0.85 0.85 ! 0.8148 700:1 Intra 2.98, 2.99 A
assign (resid 16 and name HD2) (resid 16 and name HB2) 3.65 1.85 1.85 ! 0.0000 701:1 Intra 4.04, 4.07 A
assign (resid 2 and name HG1) (resid 2 and name HB2) 3.15 1.35 1.35 ! 0.9428 702:1 Intra 2.99, 3.01 A
assign (resid 2 and name HG1) (resid 2 and name HB1) 3.65 1.85 1.85 ! 0.0000 703:1 Intra 2.41, 2.44 A
assign (resid 16 and name HB1) (resid 16 and name HG2) 2.65 0.85 0.85 ! 0.8040 704:1 Intra 2.96, 2.99 A
assign (resid 34 and name HG*) (resid 34 and name HB*) 2.30 0.50 0.50 ! 0.6455 706:1 Ambig 2.28, 2.71 A
or (resid 34 and name HG*) (resid 28 and name HG) ! 0.3545 706:1 ----- 2.52, 3.67 A
assign (resid 18 and name HG1*) (resid 18 and name HB) 2.30 0.50 0.50 ! 0.5066 709:1 Ambig 2.37, 2.62 A
or (resid 18 and name HG2*) (resid 18 and name HB) ! 0.4678 709:1 ----- 2.41, 2.64 A
assign (resid 27 and name HG2*) (resid 27 and name HB) 2.30 0.50 0.50 ! 0.9937 710:1 Intra 2.42, 2.64 A
assign (resid 27 and name HG1*) (resid 27 and name HB) 2.30 0.50 0.50 ! 0.9681 711:1 Intra 2.41, 2.63 A
assign (resid 11 and name HD1*) (resid 11 and name HG11) 2.30 0.50 0.50 ! 0.0000 712:1 Intra 2.40, 2.63 A
assign (resid 30 and name HA) (resid 30 and name HB2) 3.15 1.35 1.35 ! 0.0000 713:1 Intra 2.83, 2.87 A
assign (resid 7 and name HA) (resid 7 and name HG2) 3.15 1.35 1.35 ! 0.9426 714:1 Intra 3.00, 3.13 A
assign (resid 11 and name HA) (resid 11 and name HB) 2.65 0.85 0.85 ! 0.5516 715:1 Ambig 3.03, 3.04 A
or (resid 9 and name HA1) (resid 17 and name HG2*) ! 0.3703 715:1 ----- 3.24, 4.80 A
assign (resid 1 and name HB) (resid 1 and name HG2*) 3.15 1.35 1.35 ! 0.9818 716:1 Intra 2.44, 2.65 A
assign (resid 1 and name HA) (resid 1 and name HG2*) 3.15 1.35 1.35 ! 0.0000 717:1 Intra 2.38, 3.27 A
assign (resid 30 and name HD1) (resid 30 and name HB2) 3.65 1.85 1.85 ! 0.0000 718:1 Intra 3.88, 3.98 A
assign (resid 24 and name HB) (resid 24 and name HG2*) 2.65 0.85 0.85 ! 0.0000 719:1 Intra 2.42, 2.64 A
assign (resid 18 and name HA) (resid 18 and name HG2*) 2.65 0.85 0.85 ! 0.9037 720:1 Intra 2.51, 3.13 A
assign (resid 23 and name HB) (resid 23 and name HG2*) 2.30 0.50 0.50 ! 0.0000 721:1 Intra 2.40, 2.64 A
assign (resid 27 and name HA) (resid 27 and name HG2*) 2.65 0.85 0.85 ! 0.0000 722:1 Intra 2.52, 3.19 A
assign (resid 11 and name HA) (resid 11 and name HG12) 3.15 1.35 1.35 ! 0.9928 723:1 Intra 2.52, 2.57 A
assign (resid 27 and name HA) (resid 27 and name HG1*) 2.65 0.85 0.85 ! 0.0000 724:1 Intra 2.47, 3.12 A
assign (resid 30 and name HD2) (resid 30 and name HB2) 3.15 1.35 1.35 ! 0.0000 725:1 Intra 2.87, 3.07 A
assign (resid 22 and name HA2) (resid 23 and name HG2*) 3.65 1.85 1.85 ! 0.7946 726:1 Ambig 4.69, 5.69 A
or (resid 16 and name HD1) (resid 18 and name HG1*) ! 0.2054 726:1 ----- 5.87, 7.21 A
assign (resid 19 and name HB1) (resid 23 and name HG2*) 3.15 1.35 1.35 ! 0.7529 727:1 Ambig 4.35, 5.08 A
or (resid 19 and name HB1) (resid 18 and name HG2*) ! 0.1805 727:1 ----- 5.52, 6.44 A
assign (resid 11 and name HA) (resid 11 and name HG2*) 2.65 0.85 0.85 ! 0.8263 728:1 Intra 2.55, 3.17 A
assign (resid 12 and name HA2) (resid 11 and name HG2*) 3.15 1.35 1.35 ! 0.0000 729:1 Seq 3.78, 4.73 A
assign (resid 33 and name HB1) (resid 27 and name HG2*) 3.15 1.35 1.35 ! 0.9942 730:1 Long 2.66, 3.74 A
assign (resid 8 and name HB2) (resid 17 and name HG2*) 3.65 1.85 1.85 ! 0.0000 731:1 Long 4.51, 5.73 A
assign (resid 30 and name HG2) (resid 30 and name HB2) 2.65 0.85 0.85 ! 0.0000 734:1 Intra 2.29, 2.31 A
assign (resid 7 and name HB2) (resid 7 and name HG2) 3.15 1.35 1.35 ! 0.0000 735:1 Intra 3.00, 3.01 A
assign (resid 18 and name HB) (resid 18 and name HG1*) 2.30 0.50 0.50 ! 0.5133 736:1 Ambig 2.37, 2.62 A
or (resid 18 and name HB) (resid 18 and name HG2*) ! 0.4741 736:1 ----- 2.41, 2.64 A
assign (resid 27 and name HB) (resid 27 and name HG2*) 2.30 0.50 0.50 ! 0.9937 737:1 Intra 2.42, 2.64 A
assign (resid 27 and name HB) (resid 27 and name HG1*) 2.30 0.50 0.50 ! 0.9988 738:1 Intra 2.41, 2.63 A
assign (resid 28 and name HG) (resid 28 and name HD2*) 2.65 0.85 0.85 ! 0.9340 740:1 Intra 2.43, 2.64 A
assign (resid 11 and name HD1*) (resid 11 and name HB) 2.65 0.85 0.85 ! 0.0000 741:1 Intra 2.53, 3.16 A
assign (resid 11 and name HD1*) (resid 11 and name HG12) 2.30 0.50 0.50 ! 0.0000 742:1 Intra 2.41, 2.62 A
assign (resid 11 and name HD1*) (resid 11 and name HG2*) 2.30 0.50 0.50 ! 0.0000 743:1 Intra 2.00, 3.64 A
assign (resid 11 and name HA) (resid 11 and name HD1*) 3.65 1.85 1.85 ! 0.0000 744:1 Intra 4.41, 4.66 A
assign (resid 30 and name HB1) (resid 11 and name HD1*) 3.15 1.35 1.35 ! 0.0000 745:1 Long 2.57, 3.57 A
assign (resid 11 and name HG11) (resid 11 and name HD1*) 2.30 0.50 0.50 ! 0.0000 746:1 Intra 2.40, 2.63 A
assign (resid 33 and name HA) (resid 34 and name HN) 3.15 1.35 1.35 ! 0.9854 747:1 Seq 2.25, 2.30 A
assign (resid 33 and name HA) (resid 28 and name HN) 3.15 1.35 1.35 ! 0.9677 748:1 Long 1.90, 1.99 A
assign (resid 35 and name HA) (resid 36 and name HN) 3.15 1.35 1.35 ! 0.8775 749:1 Seq 2.05, 2.09 A
assign (resid 33 and name HA) (resid 33 and name HB1) 3.65 1.85 1.85 ! 0.0000 750:1 Intra 2.43, 2.46 A
assign (resid 8 and name HA) (resid 8 and name HB2) 3.65 1.85 1.85 ! 0.0000 751:1 Intra 2.42, 2.45 A
assign (resid 33 and name HA) (resid 27 and name HA) 3.65 1.85 1.85 ! 0.0000 752:1 Long 2.34, 2.52 A
assign (resid 8 and name HA) (resid 8 and name HB1) 3.15 1.35 1.35 ! 0.9917 753:1 Intra 2.36, 2.39 A
assign (resid 33 and name HA) (resid 33 and name HB2) 3.65 1.85 1.85 ! 0.9342 754:1 Intra 3.04, 3.05 A
assign (resid 8 and name HN) (resid 33 and name HN) 3.65 1.85 1.85 ! 0.7174 756:1 Ambig 3.52, 3.72 A
or (resid 32 and name HN) (resid 33 and name HN) ! 0.2454 756:1 ----- 4.20, 4.25 A
assign (resid 10 and name HN) (resid 10 and name HA2) 2.65 0.85 0.85 ! 0.8901 757:1 Intra 2.91, 2.94 A
assign (resid 24 and name HN) (resid 23 and name HB) 2.30 0.50 0.50 ! 0.0000 758:1 Seq 2.52, 2.76 A
assign (resid 33 and name HN) (resid 10 and name HA1) 3.15 1.35 1.35 ! 0.9596 759:1 Long 3.00, 3.43 A
assign (resid 31 and name HE*) (resid 30 and name HD2) 3.15 1.35 1.35 ! 0.9063 760:1 Seq 3.59, 5.45 A
assign (resid 34 and name HE22) (resid 5 and name HA) 3.65 1.85 1.85 ! 0.0000 761:1 Long 2.46, 3.05 A
assign (resid 18 and name HN) (resid 17 and name HA) 3.65 1.85 1.85 ! 0.0000 762:1 Seq 2.73, 3.17 A
assign (resid 33 and name HN) (resid 33 and name HA) 3.15 1.35 1.35 ! 0.9878 763:1 Intra 2.93, 2.93 A
assign (resid 13 and name HD*) (resid 15 and name HN) 3.15 1.35 1.35 ! 0.7004 764:1 Ambig 3.20, 3.76 A
or (resid 13 and name HD*) (resid 8 and name HA) ! 0.2996 764:1 ----- 3.68, 5.05 A
assign (resid 33 and name HN) (resid 10 and name HA2) 3.65 1.85 1.85 ! 0.0000 765:1 Long 3.54, 3.77 A
assign (resid 29 and name HD21) (resid 28 and name HB1) 3.65 1.85 1.85 ! 0.9624 766:1 Seq 2.69, 3.97 A
assign (resid 11 and name HN) (resid 11 and name HG2*) 3.65 1.85 1.85 ! 0.8216 767:1 Intra 4.35, 4.53 A
assign (resid 7 and name HG2) (resid 7 and name HA) 3.15 1.35 1.35 ! 0.9426 768:1 Intra 3.00, 3.13 A
assign (resid 23 and name HG2*) (resid 36 and name HA) 3.15 1.35 1.35 ! 0.6702 769:1 Ambig 2.99, 4.43 A
or (resid 18 and name HG1*) (resid 16 and name HA) ! 0.3025 769:1 ----- 3.41, 4.77 A
assign (resid 28 and name HD1*) (resid 28 and name HA) 3.15 1.35 1.35 ! 0.7471 770:1 Ambig 4.34, 4.70 A
or (resid 18 and name HG1*) (resid 17 and name HB) ! 0.1855 770:1 ----- 5.47, 6.73 A
assign (resid 27 and name HG2*) (resid 26 and name HA) 3.15 1.35 1.35 ! 0.0000 771:1 Seq 3.48, 4.63 A
assign (resid 11 and name HG2*) (resid 12 and name HA1) 3.15 1.35 1.35 ! 0.6539 772:1 Ambig 3.59, 4.74 A
or (resid 27 and name HG2*) (resid 10 and name HA2) ! 0.3293 772:1 ----- 4.02, 5.38 A
assign (resid 27 and name HG1*) (resid 33 and name HA) 3.65 1.85 1.85 ! 0.0000 773:1 Long 4.33, 5.19 A
assign (resid 27 and name HG1*) (resid 28 and name HA) 3.65 1.85 1.85 ! 0.0000 774:1 Seq 4.24, 5.39 A
assign (resid 27 and name HG1*) (resid 30 and name HA) 3.65 1.85 1.85 ! 0.0000 775:1 Mid 2.26, 2.82 A
assign (resid 11 and name HB) (resid 31 and name HA) 3.15 1.35 1.35 ! 0.0000 776:1 Long 2.67, 3.21 A
assign (resid 17 and name HG2*) (resid 15 and name HN) 3.65 1.85 1.85 ! 0.6565 777:1 Ambig 3.88, 5.21 A
or (resid 17 and name HG2*) (resid 8 and name HA) ! 0.3435 777:1 ----- 4.32, 5.46 A
assign (resid 11 and name HB) (resid 11 and name HA) 3.15 1.35 1.35 ! 0.5646 778:1 Ambig 3.03, 3.04 A
or (resid 17 and name HG2*) (resid 9 and name HA1) ! 0.3790 778:1 ----- 3.24, 4.80 A
assign (resid 11 and name HG12) (resid 11 and name HA) 3.15 1.35 1.35 ! 0.9928 779:1 Intra 2.52, 2.57 A
assign (resid 27 and name HG2*) (resid 33 and name HA) 3.65 1.85 1.85 ! 0.0000 780:1 Long 4.55, 5.46 A
assign (resid 28 and name HD2*) (resid 33 and name HA) 3.65 1.85 1.85 ! 0.8953 781:1 Long 4.46, 5.31 A
assign (resid 19 and name HB1) (resid 35 and name HB1) 2.65 0.85 0.85 ! 0.0000 782:1 Long 2.17, 2.35 A
assign (resid 26 and name HG1) (resid 26 and name HB1) 2.65 0.85 0.85 ! 0.0000 783:1 Intra 2.43, 2.95 A
assign (resid 2 and name HB2) (resid 2 and name HG1) 2.65 0.85 0.85 ! 0.0000 784:1 Intra 2.99, 3.01 A
assign (resid 16 and name HG1) (resid 16 and name HB1) 2.30 0.50 0.50 ! 0.0000 785:1 Intra 2.31, 2.32 A
assign (resid 26 and name HB2) (resid 26 and name HG2) 2.65 0.85 0.85 ! 0.9674 786:1 Intra 2.44, 2.96 A
assign (resid 7 and name HB1) (resid 7 and name HG1) 2.65 0.85 0.85 ! 0.8526 788:1 Intra 3.00, 3.01 A
assign (resid 30 and name HB2) (resid 30 and name HG2) 2.65 0.85 0.85 ! 0.0000 789:1 Intra 2.29, 2.31 A
assign (resid 7 and name HG1) (resid 7 and name HB1) 2.65 0.85 0.85 ! 0.8482 790:1 Intra 3.00, 3.01 A
assign (resid 30 and name HB1) (resid 30 and name HG1) 2.30 0.50 0.50 ! 0.6151 791:1 Ambig 2.26, 2.30 A
or (resid 26 and name HG2) (resid 26 and name HB2) ! 0.3820 791:1 ----- 2.44, 2.96 A
assign (resid 26 and name HG2) (resid 26 and name HB1) 2.30 0.50 0.50 ! 0.6395 792:1 Ambig 2.44, 2.52 A
or (resid 30 and name HB1) (resid 30 and name HG2) ! 0.3605 792:1 ----- 2.68, 2.75 A
assign (resid 36 and name HG) (resid 36 and name HD2*) 2.30 0.50 0.50 ! 0.4895 795:1 Ambig 2.41, 2.63 A
or (resid 36 and name HG) (resid 36 and name HD1*) ! 0.4805 795:1 ----- 2.42, 2.63 A
assign (resid 7 and name HB1) (resid 7 and name HG2) 2.65 0.85 0.85 ! 0.9961 796:1 Intra 2.36, 2.44 A
assign (resid 30 and name HG1) (resid 30 and name HB2) 3.15 1.35 1.35 ! 0.0000 797:1 Intra 2.94, 2.97 A
assign (resid 7 and name HG2) (resid 7 and name HB1) 2.65 0.85 0.85 ! 0.9961 799:1 Intra 2.36, 2.44 A
assign (resid 2 and name HB1) (resid 35 and name HB2) 3.15 1.35 1.35 ! 0.5288 800:1 Ambig 3.40, 4.52 A
or (resid 28 and name HB2) (resid 32 and name HB*) ! 0.4564 800:1 ----- 3.48, 4.60 A
assign (resid 30 and name HB2) (resid 30 and name HD2) 3.65 1.85 1.85 ! 0.0000 801:1 Intra 2.87, 3.07 A
assign (resid 36 and name HG) (resid 36 and name HA) 3.15 1.35 1.35 ! 0.9945 802:1 Intra 3.04, 3.11 A
assign (resid 16 and name HB2) (resid 16 and name HD2) 3.15 1.35 1.35 ! 0.5739 804:1 Ambig 4.04, 4.07 A
or (resid 27 and name HB) (resid 33 and name HB1) ! 0.2834 804:1 ----- 4.54, 4.73 A
assign (resid 28 and name HD1*) (resid 32 and name HE*) 3.15 1.35 1.35 ! 0.0000 805:1 Mid 2.24, 5.39 A
assign (resid 11 and name HG2*) (resid 31 and name HD*) 3.15 1.35 1.35 ! 0.0000 806:1 Long 3.29, 6.00 A
assign (resid 33 and name HN) (resid 8 and name HN) 3.15 1.35 1.35 ! 0.7345 807:1 Ambig 3.52, 3.72 A
or (resid 33 and name HN) (resid 32 and name HN) ! 0.2513 807:1 ----- 4.20, 4.25 A
assign (resid 13 and name HD*) (resid 13 and name HN) 3.15 1.35 1.35 ! 0.6000 808:1 Ambig 4.61, 4.74 A
or (resid 13 and name HD*) (resid 8 and name HN) ! 0.4000 808:1 ----- 4.93, 5.95 A
assign (resid 13 and name HD*) (resid 14 and name HN) 3.15 1.35 1.35 ! 0.9905 809:1 Seq 3.22, 4.36 A
assign (resid 32 and name HD*) (resid 29 and name HN) 3.65 1.85 1.85 ! 0.6344 811:1 Ambig 3.35, 5.06 A
or (resid 7 and name HE22) (resid 10 and name HN) ! 0.1791 811:1 ----- 4.13, 4.35 A
assign (resid 36 and name HN) (resid 24 and name HN) 2.65 0.85 0.85 ! 0.9853 812:1 Long 2.58, 2.80 A
assign (resid 7 and name HE22) (resid 13 and name HN) 3.65 1.85 1.85 ! 0.4271 813:1 Ambig 4.39, 5.13 A
or (resid 32 and name HD*) (resid 32 and name HN) ! 0.2883 813:1 ----- 4.68, 4.89 A
or (resid 7 and name HE22) (resid 32 and name HN) ! 0.1477 813:1 ----- 5.24, 5.73 A
assign (resid 11 and name HG12) (resid 11 and name HN) 3.65 1.85 1.85 ! 0.0000 814:1 Intra 3.34, 3.43 A
assign (resid 29 and name HB*) (resid 27 and name HG1*) 3.65 1.85 1.85 ! 0.0000 815:1 Mid 5.62, 6.38 A
assign (resid 29 and name HB*) (resid 28 and name HB1) 3.65 1.85 1.85 ! 0.8077 816:1 Seq 4.55, 5.47 A
assign (resid 29 and name HB*) (resid 28 and name HB2) 3.65 1.85 1.85 ! 0.7593 817:1 Ambig 3.85, 4.65 A
or (resid 29 and name HB*) (resid 30 and name HG1) ! 0.2407 817:1 ----- 4.66, 5.39 A
assign (resid 29 and name HB*) (resid 30 and name HG2) 3.65 1.85 1.85 ! 0.0000 818:1 Seq 4.50, 5.33 A
assign (resid 35 and name HB1) (resid 23 and name HG2*) 3.65 1.85 1.85 ! 0.0000 819:1 Long 3.26, 4.24 A
assign (resid 35 and name HB2) (resid 23 and name HG2*) 3.65 1.85 1.85 ! 0.4897 820:1 Ambig 3.38, 4.89 A
or (resid 33 and name HB2) (resid 27 and name HG2*) ! 0.3625 820:1 ----- 3.55, 4.74 A
assign (resid 19 and name HB1) (resid 35 and name HB2) 3.65 1.85 1.85 ! 0.0000 821:1 Long 3.47, 3.69 A
assign (resid 28 and name HG) (resid 28 and name HD1*) 3.15 1.35 1.35 ! 0.5084 822:1 Ambig 2.39, 2.62 A
or (resid 34 and name HB*) (resid 28 and name HD1*) ! 0.4916 822:1 ----- 2.40, 5.08 A
assign (resid 34 and name HB*) (resid 36 and name HG) 3.15 1.35 1.35 ! 0.0000 823:1 Mid 3.26, 4.59 A
assign (resid 7 and name HG2) (resid 7 and name HB2) 2.65 0.85 0.85 ! 0.0000 824:1 Intra 3.00, 3.01 A
assign (resid 11 and name HG12) (resid 11 and name HD1*) 2.65 0.85 0.85 ! 0.0000 825:1 Intra 2.41, 2.62 A
assign (resid 30 and name HG2) (resid 29 and name HB*) 3.15 1.35 1.35 ! 0.0000 826:1 Seq 4.50, 5.33 A
assign (resid 19 and name HB2) (resid 35 and name HB1) 3.15 1.35 1.35 ! 0.9722 828:1 Long 3.23, 3.62 A
assign (resid 30 and name HG1) (resid 29 and name HA) 3.65 1.85 1.85 ! 0.0000 829:1 Seq 3.97, 4.03 A
assign (resid 28 and name HB1) (resid 29 and name HD21) 3.65 1.85 1.85 ! 0.0000 830:1 Seq 2.69, 3.97 A
assign (resid 9 and name HN) (resid 10 and name HN) 3.65 1.85 1.85 ! 0.9955 831:1 Seq 2.22, 2.51 A
assign (resid 9 and name HN) (resid 7 and name HE21) 3.65 1.85 1.85 ! 0.9632 832:1 Mid 4.17, 4.49 A
assign (resid 9 and name HN) (resid 13 and name HD*) 3.15 1.35 1.35 ! 0.8960 833:1 Mid 3.74, 5.10 A
assign (resid 9 and name HN) (resid 7 and name HB2) 4.15 2.35 2.35 ! 0.0000 835:1 Mid 4.96, 5.32 A
assign (resid 9 and name HN) (resid 8 and name HB2) 3.65 1.85 1.85 ! 0.0000 836:1 Seq 3.85, 4.01 A
assign (resid 13 and name HE*) (resid 2 and name HG2) 3.65 1.85 1.85 ! 0.8086 837:1 Long 4.07, 5.43 A
assign (resid 13 and name HE*) (resid 9 and name HA1) 3.65 1.85 1.85 ! 0.7055 838:1 Ambig 5.38, 7.10 A
or (resid 13 and name HE*) (resid 14 and name HB2) ! 0.1541 838:1 ----- 6.93, 7.86 A
assign (resid 29 and name HD21) (resid 30 and name HD1) 4.15 2.35 2.35 ! 0.0000 839:1 Seq 4.96, 5.48 A
assign (resid 8 and name HN) (resid 33 and name HB1) 3.65 1.85 1.85 ! 0.9394 840:1 Long 4.09, 4.25 A
assign (resid 31 and name HN) (resid 11 and name HG11) 3.65 1.85 1.85 ! 0.8361 841:1 Long 4.66, 5.08 A
assign (resid 28 and name HN) (resid 33 and name HB1) 3.65 1.85 1.85 ! 0.5517 842:1 Ambig 3.31, 3.58 A
or (resid 27 and name HN) (resid 33 and name HB1) ! 0.3694 842:1 ----- 3.54, 3.68 A
assign (resid 10 and name HN) (resid 9 and name HN) 3.65 1.85 1.85 ! 0.9962 843:1 Seq 2.22, 2.51 A
assign (resid 10 and name HN) (resid 13 and name HD*) 3.65 1.85 1.85 ! 0.7263 844:1 Ambig 3.12, 4.14 A
or (resid 10 and name HN) (resid 7 and name HE22) ! 0.1341 844:1 ----- 4.13, 4.35 A
assign (resid 10 and name HN) (resid 33 and name HN) 3.65 1.85 1.85 ! 0.7024 845:1 Ambig 3.28, 3.56 A
or (resid 31 and name HN) (resid 31 and name HE*) ! 0.1228 845:1 ----- 4.38, 5.46 A
assign (resid 11 and name HN) (resid 31 and name HD*) 3.65 1.85 1.85 ! 0.8658 847:1 Long 3.31, 4.74 A
assign (resid 7 and name HN) (resid 2 and name HE22) 3.65 1.85 1.85 ! 0.0000 848:1 Long 3.26, 4.21 A
assign (resid 34 and name HN) (resid 33 and name HN) 3.65 1.85 1.85 ! 0.7396 849:1 Ambig 4.27, 4.33 A
or (resid 12 and name HN) (resid 31 and name HE*) ! 0.1703 849:1 ----- 5.45, 7.66 A
assign (resid 36 and name HN) (resid 26 and name HE21) 3.65 1.85 1.85 ! 0.7598 851:1 Ambig 3.46, 3.98 A
or (resid 26 and name HN) (resid 26 and name HE21) ! 0.2402 851:1 ----- 4.19, 4.99 A
assign (resid 5 and name HN) (resid 4 and name HD2) 3.65 1.85 1.85 ! 0.0000 852:1 Seq 3.36, 3.77 A
assign (resid 24 and name HN) (resid 26 and name HE21) 3.65 1.85 1.85 ! 0.0000 853:1 Mid 3.35, 4.00 A
assign (resid 13 and name HN) (resid 7 and name HE22) 3.15 1.35 1.35 ! 0.2797 854:1 Ambig 4.39, 5.13 A
or (resid 13 and name HN) (resid 13 and name HD*) ! 0.2071 854:1 ----- 4.61, 4.74 A
or (resid 32 and name HN) (resid 32 and name HD*) ! 0.1888 854:1 ----- 4.68, 4.89 A
or (resid 8 and name HN) (resid 13 and name HD*) ! 0.1381 854:1 ----- 4.93, 5.95 A
assign (resid 13 and name HN) (resid 7 and name HE21) 3.15 1.35 1.35 ! 0.3954 855:1 Ambig 3.83, 4.92 A
or (resid 32 and name HN) (resid 31 and name HD*) ! 0.2928 855:1 ----- 4.03, 5.02 A
or (resid 32 and name HN) (resid 7 and name HE21) ! 0.1473 855:1 ----- 4.52, 5.25 A
assign (resid 11 and name HD1*) (resid 31 and name HA) 3.65 1.85 1.85 ! 0.0000 858:1 Long 4.32, 5.53 A
assign (resid 13 and name HB2) (resid 10 and name HA2) 3.65 1.85 1.85 ! 0.5613 859:1 Ambig 4.53, 4.60 A
or (resid 13 and name HB2) (resid 12 and name HA1) ! 0.4387 859:1 ----- 4.72, 4.93 A
assign (resid 33 and name HA) (resid 34 and name HN) 2.30 0.50 0.50 ! 0.9854 0:2 Seq 2.25, 2.30 A
assign (resid 35 and name HA) (resid 36 and name HN) 2.30 0.50 0.50 ! 0.8775 1:2 Seq 2.05, 2.09 A
assign (resid 32 and name HN) (resid 31 and name HN) 2.30 0.50 0.50 ! 0.9373 3:2 Seq 1.91, 2.06 A
assign (resid 33 and name HA) (resid 28 and name HN) 2.30 0.50 0.50 ! 0.9677 4:2 Long 1.90, 1.99 A
assign (resid 35 and name HA) (resid 35 and name HN) 3.15 1.35 1.35 ! 0.0000 5:2 Intra 2.84, 2.87 A
assign (resid 31 and name HE*) (resid 31 and name HD*) 2.30 0.50 0.50 ! 0.0000 6:2 Intra 2.41, 3.68 A
assign (resid 32 and name HE*) (resid 32 and name HD*) 2.30 0.50 0.50 ! 0.9888 8:2 Intra 2.44, 3.68 A
assign (resid 13 and name HE*) (resid 13 and name HD*) 2.30 0.50 0.50 ! 0.9797 9:2 Intra 2.44, 3.68 A
assign (resid 8 and name HA) (resid 13 and name HD*) 3.65 1.85 1.85 ! 0.9668 10:2 Long 3.68, 5.05 A
assign (resid 31 and name HD*) (resid 31 and name HE*) 2.30 0.50 0.50 ! 0.0000 11:2 Intra 2.41, 3.68 A
assign (resid 32 and name HD*) (resid 32 and name HE*) 2.30 0.50 0.50 ! 0.9888 12:2 Intra 2.44, 3.68 A
assign (resid 13 and name HD*) (resid 13 and name HE*) 2.30 0.50 0.50 ! 0.0000 13:2 Intra 2.44, 3.68 A
assign (resid 33 and name HA) (resid 33 and name HN) 3.15 1.35 1.35 ! 0.9955 14:2 Intra 2.93, 2.93 A
assign (resid 8 and name HA) (resid 13 and name HE*) 2.65 0.85 0.85 ! 0.0000 15:2 Long 2.30, 4.13 A
assign (resid 24 and name HN) (resid 23 and name HA) 3.15 1.35 1.35 ! 0.0000 17:2 Seq 2.16, 2.27 A
assign (resid 34 and name HN) (resid 35 and name HA) 3.65 1.85 1.85 ! 0.0000 18:2 Seq 4.82, 4.90 A
assign (resid 34 and name HN) (resid 33 and name HA) 2.30 0.50 0.50 ! 0.9986 19:2 Seq 2.25, 2.30 A
assign (resid 36 and name HN) (resid 35 and name HA) 2.30 0.50 0.50 ! 0.8821 20:2 Seq 2.05, 2.09 A
assign (resid 34 and name HN) (resid 34 and name HA) 3.15 1.35 1.35 ! 0.0000 22:2 Intra 2.88, 2.91 A
assign (resid 28 and name HN) (resid 33 and name HA) 2.30 0.50 0.50 ! 0.9858 23:2 Long 1.90, 1.99 A
assign (resid 29 and name HN) (resid 29 and name HA) 2.65 0.85 0.85 ! 0.7742 24:2 Ambig 2.90, 2.91 A
or (resid 31 and name HN) (resid 29 and name HA) ! 0.1318 24:2 ----- 3.90, 4.15 A
assign (resid 35 and name HN) (resid 35 and name HA) 3.15 1.35 1.35 ! 0.0000 25:2 Intra 2.84, 2.87 A
assign (resid 35 and name HN) (resid 34 and name HA) 2.30 0.50 0.50 ! 0.9987 26:2 Seq 2.17, 2.28 A
assign (resid 13 and name HE*) (resid 8 and name HA) 2.65 0.85 0.85 ! 0.9300 27:2 Long 2.30, 4.13 A
assign (resid 26 and name HN) (resid 25 and name HA) 2.30 0.50 0.50 ! 0.9131 28:2 Seq 2.12, 2.15 A
assign (resid 2 and name HN) (resid 2 and name HA) 2.65 0.85 0.85 ! 0.5200 29:2 Ambig 2.79, 2.88 A
or (resid 28 and name HN) (resid 28 and name HA) ! 0.4362 29:2 ----- 2.87, 2.89 A
assign (resid 13 and name HN) (resid 13 and name HA) 2.65 0.85 0.85 ! 0.5383 30:2 Ambig 2.79, 2.83 A
or (resid 32 and name HN) (resid 32 and name HA) ! 0.4409 30:2 ----- 2.88, 2.90 A
assign (resid 32 and name HN) (resid 31 and name HA) 3.15 1.35 1.35 ! 0.8953 31:2 Seq 3.41, 3.48 A
assign (resid 13 and name HN) (resid 12 and name HA1) 3.15 1.35 1.35 ! 0.8326 32:2 Seq 3.00, 3.13 A
assign (resid 32 and name HN) (resid 30 and name HA) 3.65 1.85 1.85 ! 0.0000 33:2 Mid 4.17, 4.39 A
assign (resid 4 and name HD2) (resid 36 and name HA) 3.15 1.35 1.35 ! 0.9996 34:2 Long 2.02, 2.23 A
assign (resid 4 and name HD2) (resid 4 and name HA) 3.15 1.35 1.35 ! 0.9951 35:2 Intra 2.87, 3.08 A
assign (resid 32 and name HD*) (resid 32 and name HA) 2.65 0.85 0.85 ! 0.7374 36:2 Ambig 2.54, 3.49 A
or (resid 7 and name HE22) (resid 32 and name HA) ! 0.1871 36:2 ----- 3.20, 3.79 A
assign (resid 13 and name HD*) (resid 13 and name HA) 2.65 0.85 0.85 ! 0.9732 37:2 Intra 2.31, 3.47 A
assign (resid 31 and name HD*) (resid 31 and name HA) 2.65 0.85 0.85 ! 0.0000 38:2 Intra 2.61, 3.52 A
assign (resid 13 and name HD*) (resid 9 and name HA2) 2.65 0.85 0.85 ! 0.9939 39:2 Mid 2.51, 4.51 A
assign (resid 33 and name HN) (resid 32 and name HA) 2.30 0.50 0.50 ! 0.9778 40:2 Seq 2.04, 2.08 A
assign (resid 32 and name HE*) (resid 7 and name HA) 3.15 1.35 1.35 ! 0.0000 41:2 Long 3.23, 4.67 A
assign (resid 13 and name HE*) (resid 17 and name HA) 3.15 1.35 1.35 ! 0.0000 42:2 Mid 2.11, 5.01 A
assign (resid 13 and name HE*) (resid 17 and name HB) 3.15 1.35 1.35 ! 0.5722 43:2 Ambig 4.25, 7.16 A
or (resid 13 and name HE*) (resid 13 and name HA) ! 0.3625 43:2 ----- 4.59, 5.30 A
assign (resid 13 and name HE*) (resid 9 and name HA2) 3.15 1.35 1.35 ! 0.8662 44:2 Mid 4.23, 5.89 A
assign (resid 8 and name HA) (resid 17 and name HA) 2.65 0.85 0.85 ! 0.9366 45:2 Long 2.87, 3.25 A
assign (resid 35 and name HA) (resid 25 and name HA) 2.30 0.50 0.50 ! 0.9862 47:2 Long 2.11, 2.28 A
assign (resid 24 and name HN) (resid 23 and name HB) 2.65 0.85 0.85 ! 0.0000 48:2 Seq 2.52, 2.76 A
assign (resid 34 and name HN) (resid 27 and name HA) 3.15 1.35 1.35 ! 0.8929 49:2 Long 3.88, 4.02 A
assign (resid 36 and name HN) (resid 23 and name HB) 2.65 0.85 0.85 ! 0.9817 51:2 Long 3.07, 3.24 A
assign (resid 34 and name HN) (resid 33 and name HB1) 2.65 0.85 0.85 ! 0.0000 52:2 Seq 3.09, 3.23 A
assign (resid 28 and name HN) (resid 27 and name HA) 2.30 0.50 0.50 ! 0.8389 53:2 Seq 2.16, 2.23 A
assign (resid 13 and name HD*) (resid 9 and name HA1) 3.15 1.35 1.35 ! 0.7484 54:2 Ambig 4.12, 6.00 A
or (resid 13 and name HD*) (resid 10 and name HA1) ! 0.1998 54:2 ----- 5.13, 5.57 A
assign (resid 31 and name HD*) (resid 30 and name HD2) 3.15 1.35 1.35 ! 0.9829 55:2 Seq 2.50, 4.59 A
assign (resid 13 and name HE*) (resid 15 and name HA1) 3.15 1.35 1.35 ! 0.0000 56:2 Mid 2.97, 3.65 A
assign (resid 33 and name HA) (resid 27 and name HA) 2.30 0.50 0.50 ! 0.9991 57:2 Long 2.34, 2.52 A
assign (resid 33 and name HA) (resid 33 and name HB1) 2.30 0.50 0.50 ! 0.0000 58:2 Intra 2.43, 2.46 A
assign (resid 8 and name HA) (resid 8 and name HB2) 2.30 0.50 0.50 ! 0.9984 59:2 Intra 2.42, 2.45 A
assign (resid 35 and name HA) (resid 23 and name HB) 3.15 1.35 1.35 ! 0.0000 60:2 Long 3.31, 3.59 A
assign (resid 36 and name HN) (resid 35 and name HB1) 3.15 1.35 1.35 ! 0.9424 61:2 Seq 3.31, 3.48 A
assign (resid 34 and name HN) (resid 33 and name HB2) 3.15 1.35 1.35 ! 0.9008 62:2 Seq 3.92, 4.03 A
assign (resid 31 and name HN) (resid 29 and name HB*) 3.15 1.35 1.35 ! 0.4824 63:2 Ambig 2.40, 2.93 A
or (resid 29 and name HN) (resid 29 and name HB*) ! 0.4376 63:2 ----- 2.44, 3.09 A
assign (resid 31 and name HN) (resid 31 and name HB2) 3.15 1.35 1.35 ! 0.5205 64:2 Ambig 2.43, 2.58 A
or (resid 10 and name HN) (resid 13 and name HB1) ! 0.4522 64:2 ----- 2.49, 2.62 A
assign (resid 29 and name HN) (resid 32 and name HB*) 3.15 1.35 1.35 ! 0.7849 65:2 Ambig 2.93, 4.05 A
or (resid 28 and name HN) (resid 33 and name HB2) ! 0.0662 65:2 ----- 4.42, 4.62 A
assign (resid 35 and name HN) (resid 35 and name HB1) 3.15 1.35 1.35 ! 0.9900 66:2 Intra 3.55, 3.61 A
assign (resid 35 and name HN) (resid 35 and name HB2) 2.65 0.85 0.85 ! 0.9960 67:2 Intra 2.46, 2.53 A
assign (resid 13 and name HN) (resid 13 and name HB2) 2.30 0.50 0.50 ! 0.4531 68:2 Ambig 2.57, 2.68 A
or (resid 32 and name HN) (resid 32 and name HB*) ! 0.3757 68:2 ----- 2.65, 2.85 A
assign (resid 4 and name HD2) (resid 4 and name HB*) 3.15 1.35 1.35 ! 0.0000 69:2 Intra 2.78, 3.43 A
assign (resid 31 and name HD*) (resid 31 and name HB1) 2.30 0.50 0.50 ! 0.0000 70:2 Intra 2.33, 3.05 A
assign (resid 31 and name HD*) (resid 29 and name HB*) 3.15 1.35 1.35 ! 0.0000 71:2 Mid 3.44, 5.87 A
assign (resid 7 and name HE21) (resid 31 and name HB2) 3.65 1.85 1.85 ! 0.4430 72:2 Ambig 4.98, 5.78 A
or (resid 18 and name HN) (resid 8 and name HB1) ! 0.3375 72:2 ----- 5.21, 5.91 A
or (resid 18 and name HN) (resid 25 and name HB1) ! 0.1829 72:2 ----- 5.77, 7.12 A
assign (resid 31 and name HD*) (resid 31 and name HB2) 2.30 0.50 0.50 ! 0.0000 73:2 Intra 2.28, 3.05 A
assign (resid 13 and name HD*) (resid 13 and name HB1) 2.30 0.50 0.50 ! 0.9969 74:2 Intra 2.25, 3.01 A
assign (resid 32 and name HD*) (resid 32 and name HB*) 2.30 0.50 0.50 ! 0.7404 75:2 Ambig 2.33, 3.05 A
or (resid 7 and name HE22) (resid 13 and name HB2) ! 0.2368 75:2 ----- 2.82, 3.26 A
assign (resid 13 and name HD*) (resid 13 and name HB2) 2.30 0.50 0.50 ! 0.0000 76:2 Intra 2.53, 3.09 A
assign (resid 31 and name HE*) (resid 31 and name HB1) 3.65 1.85 1.85 ! 0.0000 77:2 Intra 4.60, 5.05 A
assign (resid 31 and name HE*) (resid 31 and name HB2) 3.15 1.35 1.35 ! 0.0000 78:2 Intra 4.57, 5.05 A
assign (resid 33 and name HN) (resid 33 and name HB2) 2.65 0.85 0.85 ! 0.9446 79:2 Intra 2.62, 2.69 A
assign (resid 32 and name HE*) (resid 32 and name HB*) 3.15 1.35 1.35 ! 0.9213 80:2 Intra 4.61, 5.05 A
assign (resid 13 and name HE*) (resid 13 and name HB1) 3.15 1.35 1.35 ! 0.5356 81:2 Ambig 4.56, 5.03 A
or (resid 13 and name HE*) (resid 8 and name HB1) ! 0.4644 81:2 ----- 4.67, 6.33 A
assign (resid 33 and name HA) (resid 33 and name HB2) 2.65 0.85 0.85 ! 0.9342 82:2 Intra 3.04, 3.05 A
assign (resid 35 and name HA) (resid 35 and name HB1) 2.30 0.50 0.50 ! 0.0000 84:2 Intra 2.40, 2.43 A
assign (resid 35 and name HA) (resid 35 and name HB2) 2.65 0.85 0.85 ! 0.9934 86:2 Intra 3.00, 3.02 A
assign (resid 26 and name HN) (resid 26 and name HG1) 2.65 0.85 0.85 ! 0.5973 87:2 Ambig 2.74, 2.97 A
or (resid 36 and name HN) (resid 26 and name HG1) ! 0.3913 87:2 ----- 2.94, 3.30 A
assign (resid 36 and name HN) (resid 26 and name HG2) 3.15 1.35 1.35 ! 0.5041 88:2 Ambig 2.65, 4.76 A
or (resid 26 and name HN) (resid 26 and name HG2) ! 0.4666 88:2 ----- 2.68, 3.76 A
assign (resid 34 and name HN) (resid 34 and name HG*) 3.15 1.35 1.35 ! 0.0000 89:2 Intra 2.39, 3.03 A
assign (resid 35 and name HN) (resid 34 and name HG*) 3.15 1.35 1.35 ! 0.0000 90:2 Seq 2.63, 4.03 A
assign (resid 32 and name HD*) (resid 7 and name HG1) 3.15 1.35 1.35 ! 0.7332 91:2 Ambig 2.89, 4.61 A
or (resid 7 and name HE22) (resid 7 and name HG1) ! 0.2668 91:2 ----- 3.42, 3.58 A
assign (resid 32 and name HD*) (resid 7 and name HB2) 3.15 1.35 1.35 ! 0.8483 92:2 Long 2.58, 4.67 A
assign (resid 32 and name HE*) (resid 7 and name HG1) 3.15 1.35 1.35 ! 0.0000 93:2 Long 3.55, 5.19 A
assign (resid 32 and name HE*) (resid 7 and name HB2) 2.65 0.85 0.85 ! 0.8447 94:2 Long 2.05, 4.15 A
assign (resid 8 and name HA) (resid 2 and name HG2) 3.15 1.35 1.35 ! 0.9808 95:2 Long 2.16, 2.65 A
assign (resid 26 and name HN) (resid 26 and name HB1) 3.15 1.35 1.35 ! 0.6937 97:2 Ambig 3.61, 3.71 A
or (resid 34 and name HN) (resid 26 and name HB1) ! 0.2071 97:2 ----- 4.41, 4.80 A
assign (resid 26 and name HN) (resid 26 and name HB2) 2.65 0.85 0.85 ! 0.8306 98:2 Intra 2.41, 2.57 A
assign (resid 12 and name HN) (resid 11 and name HG11) 3.65 1.85 1.85 ! 0.7037 99:2 Ambig 5.00, 5.06 A
or (resid 34 and name HN) (resid 36 and name HB*) ! 0.2963 99:2 ----- 5.77, 6.60 A
assign (resid 34 and name HN) (resid 34 and name HB*) 2.65 0.85 0.85 ! 0.6615 100:2 Ambig 2.39, 3.49 A
or (resid 34 and name HN) (resid 28 and name HG) ! 0.3378 100:2 ----- 2.67, 2.85 A
assign (resid 36 and name HN) (resid 36 and name HB*) 2.30 0.50 0.50 ! 0.9569 101:2 Intra 2.46, 3.17 A
assign (resid 36 and name HN) (resid 36 and name HG) 2.65 0.85 0.85 ! 0.7934 102:2 Ambig 2.95, 3.13 A
or (resid 26 and name HN) (resid 36 and name HG) ! 0.2066 102:2 ----- 3.69, 4.18 A
assign (resid 27 and name HN) (resid 27 and name HB) 2.65 0.85 0.85 ! 0.4768 103:2 Ambig 2.45, 2.50 A
or (resid 28 and name HN) (resid 28 and name HB2) ! 0.4748 103:2 ----- 2.45, 2.55 A
assign (resid 28 and name HN) (resid 28 and name HG) 2.65 0.85 0.85 ! 0.9307 104:2 Intra 2.29, 2.44 A
assign (resid 4 and name HE1) (resid 5 and name HB*) 3.65 1.85 1.85 ! 0.0000 105:2 Seq 3.36, 4.80 A
assign (resid 35 and name HN) (resid 34 and name HB*) 3.15 1.35 1.35 ! 0.9979 106:2 Seq 2.33, 3.24 A
assign (resid 4 and name HD2) (resid 5 and name HB*) 3.65 1.85 1.85 ! 0.0000 107:2 Seq 4.63, 6.17 A
assign (resid 32 and name HD*) (resid 28 and name HB2) 2.65 0.85 0.85 ! 0.0000 108:2 Mid 2.60, 4.71 A
assign (resid 32 and name HD*) (resid 28 and name HG) 2.65 0.85 0.85 ! 0.5597 109:2 Ambig 3.67, 5.68 A
or (resid 32 and name HD*) (resid 28 and name HB1) ! 0.4403 109:2 ----- 3.82, 6.14 A
assign (resid 32 and name HE*) (resid 34 and name HB*) 2.65 0.85 0.85 ! 0.9575 110:2 Mid 2.23, 4.20 A
assign (resid 13 and name HE*) (resid 7 and name HB1) 3.15 1.35 1.35 ! 0.0000 111:2 Long 3.27, 4.58 A
assign (resid 33 and name HA) (resid 28 and name HB2) 3.15 1.35 1.35 ! 0.9520 112:2 Long 3.22, 3.52 A
assign (resid 33 and name HA) (resid 28 and name HG) 2.65 0.85 0.85 ! 0.9725 113:2 Long 2.64, 2.98 A
assign (resid 35 and name HA) (resid 36 and name HB*) 3.15 1.35 1.35 ! 0.0000 114:2 Seq 4.43, 5.07 A
assign (resid 12 and name HN) (resid 11 and name HG2*) 2.65 0.85 0.85 ! 0.8219 115:2 Seq 2.96, 3.68 A
assign (resid 36 and name HN) (resid 36 and name HD2*) 2.65 0.85 0.85 ! 0.2382 116:2 Ambig 3.98, 4.83 A
or (resid 34 and name HN) (resid 28 and name HD2*) ! 0.2269 116:2 ----- 4.02, 4.94 A
or (resid 26 and name HN) (resid 36 and name HD1*) ! 0.1623 116:2 ----- 4.25, 5.57 A
or (resid 36 and name HN) (resid 36 and name HD1*) ! 0.1498 116:2 ----- 4.30, 5.05 A
or (resid 34 and name HN) (resid 36 and name HD1*) ! 0.0827 116:2 ----- 4.75, 5.62 A
assign (resid 27 and name HN) (resid 27 and name HG2*) 2.65 0.85 0.85 ! 0.9227 117:2 Intra 2.00, 2.98 A
assign (resid 4 and name HE1) (resid 36 and name HD2*) 3.65 1.85 1.85 ! 0.7972 118:2 Ambig 3.70, 4.67 A
or (resid 29 and name HN) (resid 28 and name HD2*) ! 0.1662 118:2 ----- 4.81, 5.34 A
assign (resid 28 and name HN) (resid 27 and name HG1*) 2.65 0.85 0.85 ! 0.6705 119:2 Ambig 3.54, 4.33 A
or (resid 27 and name HN) (resid 27 and name HG1*) ! 0.1893 119:2 ----- 4.37, 4.51 A
assign (resid 4 and name HD2) (resid 23 and name HG2*) 3.15 1.35 1.35 ! 0.0000 120:2 Long 2.17, 3.29 A
assign (resid 4 and name HD2) (resid 36 and name HD2*) 3.65 1.85 1.85 ! 0.9938 121:2 Long 2.47, 4.14 A
assign (resid 31 and name HD*) (resid 11 and name HB) 2.65 0.85 0.85 ! 0.0000 122:2 Long 2.57, 4.03 A
assign (resid 13 and name HD*) (resid 17 and name HG2*) 3.15 1.35 1.35 ! 0.0000 123:2 Mid 2.01, 5.16 A
assign (resid 31 and name HD*) (resid 30 and name HB2) 3.15 1.35 1.35 ! 0.0000 124:2 Seq 3.24, 4.53 A
assign (resid 32 and name HD*) (resid 28 and name HD1*) 2.65 0.85 0.85 ! 0.0000 125:2 Mid 2.05, 5.47 A
assign (resid 31 and name HD*) (resid 11 and name HG2*) 3.15 1.35 1.35 ! 0.0000 126:2 Long 3.29, 6.00 A
assign (resid 32 and name HD*) (resid 28 and name HD2*) 3.65 1.85 1.85 ! 0.0000 127:2 Mid 5.56, 7.84 A
assign (resid 31 and name HE*) (resid 11 and name HB) 3.15 1.35 1.35 ! 0.0000 128:2 Long 2.68, 4.24 A
assign (resid 31 and name HE*) (resid 30 and name HB2) 3.15 1.35 1.35 ! 0.0000 129:2 Seq 3.49, 4.66 A
assign (resid 32 and name HE*) (resid 28 and name HD1*) 3.15 1.35 1.35 ! 0.0000 130:2 Mid 2.24, 5.39 A
assign (resid 31 and name HE*) (resid 11 and name HG2*) 2.65 0.85 0.85 ! 0.7532 131:2 Ambig 2.80, 5.43 A
or (resid 34 and name HE22) (resid 28 and name HD1*) ! 0.2468 131:2 ----- 3.37, 4.79 A
assign (resid 13 and name HE*) (resid 17 and name HG2*) 2.65 0.85 0.85 ! 0.0000 133:2 Mid 2.82, 5.87 A
assign (resid 13 and name HE*) (resid 7 and name HG2) 3.15 1.35 1.35 ! 0.0000 134:2 Long 3.70, 4.38 A
assign (resid 8 and name HA) (resid 17 and name HG2*) 3.15 1.35 1.35 ! 0.0000 135:2 Long 4.32, 5.46 A
assign (resid 33 and name HA) (resid 28 and name HD1*) 3.15 1.35 1.35 ! 0.6860 136:2 Ambig 3.99, 4.98 A
or (resid 33 and name HA) (resid 27 and name HG2*) ! 0.3140 136:2 ----- 4.55, 5.46 A
assign (resid 33 and name HA) (resid 27 and name HG1*) 3.15 1.35 1.35 ! 0.0000 137:2 Long 4.33, 5.19 A
assign (resid 35 and name HA) (resid 23 and name HG2*) 3.65 1.85 1.85 ! 0.0000 138:2 Long 5.10, 5.92 A
assign (resid 35 and name HA) (resid 36 and name HD2*) 3.15 1.35 1.35 ! 0.7028 139:2 Ambig 4.91, 5.94 A
or (resid 35 and name HA) (resid 36 and name HD1*) ! 0.2972 139:2 ----- 5.67, 6.37 A
assign (resid 31 and name HD*) (resid 11 and name HD1*) 3.15 1.35 1.35 ! 0.0000 140:2 Long 4.20, 6.06 A
assign (resid 31 and name HE*) (resid 11 and name HD1*) 3.15 1.35 1.35 ! 0.0000 141:2 Long 3.62, 5.46 A
assign (resid 26 and name HA) (resid 26 and name HN) 2.65 0.85 0.85 ! 0.8703 142:2 Intra 2.87, 2.91 A
assign (resid 25 and name HA) (resid 26 and name HN) 2.30 0.50 0.50 ! 0.9269 143:2 Seq 2.12, 2.15 A
assign (resid 36 and name HA) (resid 36 and name HN) 2.65 0.85 0.85 ! 0.9545 144:2 Intra 2.90, 2.91 A
assign (resid 27 and name HA) (resid 34 and name HN) 3.15 1.35 1.35 ! 0.5701 145:2 Ambig 3.88, 4.02 A
or (resid 24 and name HB) (resid 36 and name HN) ! 0.1667 145:2 ----- 4.77, 4.89 A
or (resid 24 and name HB) (resid 26 and name HN) ! 0.1327 145:2 ----- 4.95, 5.22 A
assign (resid 23 and name HB) (resid 36 and name HN) 2.65 0.85 0.85 ! 0.9817 146:2 Long 3.07, 3.24 A
assign (resid 33 and name HB1) (resid 34 and name HN) 2.65 0.85 0.85 ! 0.7865 147:2 Ambig 3.09, 3.23 A
or (resid 33 and name HB1) (resid 26 and name HN) ! 0.2088 147:2 ----- 3.85, 4.06 A
assign (resid 35 and name HB1) (resid 36 and name HN) 3.15 1.35 1.35 ! 0.9325 148:2 Seq 3.31, 3.48 A
assign (resid 33 and name HB2) (resid 34 and name HN) 3.15 1.35 1.35 ! 0.4652 149:2 Ambig 3.92, 4.03 A
or (resid 35 and name HB2) (resid 36 and name HN) ! 0.3449 149:2 ----- 4.12, 4.24 A
assign (resid 26 and name HB1) (resid 26 and name HN) 3.15 1.35 1.35 ! 0.6937 150:2 Ambig 3.61, 3.71 A
or (resid 26 and name HB1) (resid 34 and name HN) ! 0.2071 150:2 ----- 4.41, 4.80 A
assign (resid 28 and name HG) (resid 34 and name HN) 2.65 0.85 0.85 ! 0.9679 151:2 Long 2.67, 2.85 A
assign (resid 26 and name HB2) (resid 26 and name HN) 2.65 0.85 0.85 ! 0.8306 152:2 Intra 2.41, 2.57 A
assign (resid 36 and name HB*) (resid 36 and name HN) 2.65 0.85 0.85 ! 0.9386 155:2 Intra 2.46, 3.17 A
assign (resid 36 and name HG) (resid 36 and name HN) 3.15 1.35 1.35 ! 0.7132 156:2 Ambig 2.95, 3.13 A
or (resid 36 and name HG) (resid 26 and name HN) ! 0.1857 156:2 ----- 3.69, 4.18 A
assign (resid 36 and name HD2*) (resid 36 and name HN) 2.65 0.85 0.85 ! 0.3438 157:2 Ambig 3.98, 4.83 A
or (resid 36 and name HD1*) (resid 26 and name HN) ! 0.2343 157:2 ----- 4.25, 5.57 A
or (resid 36 and name HD1*) (resid 36 and name HN) ! 0.2162 157:2 ----- 4.30, 5.05 A
or (resid 36 and name HD1*) (resid 34 and name HN) ! 0.1194 157:2 ----- 4.75, 5.62 A
assign (resid 28 and name HA) (resid 28 and name HN) 2.65 0.85 0.85 ! 0.7385 158:2 Ambig 2.87, 2.89 A
or (resid 28 and name HA) (resid 29 and name HN) ! 0.2333 158:2 ----- 3.48, 3.50 A
assign (resid 27 and name HA) (resid 28 and name HN) 2.30 0.50 0.50 ! 0.8260 159:2 Seq 2.16, 2.23 A
assign (resid 29 and name HB*) (resid 31 and name HN) 3.15 1.35 1.35 ! 0.4810 160:2 Ambig 2.40, 2.93 A
or (resid 29 and name HB*) (resid 29 and name HN) ! 0.4363 160:2 ----- 2.44, 3.09 A
assign (resid 35 and name HB1) (resid 35 and name HN) 3.15 1.35 1.35 ! 0.9900 161:2 Intra 3.55, 3.61 A
assign (resid 31 and name HB2) (resid 31 and name HN) 3.15 1.35 1.35 ! 0.5120 162:2 Ambig 2.43, 2.58 A
or (resid 13 and name HB1) (resid 10 and name HN) ! 0.4448 162:2 ----- 2.49, 2.62 A
assign (resid 35 and name HB2) (resid 6 and name HN) 3.15 1.35 1.35 ! 0.3655 163:2 Ambig 2.79, 3.29 A
or (resid 33 and name HB2) (resid 10 and name HN) ! 0.2789 163:2 ----- 2.92, 3.12 A
or (resid 32 and name HB*) (resid 29 and name HN) ! 0.2719 163:2 ----- 2.93, 4.05 A
assign (resid 35 and name HB2) (resid 35 and name HN) 2.65 0.85 0.85 ! 0.9960 164:2 Intra 2.46, 2.53 A
assign (resid 34 and name HG*) (resid 35 and name HN) 3.15 1.35 1.35 ! 0.0000 165:2 Seq 2.63, 4.03 A
assign (resid 28 and name HB2) (resid 29 and name HN) 2.30 0.50 0.50 ! 0.7261 166:2 Ambig 1.84, 1.88 A
or (resid 28 and name HB2) (resid 28 and name HN) ! 0.1298 166:2 ----- 2.45, 2.55 A
assign (resid 28 and name HB1) (resid 29 and name HN) 2.65 0.85 0.85 ! 0.8011 167:2 Seq 2.84, 3.02 A
assign (resid 28 and name HG) (resid 28 and name HN) 3.15 1.35 1.35 ! 0.9372 168:2 Intra 2.29, 2.44 A
assign (resid 27 and name HG2*) (resid 27 and name HN) 3.15 1.35 1.35 ! 0.9891 169:2 Intra 2.00, 2.98 A
assign (resid 27 and name HG1*) (resid 28 and name HN) 2.65 0.85 0.85 ! 0.5618 170:2 Ambig 3.54, 4.33 A
or (resid 27 and name HG1*) (resid 29 and name HN) ! 0.1622 170:2 ----- 4.35, 5.09 A
or (resid 27 and name HG1*) (resid 27 and name HN) ! 0.1586 170:2 ----- 4.37, 4.51 A
assign (resid 13 and name HA) (resid 13 and name HN) 2.65 0.85 0.85 ! 0.5390 171:2 Ambig 2.79, 2.83 A
or (resid 32 and name HA) (resid 32 and name HN) ! 0.4415 171:2 ----- 2.88, 2.90 A
assign (resid 31 and name HA) (resid 32 and name HN) 3.15 1.35 1.35 ! 0.8953 172:2 Seq 3.41, 3.48 A
assign (resid 10 and name HA1) (resid 13 and name HN) 3.15 1.35 1.35 ! 0.3904 173:2 Ambig 4.00, 4.23 A
or (resid 10 and name HA1) (resid 32 and name HN) ! 0.2978 173:2 ----- 4.19, 4.32 A
or (resid 9 and name HA1) (resid 8 and name HN) ! 0.2311 173:2 ----- 4.37, 4.50 A
assign (resid 13 and name HB1) (resid 13 and name HN) 3.15 1.35 1.35 ! 0.5580 174:2 Ambig 2.44, 2.54 A
or (resid 31 and name HB2) (resid 32 and name HN) ! 0.2328 174:2 ----- 2.83, 2.95 A
or (resid 8 and name HB1) (resid 8 and name HN) ! 0.2034 174:2 ----- 2.89, 2.98 A
assign (resid 32 and name HB*) (resid 32 and name HN) 2.65 0.85 0.85 ! 0.6938 175:2 Ambig 2.65, 2.85 A
or (resid 33 and name HB2) (resid 8 and name HN) ! 0.2917 175:2 ----- 3.07, 3.25 A
assign (resid 13 and name HB2) (resid 13 and name HN) 2.65 0.85 0.85 ! 0.9881 177:2 Intra 2.57, 2.68 A
assign (resid 13 and name HA) (resid 13 and name HD*) 2.30 0.50 0.50 ! 0.5603 178:2 Ambig 2.31, 3.47 A
or (resid 32 and name HA) (resid 32 and name HD*) ! 0.3148 178:2 ----- 2.54, 3.49 A
assign (resid 4 and name HA) (resid 4 and name HD2) 3.65 1.85 1.85 ! 0.9951 179:2 Intra 2.87, 3.08 A
assign (resid 31 and name HA) (resid 31 and name HD*) 2.65 0.85 0.85 ! 0.9350 180:2 Intra 2.61, 3.52 A
assign (resid 9 and name HA2) (resid 13 and name HD*) 2.30 0.50 0.50 ! 0.9971 182:2 Mid 2.51, 4.51 A
assign (resid 10 and name HA1) (resid 7 and name HE22) 2.65 0.85 0.85 ! 0.6218 183:2 Ambig 3.49, 3.64 A
or (resid 9 and name HA1) (resid 13 and name HD*) ! 0.2295 183:2 ----- 4.12, 6.00 A
assign (resid 4 and name HB*) (resid 4 and name HD2) 3.15 1.35 1.35 ! 0.0000 184:2 Intra 2.78, 3.43 A
assign (resid 31 and name HB1) (resid 31 and name HD*) 2.30 0.50 0.50 ! 0.9662 185:2 Intra 2.33, 3.05 A
assign (resid 29 and name HB*) (resid 31 and name HD*) 3.65 1.85 1.85 ! 0.9668 186:2 Mid 3.44, 5.87 A
assign (resid 31 and name HB2) (resid 31 and name HD*) 2.30 0.50 0.50 ! 0.8896 187:2 Intra 2.28, 3.05 A
assign (resid 32 and name HB*) (resid 32 and name HD*) 2.30 0.50 0.50 ! 0.9702 188:2 Intra 2.33, 3.05 A
assign (resid 13 and name HB2) (resid 13 and name HD*) 2.30 0.50 0.50 ! 0.6592 189:2 Ambig 2.53, 3.09 A
or (resid 13 and name HB2) (resid 7 and name HE22) ! 0.3408 189:2 ----- 2.82, 3.26 A
assign (resid 13 and name HB1) (resid 13 and name HD*) 2.30 0.50 0.50 ! 0.9744 190:2 Intra 2.25, 3.01 A
assign (resid 7 and name HG1) (resid 32 and name HD*) 3.15 1.35 1.35 ! 0.6917 191:2 Ambig 2.89, 4.61 A
or (resid 7 and name HG1) (resid 7 and name HE22) ! 0.2517 191:2 ----- 3.42, 3.58 A
assign (resid 28 and name HB2) (resid 32 and name HD*) 2.65 0.85 0.85 ! 0.0000 192:2 Mid 2.60, 4.71 A
assign (resid 28 and name HB1) (resid 32 and name HD*) 3.15 1.35 1.35 ! 0.0000 193:2 Mid 3.82, 6.14 A
assign (resid 11 and name HB) (resid 31 and name HD*) 2.65 0.85 0.85 ! 0.9959 194:2 Long 2.57, 4.03 A
assign (resid 17 and name HG2*) (resid 13 and name HD*) 3.15 1.35 1.35 ! 0.9992 195:2 Mid 2.01, 5.16 A
assign (resid 11 and name HG2*) (resid 31 and name HD*) 3.15 1.35 1.35 ! 0.0000 196:2 Long 3.29, 6.00 A
assign (resid 28 and name HD1*) (resid 32 and name HD*) 3.15 1.35 1.35 ! 0.0000 197:2 Mid 2.05, 5.47 A
assign (resid 11 and name HD1*) (resid 31 and name HD*) 3.65 1.85 1.85 ! 0.0000 198:2 Long 4.20, 6.06 A
assign (resid 32 and name HA) (resid 33 and name HN) 2.30 0.50 0.50 ! 0.9995 199:2 Seq 2.04, 2.08 A
assign (resid 7 and name HA) (resid 32 and name HE*) 3.15 1.35 1.35 ! 0.0000 200:2 Long 3.23, 4.67 A
assign (resid 15 and name HA1) (resid 13 and name HE*) 3.15 1.35 1.35 ! 0.0000 201:2 Mid 2.97, 3.65 A
assign (resid 33 and name HB2) (resid 33 and name HN) 2.65 0.85 0.85 ! 0.9419 202:2 Intra 2.62, 2.69 A
assign (resid 7 and name HG1) (resid 32 and name HE*) 3.15 1.35 1.35 ! 0.0000 203:2 Long 3.55, 5.19 A
assign (resid 34 and name HG*) (resid 32 and name HE*) 3.65 1.85 1.85 ! 0.0000 204:2 Mid 2.72, 5.32 A
assign (resid 7 and name HB2) (resid 32 and name HE*) 2.65 0.85 0.85 ! 0.0000 205:2 Long 2.05, 4.15 A
assign (resid 34 and name HB*) (resid 32 and name HE*) 2.65 0.85 0.85 ! 0.9356 206:2 Mid 2.23, 4.20 A
assign (resid 17 and name HG2*) (resid 13 and name HE*) 2.65 0.85 0.85 ! 0.0000 208:2 Mid 2.82, 5.87 A
assign (resid 11 and name HG2*) (resid 31 and name HE*) 3.15 1.35 1.35 ! 0.0000 209:2 Long 2.80, 5.43 A
assign (resid 11 and name HD1*) (resid 31 and name HE*) 3.15 1.35 1.35 ! 0.0000 210:2 Long 3.62, 5.46 A
assign (resid 25 and name HA) (resid 35 and name HA) 2.30 0.50 0.50 ! 0.0000 211:2 Long 2.11, 2.28 A
assign (resid 7 and name HA) (resid 34 and name HA) 2.30 0.50 0.50 ! 0.0000 212:2 Long 2.20, 2.55 A
assign (resid 27 and name HA) (resid 33 and name HA) 2.30 0.50 0.50 ! 0.9988 213:2 Long 2.34, 2.52 A
assign (resid 30 and name HD1) (resid 29 and name HA) 2.30 0.50 0.50 ! 0.9483 214:2 Seq 2.03, 2.11 A
assign (resid 101 and name H2) (resid 101 and name H1) 2.65 0.85 0.85 ! 0.9987 215:2 Intra 2.50, 2.70 A
assign (resid 3 and name HB1) (resid 101 and name H1) 2.65 0.85 0.85 ! 0.9379 216:2 Long 2.33, 2.69 A
assign (resid 23 and name HB) (resid 23 and name HA) 2.30 0.50 0.50 ! 0.9983 217:2 Intra 2.46, 2.50 A
assign (resid 33 and name HB1) (resid 33 and name HA) 2.30 0.50 0.50 ! 0.9962 218:2 Intra 2.43, 2.46 A
assign (resid 8 and name HB2) (resid 8 and name HA) 2.30 0.50 0.50 ! 0.9984 219:2 Intra 2.42, 2.45 A
assign (resid 101 and name H4) (resid 101 and name H1) 3.15 1.35 1.35 ! 0.9497 220:2 Intra 2.13, 3.49 A
assign (resid 35 and name HB1) (resid 35 and name HA) 2.30 0.50 0.50 ! 0.0000 222:2 Intra 2.40, 2.43 A
assign (resid 29 and name HB*) (resid 29 and name HA) 2.30 0.50 0.50 ! 0.0000 223:2 Intra 2.42, 2.74 A
assign (resid 33 and name HB2) (resid 33 and name HA) 2.65 0.85 0.85 ! 0.8834 224:2 Intra 3.04, 3.05 A
assign (resid 8 and name HB1) (resid 8 and name HA) 2.30 0.50 0.50 ! 0.9456 225:2 Intra 2.36, 2.39 A
assign (resid 35 and name HB2) (resid 35 and name HA) 2.65 0.85 0.85 ! 0.9934 226:2 Intra 3.00, 3.02 A
assign (resid 34 and name HG*) (resid 34 and name HA) 2.65 0.85 0.85 ! 0.0000 227:2 Intra 2.58, 3.66 A
assign (resid 28 and name HG) (resid 33 and name HA) 3.15 1.35 1.35 ! 0.0000 228:2 Long 2.64, 2.98 A
assign (resid 34 and name HB*) (resid 34 and name HA) 2.30 0.50 0.50 ! 0.9921 229:2 Intra 2.32, 2.46 A
assign (resid 27 and name HG1*) (resid 29 and name HA) 3.15 1.35 1.35 ! 0.0000 230:2 Mid 3.92, 5.17 A
assign (resid 23 and name HG2*) (resid 23 and name HA) 2.30 0.50 0.50 ! 0.9917 231:2 Intra 2.41, 3.06 A
assign (resid 3 and name HB1) (resid 3 and name HA) 2.65 0.85 0.85 ! 0.9384 232:2 Intra 2.30, 2.43 A
assign (resid 3 and name HB2) (resid 3 and name HA) 2.30 0.50 0.50 ! 0.5138 233:2 Ambig 2.44, 2.72 A
or (resid 24 and name HB) (resid 24 and name HA) ! 0.4455 233:2 ----- 2.50, 2.54 A
assign (resid 14 and name HB2) (resid 14 and name HA) 2.30 0.50 0.50 ! 0.9986 234:2 Intra 2.52, 2.56 A
assign (resid 21 and name HB*) (resid 21 and name HA) 2.30 0.50 0.50 ! 0.0000 237:2 Intra 2.28, 2.68 A
assign (resid 19 and name HB1) (resid 19 and name HA) 2.65 0.85 0.85 ! 0.9989 239:2 Intra 2.41, 2.45 A
assign (resid 8 and name HB2) (resid 17 and name HA) 2.65 0.85 0.85 ! 0.9342 240:2 Long 2.87, 3.22 A
assign (resid 14 and name HB1) (resid 14 and name HA) 2.30 0.50 0.50 ! 0.9415 241:2 Intra 2.27, 2.33 A
assign (resid 30 and name HD2) (resid 30 and name HA) 3.15 1.35 1.35 ! 0.6435 244:2 Ambig 3.90, 3.93 A
or (resid 22 and name HA2) (resid 21 and name HA) ! 0.3455 244:2 ----- 4.33, 4.39 A
assign (resid 25 and name HB2) (resid 25 and name HA) 2.30 0.50 0.50 ! 0.9695 245:2 Intra 2.46, 2.48 A
assign (resid 31 and name HB1) (resid 31 and name HA) 2.30 0.50 0.50 ! 0.0000 246:2 Intra 2.40, 2.46 A
assign (resid 4 and name HB*) (resid 4 and name HA) 2.30 0.50 0.50 ! 0.9967 247:2 Intra 2.44, 2.76 A
assign (resid 8 and name HB1) (resid 17 and name HA) 3.15 1.35 1.35 ! 0.4198 248:2 Ambig 4.19, 4.58 A
or (resid 8 and name HB1) (resid 19 and name HA) ! 0.3297 248:2 ----- 4.36, 4.55 A
or (resid 25 and name HB1) (resid 17 and name HA) ! 0.1180 248:2 ----- 5.18, 6.06 A
assign (resid 13 and name HB2) (resid 13 and name HA) 2.30 0.50 0.50 ! 0.9873 249:2 Intra 2.41, 2.53 A
assign (resid 13 and name HB1) (resid 13 and name HA) 3.15 1.35 1.35 ! 0.7306 250:2 Ambig 3.01, 3.03 A
or (resid 31 and name HB2) (resid 32 and name HA) ! 0.0709 250:2 ----- 4.45, 4.62 A
assign (resid 32 and name HB*) (resid 32 and name HA) 2.65 0.85 0.85 ! 0.9616 252:2 Intra 2.45, 2.75 A
assign (resid 25 and name HB1) (resid 25 and name HA) 2.65 0.85 0.85 ! 0.7072 253:2 Ambig 3.01, 3.03 A
or (resid 8 and name HB1) (resid 25 and name HA) ! 0.2204 253:2 ----- 3.66, 4.11 A
assign (resid 31 and name HB2) (resid 31 and name HA) 2.65 0.85 0.85 ! 0.9714 254:2 Intra 3.00, 3.02 A
assign (resid 26 and name HG1) (resid 26 and name HA) 3.15 1.35 1.35 ! 0.0000 255:2 Intra 2.94, 3.16 A
assign (resid 19 and name HB2) (resid 19 and name HA) 3.15 1.35 1.35 ! 0.8676 256:2 Intra 3.01, 3.03 A
assign (resid 7 and name HG1) (resid 32 and name HA) 2.65 0.85 0.85 ! 0.8933 257:2 Long 2.50, 2.90 A
assign (resid 26 and name HG2) (resid 26 and name HA) 2.65 0.85 0.85 ! 0.0000 258:2 Intra 2.44, 2.54 A
assign (resid 26 and name HB1) (resid 26 and name HA) 2.30 0.50 0.50 ! 0.9442 259:2 Intra 2.44, 2.47 A
assign (resid 19 and name HB2) (resid 24 and name HA) 2.65 0.85 0.85 ! 0.8768 260:2 Long 2.97, 3.35 A
assign (resid 16 and name HB1) (resid 16 and name HA) 2.30 0.50 0.50 ! 0.0000 261:2 Intra 2.26, 2.30 A
assign (resid 7 and name HG1) (resid 7 and name HA) 2.30 0.50 0.50 ! 0.9452 262:2 Intra 2.49, 2.58 A
assign (resid 7 and name HB2) (resid 7 and name HA) 2.30 0.50 0.50 ! 0.9989 263:2 Intra 2.37, 2.46 A
assign (resid 30 and name HB1) (resid 30 and name HA) 2.30 0.50 0.50 ! 0.0000 264:2 Intra 2.27, 2.30 A
assign (resid 28 and name HB1) (resid 28 and name HA) 2.30 0.50 0.50 ! 0.0000 265:2 Intra 2.41, 2.47 A
assign (resid 2 and name HB1) (resid 2 and name HA) 2.30 0.50 0.50 ! 0.7503 266:2 Ambig 2.52, 2.96 A
or (resid 28 and name HB2) (resid 28 and name HA) ! 0.2497 266:2 ----- 3.02, 3.04 A
assign (resid 2 and name HB2) (resid 2 and name HA) 3.15 1.35 1.35 ! 0.9973 267:2 Intra 2.47, 2.58 A
assign (resid 26 and name HB2) (resid 26 and name HA) 2.65 0.85 0.85 ! 0.9099 268:2 Intra 3.00, 3.01 A
assign (resid 16 and name HG2) (resid 16 and name HA) 3.15 1.35 1.35 ! 0.8642 269:2 Intra 3.82, 3.86 A
assign (resid 16 and name HB2) (resid 16 and name HA) 2.65 0.85 0.85 ! 0.0000 270:2 Intra 2.74, 2.76 A
assign (resid 7 and name HB1) (resid 7 and name HA) 2.65 0.85 0.85 ! 0.5330 271:2 Ambig 3.00, 3.02 A
or (resid 34 and name HB*) (resid 7 and name HA) ! 0.4635 271:2 ----- 3.07, 3.74 A
assign (resid 30 and name HG1) (resid 30 and name HA) 2.65 0.85 0.85 ! 0.8573 272:2 Intra 3.25, 3.45 A
assign (resid 18 and name HB) (resid 18 and name HA) 2.65 0.85 0.85 ! 0.9689 273:2 Intra 2.42, 2.45 A
assign (resid 20 and name HB*) (resid 3 and name HA) 3.15 1.35 1.35 ! 0.0000 274:2 Long 2.86, 3.84 A
assign (resid 36 and name HB*) (resid 36 and name HA) 2.30 0.50 0.50 ! 0.9951 275:2 Intra 2.46, 2.76 A
assign (resid 20 and name HB*) (resid 20 and name HA) 2.30 0.50 0.50 ! 0.7261 277:2 Ambig 2.42, 2.64 A
or (resid 20 and name HB*) (resid 1 and name HB) ! 0.2739 277:2 ----- 2.85, 4.99 A
assign (resid 17 and name HG2*) (resid 17 and name HA) 2.30 0.50 0.50 ! 0.0000 278:2 Intra 2.35, 2.98 A
assign (resid 17 and name HG2*) (resid 17 and name HB) 2.30 0.50 0.50 ! 0.9924 279:2 Intra 2.43, 2.65 A
assign (resid 24 and name HG2*) (resid 24 and name HA) 2.30 0.50 0.50 ! 0.9952 280:2 Intra 2.37, 3.01 A
assign (resid 11 and name HB) (resid 31 and name HA) 2.65 0.85 0.85 ! 0.0000 281:2 Long 2.67, 3.21 A
assign (resid 7 and name HG2) (resid 7 and name HA) 2.65 0.85 0.85 ! 0.9426 282:2 Intra 3.00, 3.13 A
assign (resid 1 and name HG2*) (resid 20 and name HA) 2.65 0.85 0.85 ! 0.6622 283:2 Ambig 2.17, 3.39 A
or (resid 1 and name HG2*) (resid 1 and name HB) ! 0.3327 283:2 ----- 2.44, 2.65 A
assign (resid 30 and name HB2) (resid 30 and name HA) 2.65 0.85 0.85 ! 0.0000 284:2 Intra 2.83, 2.87 A
assign (resid 28 and name HD2*) (resid 28 and name HA) 2.65 0.85 0.85 ! 0.9971 285:2 Intra 2.14, 2.98 A
assign (resid 36 and name HD2*) (resid 36 and name HA) 2.30 0.50 0.50 ! 0.9894 286:2 Intra 2.07, 2.96 A
assign (resid 18 and name HG2*) (resid 18 and name HA) 2.30 0.50 0.50 ! 0.6442 287:2 Ambig 2.51, 3.13 A
or (resid 18 and name HG1*) (resid 1 and name HB) ! 0.1808 287:2 ----- 3.10, 5.26 A
assign (resid 24 and name HA) (resid 24 and name HB) 2.30 0.50 0.50 ! 0.9385 288:2 Intra 2.50, 2.54 A
assign (resid 3 and name HA) (resid 3 and name HB2) 2.65 0.85 0.85 ! 0.0000 289:2 Intra 2.44, 2.72 A
assign (resid 3 and name HA) (resid 3 and name HB1) 2.65 0.85 0.85 ! 0.6776 290:2 Ambig 2.30, 2.43 A
or (resid 3 and name HA) (resid 101 and name H2) ! 0.2825 290:2 ----- 2.66, 4.87 A
assign (resid 14 and name HA) (resid 14 and name HB2) 2.30 0.50 0.50 ! 0.9959 291:2 Intra 2.52, 2.56 A
assign (resid 14 and name HA) (resid 14 and name HB1) 2.30 0.50 0.50 ! 0.9523 292:2 Intra 2.27, 2.33 A
assign (resid 21 and name HA) (resid 21 and name HB*) 2.30 0.50 0.50 ! 0.0000 293:2 Intra 2.28, 2.68 A
assign (resid 101 and name H3) (resid 101 and name H5) 2.30 0.50 0.50 ! 0.5011 304:2 Ambig 2.42, 2.59 A
or (resid 3 and name HB1) (resid 101 and name H5) ! 0.3471 304:2 ----- 2.57, 4.05 A
assign (resid 27 and name HA) (resid 33 and name HB1) 2.30 0.50 0.50 ! 0.8077 306:2 Long 1.99, 2.15 A
assign (resid 30 and name HD2) (resid 30 and name HG1) 2.65 0.85 0.85 ! 0.9939 309:2 Intra 2.98, 2.99 A
assign (resid 16 and name HD2) (resid 15 and name HA2) 2.65 0.85 0.85 ! 0.0000 313:2 Seq 2.53, 2.80 A
assign (resid 35 and name HB1) (resid 19 and name HB1) 2.65 0.85 0.85 ! 0.0000 316:2 Long 2.17, 2.35 A
assign (resid 35 and name HB1) (resid 23 and name HB) 2.65 0.85 0.85 ! 0.0000 317:2 Long 1.92, 2.25 A
assign (resid 29 and name HB*) (resid 30 and name HD1) 2.30 0.50 0.50 ! 0.9962 318:2 Seq 2.47, 3.37 A
assign (resid 29 and name HB*) (resid 30 and name HD2) 2.30 0.50 0.50 ! 0.0000 319:2 Seq 2.32, 3.12 A
assign (resid 33 and name HB2) (resid 9 and name HA1) 2.65 0.85 0.85 ! 0.8501 320:2 Ambig 2.81, 2.82 A
or (resid 33 and name HB2) (resid 10 and name HA1) ! 0.0000 320:2 ----- 0.00, 0.00 A
assign (resid 2 and name HG1) (resid 6 and name HA1) 3.15 1.35 1.35 ! 0.0000 322:2 Mid 2.57, 2.95 A
assign (resid 34 and name HG*) (resid 5 and name HA) 2.65 0.85 0.85 ! 0.9737 323:2 Long 2.12, 3.79 A
assign (resid 30 and name HB1) (resid 30 and name HD1) 3.65 1.85 1.85 ! 0.8891 324:2 Intra 3.99, 4.03 A
assign (resid 30 and name HG2) (resid 30 and name HD1) 2.65 0.85 0.85 ! 0.7516 325:2 Ambig 2.67, 2.70 A
or (resid 16 and name HG1) (resid 1 and name HA) ! 0.2484 325:2 ----- 3.21, 4.42 A
assign (resid 30 and name HG2) (resid 30 and name HD2) 2.30 0.50 0.50 ! 0.5190 326:2 Ambig 2.28, 2.31 A
or (resid 16 and name HG1) (resid 16 and name HD1) ! 0.4810 326:2 ----- 2.30, 2.32 A
assign (resid 16 and name HG1) (resid 16 and name HD2) 2.65 0.85 0.85 ! 0.9860 328:2 Intra 2.66, 2.69 A
assign (resid 27 and name HB) (resid 27 and name HA) 2.65 0.85 0.85 ! 0.9099 329:2 Intra 3.04, 3.04 A
assign (resid 30 and name HG1) (resid 30 and name HD1) 2.30 0.50 0.50 ! 0.7070 330:2 Ambig 2.32, 2.34 A
or (resid 16 and name HB2) (resid 1 and name HA) ! 0.2930 330:2 ----- 2.68, 3.20 A
assign (resid 30 and name HG1) (resid 30 and name HD2) 2.65 0.85 0.85 ! 0.8189 331:2 Intra 2.98, 2.99 A
assign (resid 16 and name HG2) (resid 16 and name HD1) 2.65 0.85 0.85 ! 0.9838 332:2 Intra 2.98, 3.00 A
assign (resid 16 and name HG2) (resid 16 and name HD2) 2.30 0.50 0.50 ! 0.0000 333:2 Intra 2.31, 2.34 A
assign (resid 5 and name HB*) (resid 5 and name HA) 2.30 0.50 0.50 ! 0.9768 334:2 Intra 2.41, 2.64 A
assign (resid 11 and name HG11) (resid 11 and name HA) 2.65 0.85 0.85 ! 0.9413 335:2 Intra 2.97, 3.03 A
assign (resid 24 and name HG2*) (resid 24 and name HB) 2.30 0.50 0.50 ! 0.0000 336:2 Intra 2.42, 2.64 A
assign (resid 1 and name HG2*) (resid 1 and name HA) 2.65 0.85 0.85 ! 0.0000 337:2 Intra 2.38, 3.27 A
assign (resid 11 and name HB) (resid 11 and name HA) 2.65 0.85 0.85 ! 0.5646 338:2 Ambig 3.03, 3.04 A
or (resid 17 and name HG2*) (resid 9 and name HA1) ! 0.3790 338:2 ----- 3.24, 4.80 A
assign (resid 27 and name HG2*) (resid 27 and name HA) 2.30 0.50 0.50 ! 0.0000 339:2 Intra 2.52, 3.19 A
assign (resid 27 and name HG1*) (resid 27 and name HA) 2.30 0.50 0.50 ! 0.0000 340:2 Intra 2.47, 3.12 A
assign (resid 18 and name HG1*) (resid 1 and name HA) 2.30 0.50 0.50 ! 0.6891 341:2 Ambig 2.08, 3.59 A
or (resid 23 and name HG2*) (resid 23 and name HB) ! 0.2975 341:2 ----- 2.40, 2.64 A
assign (resid 11 and name HG2*) (resid 11 and name HA) 2.30 0.50 0.50 ! 0.8510 342:2 Intra 2.55, 3.17 A
assign (resid 11 and name HD1*) (resid 11 and name HA) 3.15 1.35 1.35 ! 0.9170 343:2 Intra 4.41, 4.66 A
assign (resid 25 and name HA) (resid 25 and name HB2) 2.30 0.50 0.50 ! 0.0000 344:2 Intra 2.46, 2.48 A
assign (resid 25 and name HA) (resid 25 and name HB1) 2.65 0.85 0.85 ! 0.7624 345:2 Ambig 3.01, 3.03 A
or (resid 25 and name HA) (resid 8 and name HB1) ! 0.2376 345:2 ----- 3.66, 4.11 A
assign (resid 13 and name HA) (resid 13 and name HB2) 2.30 0.50 0.50 ! 0.5104 346:2 Ambig 2.41, 2.53 A
or (resid 32 and name HA) (resid 32 and name HB*) ! 0.4667 346:2 ----- 2.45, 2.75 A
assign (resid 31 and name HA) (resid 31 and name HB1) 2.30 0.50 0.50 ! 0.0000 347:2 Intra 2.40, 2.46 A
assign (resid 4 and name HA) (resid 4 and name HB*) 2.30 0.50 0.50 ! 0.9967 348:2 Intra 2.44, 2.76 A
assign (resid 31 and name HA) (resid 31 and name HB2) 2.65 0.85 0.85 ! 0.9815 349:2 Intra 3.00, 3.02 A
assign (resid 9 and name HA2) (resid 33 and name HB2) 3.15 1.35 1.35 ! 0.0000 350:2 Long 3.73, 3.79 A
assign (resid 30 and name HD1) (resid 29 and name HB*) 2.30 0.50 0.50 ! 0.0000 351:2 Seq 2.47, 3.37 A
assign (resid 23 and name HB) (resid 35 and name HB1) 2.65 0.85 0.85 ! 0.0000 352:2 Long 1.92, 2.25 A
assign (resid 9 and name HA1) (resid 33 and name HB2) 2.65 0.85 0.85 ! 0.8501 353:2 Ambig 2.81, 2.82 A
or (resid 10 and name HA1) (resid 33 and name HB2) ! 0.0000 353:2 ----- 0.00, 0.00 A
assign (resid 8 and name HB2) (resid 25 and name HB2) 2.65 0.85 0.85 ! 0.0000 354:2 Long 2.80, 2.94 A
assign (resid 30 and name HD2) (resid 29 and name HB*) 2.30 0.50 0.50 ! 0.0000 355:2 Seq 2.32, 3.12 A
assign (resid 19 and name HB1) (resid 35 and name HB1) 2.65 0.85 0.85 ! 0.0000 356:2 Long 2.17, 2.35 A
assign (resid 2 and name HA) (resid 2 and name HG1) 3.15 1.35 1.35 ! 0.0000 368:2 Intra 2.42, 3.00 A
assign (resid 26 and name HA) (resid 26 and name HG1) 3.15 1.35 1.35 ! 0.0000 369:2 Intra 2.94, 3.16 A
assign (resid 16 and name HA) (resid 16 and name HB1) 2.30 0.50 0.50 ! 0.0000 370:2 Intra 2.26, 2.30 A
assign (resid 24 and name HA) (resid 19 and name HB2) 2.65 0.85 0.85 ! 0.9460 371:2 Long 2.97, 3.35 A
assign (resid 26 and name HA) (resid 26 and name HG2) 2.30 0.50 0.50 ! 0.5379 372:2 Ambig 2.44, 2.54 A
or (resid 32 and name HA) (resid 7 and name HG1) ! 0.4591 372:2 ----- 2.50, 2.90 A
assign (resid 36 and name HA) (resid 34 and name HG*) 3.15 1.35 1.35 ! 0.5641 373:2 Ambig 3.76, 5.41 A
or (resid 16 and name HA) (resid 16 and name HG1) ! 0.4106 373:2 ----- 3.96, 4.00 A
assign (resid 26 and name HA) (resid 26 and name HB1) 2.30 0.50 0.50 ! 0.9431 374:2 Intra 2.44, 2.47 A
assign (resid 7 and name HA) (resid 7 and name HG1) 2.30 0.50 0.50 ! 0.9601 375:2 Intra 2.49, 2.58 A
assign (resid 30 and name HA) (resid 30 and name HB1) 2.30 0.50 0.50 ! 0.9911 376:2 Intra 2.27, 2.30 A
assign (resid 30 and name HA) (resid 30 and name HG2) 3.15 1.35 1.35 ! 0.0000 378:2 Intra 4.08, 4.12 A
assign (resid 7 and name HA) (resid 7 and name HB2) 2.30 0.50 0.50 ! 0.9786 379:2 Intra 2.37, 2.46 A
assign (resid 5 and name HA) (resid 34 and name HG*) 2.65 0.85 0.85 ! 0.9834 380:2 Long 2.12, 3.79 A
assign (resid 30 and name HD1) (resid 30 and name HG2) 2.65 0.85 0.85 ! 0.0000 381:2 Intra 2.67, 2.70 A
assign (resid 6 and name HA1) (resid 2 and name HG1) 3.15 1.35 1.35 ! 0.0000 382:2 Mid 2.57, 2.95 A
assign (resid 16 and name HD2) (resid 16 and name HB1) 3.15 1.35 1.35 ! 0.0000 383:2 Intra 3.83, 3.88 A
assign (resid 30 and name HD2) (resid 30 and name HG2) 2.30 0.50 0.50 ! 0.5126 385:2 Ambig 2.28, 2.31 A
or (resid 16 and name HD1) (resid 16 and name HG1) ! 0.4751 385:2 ----- 2.30, 2.32 A
assign (resid 26 and name HG2) (resid 26 and name HB1) 2.30 0.50 0.50 ! 0.6356 389:2 Ambig 2.44, 2.52 A
or (resid 30 and name HB1) (resid 30 and name HG2) ! 0.3583 389:2 ----- 2.68, 2.75 A
assign (resid 2 and name HB2) (resid 2 and name HG1) 2.65 0.85 0.85 ! 0.0000 390:2 Intra 2.99, 3.01 A
assign (resid 2 and name HB2) (resid 2 and name HG2) 2.30 0.50 0.50 ! 0.9886 392:2 Intra 2.40, 2.43 A
assign (resid 26 and name HB2) (resid 26 and name HG2) 2.65 0.85 0.85 ! 0.9923 393:2 Intra 2.44, 2.96 A
assign (resid 7 and name HB1) (resid 7 and name HG1) 2.65 0.85 0.85 ! 0.0000 394:2 Intra 3.00, 3.01 A
assign (resid 11 and name HD1*) (resid 30 and name HB1) 3.15 1.35 1.35 ! 0.0000 399:2 Long 2.57, 3.57 A
assign (resid 25 and name HA) (resid 26 and name HB1) 4.15 2.35 2.35 ! 0.5519 400:2 Ambig 5.65, 5.69 A
or (resid 25 and name HA) (resid 2 and name HB2) ! 0.3563 400:2 ----- 6.07, 7.35 A
assign (resid 16 and name HA) (resid 16 and name HG2) 3.15 1.35 1.35 ! 0.6879 401:2 Ambig 3.82, 3.86 A
or (resid 16 and name HA) (resid 2 and name HB2) ! 0.1929 401:2 ----- 4.73, 5.88 A
assign (resid 2 and name HA) (resid 2 and name HB2) 2.65 0.85 0.85 ! 0.8299 402:2 Intra 2.47, 2.58 A
assign (resid 26 and name HA) (resid 26 and name HB2) 2.65 0.85 0.85 ! 0.9011 404:2 Intra 3.00, 3.01 A
assign (resid 16 and name HA) (resid 16 and name HB2) 2.65 0.85 0.85 ! 0.9775 405:2 Intra 2.74, 2.76 A
assign (resid 2 and name HA) (resid 2 and name HB1) 2.65 0.85 0.85 ! 0.6614 406:2 Ambig 2.52, 2.96 A
or (resid 28 and name HA) (resid 28 and name HB2) ! 0.2201 406:2 ----- 3.02, 3.04 A
assign (resid 2 and name HA) (resid 2 and name HB1) 2.65 0.85 0.85 ! 0.0000 407:2 Intra 2.52, 2.96 A
assign (resid 28 and name HA) (resid 28 and name HB1) 2.30 0.50 0.50 ! 0.8484 408:2 Intra 2.41, 2.47 A
assign (resid 36 and name HA) (resid 36 and name HB*) 2.30 0.50 0.50 ! 0.0000 409:2 Intra 2.46, 2.76 A
assign (resid 3 and name HA) (resid 20 and name HB*) 2.65 0.85 0.85 ! 0.0000 410:2 Long 2.86, 3.84 A
assign (resid 36 and name HA) (resid 36 and name HG) 2.65 0.85 0.85 ! 0.0000 411:2 Intra 3.04, 3.11 A
assign (resid 18 and name HA) (resid 18 and name HB) 2.30 0.50 0.50 ! 0.9910 412:2 Intra 2.42, 2.45 A
assign (resid 30 and name HA) (resid 30 and name HG1) 2.65 0.85 0.85 ! 0.9054 414:2 Intra 3.25, 3.45 A
assign (resid 7 and name HA) (resid 7 and name HB1) 2.65 0.85 0.85 ! 0.5323 415:2 Ambig 3.00, 3.02 A
or (resid 7 and name HA) (resid 34 and name HB*) ! 0.4629 415:2 ----- 3.07, 3.74 A
assign (resid 10 and name HA2) (resid 11 and name HG11) 3.15 1.35 1.35 ! 0.0000 417:2 Seq 3.83, 3.94 A
assign (resid 4 and name HA) (resid 5 and name HB*) 3.15 1.35 1.35 ! 0.4169 418:2 Ambig 4.63, 5.16 A
or (resid 4 and name HA) (resid 36 and name HG) ! 0.2262 418:2 ----- 5.13, 5.61 A
or (resid 4 and name HA) (resid 20 and name HB*) ! 0.2226 418:2 ----- 5.15, 7.01 A
assign (resid 20 and name HA) (resid 20 and name HB*) 2.30 0.50 0.50 ! 0.7261 421:2 Ambig 2.42, 2.64 A
or (resid 1 and name HB) (resid 20 and name HB*) ! 0.2739 421:2 ----- 2.85, 4.99 A
assign (resid 1 and name HA) (resid 16 and name HG2) 3.15 1.35 1.35 ! 0.7391 422:2 Ambig 3.39, 4.54 A
or (resid 1 and name HA) (resid 2 and name HB2) ! 0.1884 422:2 ----- 4.26, 4.43 A
assign (resid 27 and name HA) (resid 27 and name HB) 2.65 0.85 0.85 ! 0.9164 423:2 Intra 3.04, 3.04 A
assign (resid 30 and name HD1) (resid 30 and name HG1) 2.30 0.50 0.50 ! 0.9961 424:2 Intra 2.32, 2.34 A
assign (resid 11 and name HA) (resid 11 and name HG11) 2.65 0.85 0.85 ! 0.0000 425:2 Intra 2.97, 3.03 A
assign (resid 5 and name HA) (resid 5 and name HB*) 2.30 0.50 0.50 ! 0.9768 426:2 Intra 2.41, 2.64 A
assign (resid 16 and name HD1) (resid 16 and name HG2) 2.65 0.85 0.85 ! 0.9654 427:2 Intra 2.98, 3.00 A
assign (resid 15 and name HA1) (resid 16 and name HG2) 3.15 1.35 1.35 ! 0.9293 428:2 Seq 3.90, 4.11 A
assign (resid 16 and name HD2) (resid 16 and name HG2) 2.30 0.50 0.50 ! 0.9845 429:2 Intra 2.31, 2.34 A
assign (resid 16 and name HD2) (resid 16 and name HB2) 3.65 1.85 1.85 ! 0.0000 430:2 Intra 4.04, 4.07 A
assign (resid 2 and name HG1) (resid 2 and name HB2) 2.65 0.85 0.85 ! 0.9428 431:2 Intra 2.99, 3.01 A
assign (resid 2 and name HG1) (resid 2 and name HB1) 3.15 1.35 1.35 ! 0.0000 432:2 Intra 2.41, 2.44 A
assign (resid 16 and name HB1) (resid 16 and name HG2) 2.65 0.85 0.85 ! 0.8040 433:2 Intra 2.96, 2.99 A
assign (resid 2 and name HG2) (resid 2 and name HB2) 2.30 0.50 0.50 ! 0.9537 434:2 Intra 2.40, 2.43 A
assign (resid 30 and name HB1) (resid 30 and name HG1) 2.30 0.50 0.50 ! 0.6151 436:2 Ambig 2.26, 2.30 A
or (resid 26 and name HG2) (resid 26 and name HB2) ! 0.3820 436:2 ----- 2.44, 2.96 A
assign (resid 2 and name HG2) (resid 2 and name HB1) 2.65 0.85 0.85 ! 0.9987 438:2 Intra 2.30, 2.43 A
assign (resid 27 and name HG2*) (resid 27 and name HB) 2.30 0.50 0.50 ! 0.9937 440:2 Intra 2.42, 2.64 A
assign (resid 27 and name HG1*) (resid 27 and name HB) 2.30 0.50 0.50 ! 0.9681 441:2 Intra 2.41, 2.63 A
assign (resid 36 and name HD1*) (resid 36 and name HB*) 2.30 0.50 0.50 ! 0.5176 442:2 Ambig 2.39, 3.07 A
or (resid 36 and name HD2*) (resid 36 and name HB*) ! 0.4726 442:2 ----- 2.43, 3.48 A
assign (resid 36 and name HD2*) (resid 36 and name HG) 2.30 0.50 0.50 ! 0.5047 444:2 Ambig 2.41, 2.63 A
or (resid 36 and name HD1*) (resid 36 and name HG) ! 0.4953 444:2 ----- 2.42, 2.63 A
assign (resid 11 and name HD1*) (resid 11 and name HG11) 2.30 0.50 0.50 ! 0.0000 445:2 Intra 2.40, 2.63 A
assign (resid 31 and name HA) (resid 11 and name HB) 2.65 0.85 0.85 ! 0.0000 446:2 Long 2.67, 3.21 A
assign (resid 17 and name HB) (resid 17 and name HG2*) 2.30 0.50 0.50 ! 0.9924 447:2 Intra 2.43, 2.65 A
assign (resid 24 and name HA) (resid 24 and name HG2*) 2.30 0.50 0.50 ! 0.0000 448:2 Intra 2.37, 3.01 A
assign (resid 28 and name HA) (resid 28 and name HD1*) 3.15 1.35 1.35 ! 0.0000 449:2 Intra 4.34, 4.70 A
assign (resid 36 and name HA) (resid 23 and name HG2*) 2.65 0.85 0.85 ! 0.6861 450:2 Ambig 2.99, 4.43 A
or (resid 16 and name HA) (resid 18 and name HG1*) ! 0.3097 450:2 ----- 3.41, 4.77 A
assign (resid 26 and name HA) (resid 27 and name HG2*) 2.65 0.85 0.85 ! 0.8715 451:2 Seq 3.48, 4.63 A
assign (resid 28 and name HA) (resid 28 and name HD2*) 2.30 0.50 0.50 ! 0.9971 452:2 Intra 2.14, 2.98 A
assign (resid 36 and name HA) (resid 36 and name HD2*) 2.30 0.50 0.50 ! 0.9894 453:2 Intra 2.07, 2.96 A
assign (resid 31 and name HA) (resid 11 and name HB) 3.15 1.35 1.35 ! 0.0000 454:2 Long 2.67, 3.21 A
assign (resid 9 and name HA2) (resid 17 and name HG2*) 3.15 1.35 1.35 ! 0.0000 455:2 Long 1.94, 3.53 A
assign (resid 20 and name HA) (resid 1 and name HG2*) 2.30 0.50 0.50 ! 0.6656 457:2 Ambig 2.17, 3.39 A
or (resid 1 and name HB) (resid 1 and name HG2*) ! 0.3344 457:2 ----- 2.44, 2.65 A
assign (resid 30 and name HA) (resid 30 and name HB2) 2.65 0.85 0.85 ! 0.0000 461:2 Intra 2.83, 2.87 A
assign (resid 7 and name HA) (resid 7 and name HG2) 2.65 0.85 0.85 ! 0.0000 464:2 Intra 3.00, 3.13 A
assign (resid 18 and name HA) (resid 18 and name HG2*) 2.30 0.50 0.50 ! 0.9151 465:2 Intra 2.51, 3.13 A
assign (resid 4 and name HA) (resid 23 and name HG2*) 2.65 0.85 0.85 ! 0.9327 466:2 Long 2.33, 3.82 A
assign (resid 22 and name HA1) (resid 23 and name HG2*) 3.15 1.35 1.35 ! 0.0000 467:2 Seq 3.61, 4.77 A
assign (resid 12 and name HA1) (resid 11 and name HG2*) 3.15 1.35 1.35 ! 0.0000 468:2 Seq 3.59, 4.74 A
assign (resid 30 and name HA) (resid 27 and name HG1*) 3.15 1.35 1.35 ! 0.0000 469:2 Mid 2.26, 2.82 A
assign (resid 9 and name HA1) (resid 17 and name HG2*) 3.65 1.85 1.85 ! 0.9174 470:2 Long 3.24, 4.80 A
assign (resid 11 and name HA) (resid 11 and name HB) 2.65 0.85 0.85 ! 0.9798 471:2 Intra 3.03, 3.04 A
assign (resid 1 and name HA) (resid 1 and name HG2*) 2.65 0.85 0.85 ! 0.0000 472:2 Intra 2.38, 3.27 A
assign (resid 30 and name HD1) (resid 30 and name HB2) 3.15 1.35 1.35 ! 0.0000 473:2 Intra 3.88, 3.98 A
assign (resid 24 and name HB) (resid 24 and name HG2*) 2.30 0.50 0.50 ! 0.0000 474:2 Intra 2.42, 2.64 A
assign (resid 1 and name HA) (resid 18 and name HG1*) 2.30 0.50 0.50 ! 0.6891 475:2 Ambig 2.08, 3.59 A
or (resid 23 and name HB) (resid 23 and name HG2*) ! 0.2975 475:2 ----- 2.40, 2.64 A
assign (resid 11 and name HA) (resid 11 and name HG12) 2.30 0.50 0.50 ! 0.0000 476:2 Intra 2.52, 2.57 A
assign (resid 11 and name HA) (resid 11 and name HG2*) 2.30 0.50 0.50 ! 0.8263 477:2 Intra 2.55, 3.17 A
assign (resid 27 and name HA) (resid 27 and name HG2*) 2.30 0.50 0.50 ! 0.0000 478:2 Intra 2.52, 3.19 A
assign (resid 27 and name HA) (resid 27 and name HG1*) 2.30 0.50 0.50 ! 0.0000 479:2 Intra 2.47, 3.12 A
assign (resid 30 and name HG2) (resid 30 and name HB2) 2.30 0.50 0.50 ! 0.0000 481:2 Intra 2.29, 2.31 A
assign (resid 7 and name HB2) (resid 7 and name HG2) 2.65 0.85 0.85 ! 0.0000 483:2 Intra 3.00, 3.01 A
assign (resid 18 and name HB) (resid 18 and name HG1*) 2.30 0.50 0.50 ! 0.5133 484:2 Ambig 2.37, 2.62 A
or (resid 18 and name HB) (resid 18 and name HG2*) ! 0.4741 484:2 ----- 2.41, 2.64 A
assign (resid 26 and name HB1) (resid 28 and name HD2*) 2.65 0.85 0.85 ! 0.5882 485:2 Ambig 2.63, 3.82 A
or (resid 26 and name HB1) (resid 36 and name HD1*) ! 0.4078 485:2 ----- 2.80, 4.54 A
assign (resid 34 and name HG*) (resid 36 and name HD2*) 2.65 0.85 0.85 ! 0.6567 486:2 Ambig 2.38, 4.21 A
or (resid 34 and name HG*) (resid 36 and name HD1*) ! 0.2303 486:2 ----- 2.84, 4.27 A
assign (resid 28 and name HB1) (resid 28 and name HD1*) 2.30 0.50 0.50 ! 0.0000 487:2 Intra 2.39, 3.03 A
assign (resid 27 and name HB) (resid 27 and name HG2*) 2.30 0.50 0.50 ! 0.9959 488:2 Intra 2.42, 2.64 A
assign (resid 28 and name HB1) (resid 28 and name HD2*) 2.30 0.50 0.50 ! 0.9908 489:2 Intra 2.55, 3.17 A
assign (resid 27 and name HB) (resid 27 and name HG1*) 2.30 0.50 0.50 ! 0.9988 490:2 Intra 2.41, 2.63 A
assign (resid 36 and name HB*) (resid 36 and name HD1*) 2.30 0.50 0.50 ! 0.5176 492:2 Ambig 2.39, 3.07 A
or (resid 36 and name HB*) (resid 36 and name HD2*) ! 0.4726 492:2 ----- 2.43, 3.48 A
assign (resid 11 and name HD1*) (resid 11 and name HB) 2.30 0.50 0.50 ! 0.0000 494:2 Intra 2.53, 3.16 A
assign (resid 31 and name HA) (resid 11 and name HD1*) 3.65 1.85 1.85 ! 0.0000 495:2 Long 4.32, 5.53 A
assign (resid 30 and name HA) (resid 11 and name HD1*) 3.65 1.85 1.85 ! 0.0000 496:2 Long 4.10, 4.87 A
assign (resid 11 and name HA) (resid 11 and name HD1*) 3.15 1.35 1.35 ! 0.0000 497:2 Intra 4.41, 4.66 A
assign (resid 30 and name HB1) (resid 11 and name HD1*) 2.65 0.85 0.85 ! 0.0000 498:2 Long 2.57, 3.57 A
assign (resid 11 and name HG11) (resid 11 and name HD1*) 2.30 0.50 0.50 ! 0.0000 499:2 Intra 2.40, 2.63 A
assign (resid 8 and name HA) (resid 8 and name HB1) 2.30 0.50 0.50 ! 0.9880 500:2 Intra 2.36, 2.39 A
assign (resid 29 and name HN) (resid 28 and name HB2) 2.65 0.85 0.85 ! 0.6537 501:2 Ambig 1.84, 1.88 A
or (resid 28 and name HN) (resid 28 and name HB2) ! 0.1168 501:2 ----- 2.45, 2.55 A
or (resid 2 and name HN) (resid 16 and name HB2) ! 0.1141 501:2 ----- 2.46, 3.54 A
assign (resid 29 and name HN) (resid 28 and name HB1) 2.65 0.85 0.85 ! 0.8040 502:2 Seq 2.84, 3.02 A
assign (resid 7 and name HG1) (resid 33 and name HN) 3.15 1.35 1.35 ! 0.9994 503:2 Long 2.05, 2.23 A
assign (resid 11 and name HB) (resid 31 and name HE*) 3.65 1.85 1.85 ! 0.0000 504:2 Long 2.68, 4.24 A
assign (resid 28 and name HD2*) (resid 32 and name HD*) 3.65 1.85 1.85 ! 0.0000 505:2 Mid 5.56, 7.84 A
assign (resid 23 and name HG2*) (resid 4 and name HD2) 3.15 1.35 1.35 ! 0.0000 506:2 Long 2.17, 3.29 A
assign (resid 35 and name HB1) (resid 4 and name HA) 3.15 1.35 1.35 ! 0.9967 507:2 Long 2.91, 3.29 A
assign (resid 35 and name HB1) (resid 25 and name HA) 3.15 1.35 1.35 ! 0.5425 508:2 Ambig 3.90, 4.22 A
or (resid 35 and name HB1) (resid 36 and name HA) ! 0.2334 508:2 ----- 4.49, 4.63 A
or (resid 35 and name HB1) (resid 24 and name HA) ! 0.2241 508:2 ----- 4.52, 4.96 A
assign (resid 33 and name HB2) (resid 9 and name HA2) 3.15 1.35 1.35 ! 0.6655 509:2 Ambig 3.73, 3.79 A
or (resid 33 and name HB2) (resid 7 and name HA) ! 0.2609 509:2 ----- 4.36, 4.55 A
assign (resid 27 and name HG1*) (resid 33 and name HA) 3.65 1.85 1.85 ! 0.0000 511:2 Long 4.33, 5.19 A
assign (resid 27 and name HG1*) (resid 28 and name HA) 3.65 1.85 1.85 ! 0.0000 512:2 Seq 4.24, 5.39 A
assign (resid 27 and name HG1*) (resid 30 and name HA) 3.65 1.85 1.85 ! 0.0000 513:2 Mid 2.26, 2.82 A
assign (resid 11 and name HD1*) (resid 30 and name HA) 3.65 1.85 1.85 ! 0.0000 514:2 Long 4.10, 4.87 A
assign (resid 23 and name HG2*) (resid 36 and name HA) 3.15 1.35 1.35 ! 0.6702 515:2 Ambig 2.99, 4.43 A
or (resid 18 and name HG1*) (resid 16 and name HA) ! 0.3025 515:2 ----- 3.41, 4.77 A
assign (resid 23 and name HG2*) (resid 4 and name HA) 3.15 1.35 1.35 ! 0.9327 516:2 Long 2.33, 3.82 A
assign (resid 27 and name HG2*) (resid 26 and name HA) 3.15 1.35 1.35 ! 0.0000 518:2 Seq 3.48, 4.63 A
assign (resid 28 and name HD1*) (resid 28 and name HA) 3.15 1.35 1.35 ! 0.5569 519:2 Ambig 4.34, 4.70 A
or (resid 18 and name HG1*) (resid 17 and name HA) ! 0.3107 519:2 ----- 4.78, 6.04 A
assign (resid 27 and name HG2*) (resid 33 and name HA) 3.65 1.85 1.85 ! 0.0000 520:2 Long 4.55, 5.46 A
assign (resid 36 and name HD2*) (resid 5 and name HA) 3.15 1.35 1.35 ! 0.8048 521:2 Long 3.32, 4.36 A
assign (resid 11 and name HG12) (resid 11 and name HA) 2.30 0.50 0.50 ! 0.9928 522:2 Intra 2.52, 2.57 A
assign (resid 24 and name HG2*) (resid 23 and name HA) 3.65 1.85 1.85 ! 0.0000 523:2 Seq 3.64, 4.83 A
assign (resid 27 and name HG2*) (resid 10 and name HA2) 3.15 1.35 1.35 ! 0.0000 524:2 Long 4.02, 5.38 A
assign (resid 28 and name HD1*) (resid 32 and name HE*) 3.15 1.35 1.35 ! 0.0000 525:2 Mid 2.24, 5.39 A
assign (resid 1 and name HB) (resid 1 and name HA) 2.65 0.85 0.85 ! 0.9753 526:2 Intra 2.51, 2.84 A
assign (resid 26 and name HG1) (resid 26 and name HB1) 2.65 0.85 0.85 ! 0.0000 530:2 Intra 2.43, 2.95 A
assign (resid 2 and name HB1) (resid 2 and name HG1) 3.15 1.35 1.35 ! 0.0000 531:2 Intra 2.41, 2.44 A
assign (resid 2 and name HB1) (resid 2 and name HG2) 2.30 0.50 0.50 ! 0.9847 532:2 Intra 2.30, 2.43 A
assign (resid 7 and name HB2) (resid 7 and name HG1) 2.30 0.50 0.50 ! 0.6654 533:2 Ambig 2.39, 2.45 A
or (resid 30 and name HG2) (resid 30 and name HB1) ! 0.3346 533:2 ----- 2.68, 2.75 A
assign (resid 30 and name HB2) (resid 30 and name HG2) 2.65 0.85 0.85 ! 0.0000 536:2 Intra 2.29, 2.31 A
assign (resid 16 and name HG1) (resid 16 and name HB1) 2.30 0.50 0.50 ! 0.9909 537:2 Intra 2.31, 2.32 A
assign (resid 34 and name HG*) (resid 36 and name HG) 2.65 0.85 0.85 ! 0.0000 539:2 Mid 1.93, 2.86 A
assign (resid 7 and name HB1) (resid 7 and name HG2) 2.65 0.85 0.85 ! 0.9961 540:2 Intra 2.36, 2.44 A
assign (resid 34 and name HG*) (resid 34 and name HB*) 2.30 0.50 0.50 ! 0.0000 541:2 Intra 2.28, 2.71 A
assign (resid 18 and name HG1*) (resid 18 and name HB) 2.30 0.50 0.50 ! 0.5066 542:2 Ambig 2.37, 2.62 A
or (resid 18 and name HG2*) (resid 18 and name HB) ! 0.4678 542:2 ----- 2.41, 2.64 A
assign (resid 7 and name HG2) (resid 7 and name HB1) 2.30 0.50 0.50 ! 0.9961 543:2 Intra 2.36, 2.44 A
assign (resid 28 and name HD2*) (resid 28 and name HG) 2.30 0.50 0.50 ! 0.5458 544:2 Ambig 2.43, 2.64 A
or (resid 28 and name HD2*) (resid 28 and name HB1) ! 0.4118 544:2 ----- 2.55, 3.17 A
assign (resid 11 and name HG2*) (resid 11 and name HB) 2.30 0.50 0.50 ! 0.0000 545:2 Intra 2.42, 2.64 A
assign (resid 11 and name HD1*) (resid 11 and name HG2*) 2.30 0.50 0.50 ! 0.0000 546:2 Intra 2.00, 3.64 A
assign (resid 35 and name HB2) (resid 23 and name HB) 3.15 1.35 1.35 ! 0.0000 547:2 Long 3.15, 3.53 A
assign (resid 33 and name HB2) (resid 27 and name HA) 3.15 1.35 1.35 ! 0.7827 548:2 Ambig 3.32, 3.42 A
or (resid 35 and name HB2) (resid 5 and name HA) ! 0.1540 548:2 ----- 4.35, 4.78 A
assign (resid 35 and name HB2) (resid 4 and name HA) 3.15 1.35 1.35 ! 0.9958 549:2 Long 2.06, 2.36 A
assign (resid 26 and name HG1) (resid 26 and name HB2) 2.65 0.85 0.85 ! 0.9988 550:2 Intra 2.37, 2.42 A
assign (resid 26 and name HG1) (resid 26 and name HN) 3.65 1.85 1.85 ! 0.5973 551:2 Ambig 2.74, 2.97 A
or (resid 26 and name HG1) (resid 36 and name HN) ! 0.3913 551:2 ----- 2.94, 3.30 A
assign (resid 26 and name HG2) (resid 36 and name HN) 3.15 1.35 1.35 ! 0.5081 552:2 Ambig 2.65, 4.76 A
or (resid 26 and name HG2) (resid 26 and name HN) ! 0.4704 552:2 ----- 2.68, 3.76 A
assign (resid 34 and name HG*) (resid 34 and name HN) 3.65 1.85 1.85 ! 0.9322 553:2 Intra 2.39, 3.03 A
assign (resid 7 and name HB1) (resid 13 and name HE*) 3.15 1.35 1.35 ! 0.0000 554:2 Long 3.27, 4.58 A
assign (resid 30 and name HB2) (resid 31 and name HD*) 3.15 1.35 1.35 ! 0.0000 555:2 Seq 3.24, 4.53 A
assign (resid 17 and name HG2*) (resid 15 and name HN) 3.15 1.35 1.35 ! 0.6565 556:2 Ambig 3.88, 5.21 A
or (resid 17 and name HG2*) (resid 8 and name HA) ! 0.3435 556:2 ----- 4.32, 5.46 A
assign (resid 30 and name HG1) (resid 29 and name HA) 3.15 1.35 1.35 ! 0.9283 557:2 Seq 3.97, 4.03 A
assign (resid 11 and name HD1*) (resid 31 and name HA) 3.65 1.85 1.85 ! 0.0000 558:2 Long 4.32, 5.53 A
assign (resid 16 and name HB2) (resid 16 and name HD2) 3.15 1.35 1.35 ! 0.5739 559:2 Ambig 4.04, 4.07 A
or (resid 27 and name HB) (resid 33 and name HB1) ! 0.2834 559:2 ----- 4.54, 4.73 A
assign (resid 16 and name HB1) (resid 16 and name HD2) 3.15 1.35 1.35 ! 0.0000 560:2 Intra 3.83, 3.88 A
assign (resid 30 and name HG2) (resid 29 and name HB*) 3.15 1.35 1.35 ! 0.0000 561:2 Seq 4.50, 5.33 A
assign (resid 16 and name HG2) (resid 1 and name HA) 3.65 1.85 1.85 ! 0.9107 562:2 Long 3.39, 4.54 A
assign (resid 34 and name HG*) (resid 36 and name HA) 3.15 1.35 1.35 ! 0.5787 563:2 Ambig 3.76, 5.41 A
or (resid 16 and name HG1) (resid 16 and name HA) ! 0.4213 563:2 ----- 3.96, 4.00 A
assign (resid 16 and name HB1) (resid 16 and name HD1) 3.15 1.35 1.35 ! 0.0000 564:2 Intra 2.82, 2.93 A
assign (resid 2 and name HB1) (resid 35 and name HB2) 3.15 1.35 1.35 ! 0.5288 565:2 Ambig 3.40, 4.52 A
or (resid 28 and name HB2) (resid 32 and name HB*) ! 0.4564 565:2 ----- 3.48, 4.60 A
assign (resid 36 and name HD1*) (resid 26 and name HG1) 3.65 1.85 1.85 ! 0.9743 566:2 Long 2.24, 4.68 A
assign (resid 23 and name HG2*) (resid 4 and name HB*) 3.15 1.35 1.35 ! 0.0000 567:2 Long 1.98, 3.89 A
assign (resid 36 and name HG) (resid 36 and name HD2*) 2.30 0.50 0.50 ! 0.4895 568:2 Ambig 2.41, 2.63 A
or (resid 36 and name HG) (resid 36 and name HD1*) ! 0.4805 568:2 ----- 2.42, 2.63 A
assign (resid 11 and name HB) (resid 11 and name HG12) 2.65 0.85 0.85 ! 0.9765 569:2 Intra 3.03, 3.03 A
assign (resid 11 and name HB) (resid 11 and name HD1*) 2.65 0.85 0.85 ! 0.0000 570:2 Intra 2.53, 3.16 A
assign (resid 11 and name HG12) (resid 11 and name HD1*) 2.30 0.50 0.50 ! 0.0000 571:2 Intra 2.41, 2.62 A
assign (resid 18 and name HG1*) (resid 1 and name HG2*) 3.15 1.35 1.35 ! 0.6863 573:2 Ambig 2.04, 4.83 A
or (resid 18 and name HG2*) (resid 1 and name HG2*) ! 0.2492 573:2 ----- 2.41, 5.31 A
assign (resid 7 and name HG2) (resid 7 and name HB2) 2.65 0.85 0.85 ! 0.0000 574:2 Intra 3.00, 3.01 A
assign (resid 36 and name HG) (resid 36 and name HB*) 2.30 0.50 0.50 ! 0.0000 575:2 Intra 2.44, 2.75 A
assign (resid 28 and name HG) (resid 36 and name HG) 3.65 1.85 1.85 ! 0.0000 576:2 Long 4.78, 5.02 A
assign (resid 30 and name HG1) (resid 30 and name HB2) 3.15 1.35 1.35 ! 0.9963 577:2 Intra 2.94, 2.97 A
assign (resid 26 and name HG1) (resid 36 and name HB*) 3.15 1.35 1.35 ! 0.0000 578:2 Long 1.97, 3.65 A
assign (resid 4 and name HB*) (resid 23 and name HG2*) 3.15 1.35 1.35 ! 0.0000 579:2 Long 1.98, 3.89 A
assign (resid 33 and name HB1) (resid 27 and name HG2*) 3.15 1.35 1.35 ! 0.9942 580:2 Long 2.66, 3.74 A
assign (resid 35 and name HB1) (resid 23 and name HG2*) 3.15 1.35 1.35 ! 0.0000 581:2 Long 3.26, 4.24 A
assign (resid 29 and name HB*) (resid 28 and name HB2) 3.15 1.35 1.35 ! 0.6514 582:2 Ambig 3.85, 4.65 A
or (resid 29 and name HB*) (resid 30 and name HG1) ! 0.2065 582:2 ----- 4.66, 5.39 A
assign (resid 29 and name HB*) (resid 30 and name HG2) 3.15 1.35 1.35 ! 0.9597 583:2 Seq 4.50, 5.33 A
assign (resid 29 and name HB*) (resid 28 and name HB1) 3.65 1.85 1.85 ! 0.8077 584:2 Seq 4.55, 5.47 A
assign (resid 35 and name HB1) (resid 19 and name HB2) 3.15 1.35 1.35 ! 0.9329 585:2 Long 3.23, 3.62 A
assign (resid 19 and name HB1) (resid 23 and name HG2*) 3.15 1.35 1.35 ! 0.4678 586:2 Ambig 4.35, 5.08 A
or (resid 22 and name HA2) (resid 23 and name HG2*) ! 0.3009 586:2 ----- 4.69, 5.69 A
or (resid 19 and name HB1) (resid 18 and name HG2*) ! 0.1122 586:2 ----- 5.52, 6.44 A
assign (resid 12 and name HA2) (resid 11 and name HG2*) 3.15 1.35 1.35 ! 0.0000 587:2 Seq 3.78, 4.73 A
assign (resid 36 and name HA) (resid 4 and name HD2) 3.15 1.35 1.35 ! 0.0000 588:2 Long 2.02, 2.23 A
assign (resid 23 and name HB) (resid 24 and name HN) 3.15 1.35 1.35 ! 0.0000 589:2 Seq 2.52, 2.76 A
assign (resid 30 and name HD2) (resid 30 and name HB2) 2.65 0.85 0.85 ! 0.0000 590:2 Intra 2.87, 3.07 A
assign (resid 6 and name HA2) (resid 2 and name HG1) 3.15 1.35 1.35 ! 0.9174 591:2 Mid 4.25, 4.54 A
assign (resid 23 and name HB) (resid 35 and name HB2) 3.15 1.35 1.35 ! 0.0000 592:2 Long 3.15, 3.53 A
assign (resid 29 and name HA) (resid 27 and name HG1*) 3.15 1.35 1.35 ! 0.0000 593:2 Mid 3.92, 5.17 A
assign (resid 29 and name HA) (resid 29 and name HB*) 2.30 0.50 0.50 ! 0.0000 594:2 Intra 2.42, 2.74 A
assign (resid 29 and name HA) (resid 30 and name HD1) 2.30 0.50 0.50 ! 0.9483 595:2 Seq 2.03, 2.11 A
assign (resid 29 and name HA) (resid 29 and name HN) 2.65 0.85 0.85 ! 0.7751 596:2 Ambig 2.90, 2.91 A
or (resid 29 and name HA) (resid 31 and name HN) ! 0.1319 596:2 ----- 3.90, 4.15 A
assign (resid 33 and name HN) (resid 33 and name HA) 3.15 1.35 1.35 ! 0.9878 597:2 Intra 2.93, 2.93 A
assign (resid 13 and name HE*) (resid 16 and name HG1) 3.65 1.85 1.85 ! 0.5224 598:2 Ambig 4.83, 6.24 A
or (resid 13 and name HE*) (resid 7 and name HB2) ! 0.4776 598:2 ----- 4.90, 6.11 A
assign (resid 13 and name HD*) (resid 7 and name HG2) 3.65 1.85 1.85 ! 0.0000 599:2 Long 2.87, 3.88 A
assign (resid 16 and name HG2) (resid 15 and name HA2) 3.65 1.85 1.85 ! 0.0000 600:2 Seq 4.66, 4.91 A
assign (resid 11 and name HB) (resid 11 and name HG2*) 2.30 0.50 0.50 ! 0.0000 601:2 Intra 2.42, 2.64 A
assign (resid 11 and name HG2*) (resid 11 and name HD1*) 2.30 0.50 0.50 ! 0.0000 602:2 Intra 2.00, 3.64 A
assign (resid 101 and name H1) (resid 3 and name HB1) 2.30 0.50 0.50 ! 0.5814 603:2 Ambig 2.33, 2.69 A
or (resid 101 and name H1) (resid 101 and name H2) ! 0.3801 603:2 ----- 2.50, 2.70 A
assign (resid 23 and name HA) (resid 23 and name HB) 2.30 0.50 0.50 ! 0.0000 604:2 Intra 2.46, 2.50 A
assign (resid 29 and name HA) (resid 30 and name HD2) 2.65 0.85 0.85 ! 0.6515 605:2 Ambig 3.21, 3.32 A
or (resid 101 and name H1) (resid 101 and name H5) ! 0.3485 605:2 ----- 3.56, 3.65 A
or (resid 101 and name H1) (resid 101 and name H61) ! 0.0000 605:2 ----- 0.00, 0.00 A
or (resid 101 and name H1) (resid 101 and name H62) ! 0.0000 605:2 ----- 0.00, 0.00 A
assign (resid 101 and name H1) (resid 3 and name HB2) 2.65 0.85 0.85 ! 0.9968 606:2 Long 2.25, 2.80 A
assign (resid 23 and name HA) (resid 23 and name HG2*) 2.30 0.50 0.50 ! 0.0000 607:2 Intra 2.41, 3.06 A
assign (resid 30 and name HB2) (resid 30 and name HD2) 3.15 1.35 1.35 ! 0.0000 608:2 Intra 2.87, 3.07 A
assign (resid 31 and name HN) (resid 31 and name HB1) 3.15 1.35 1.35 ! 0.9566 609:2 Intra 3.65, 3.72 A
assign (resid 28 and name HN) (resid 33 and name HB1) 3.15 1.35 1.35 ! 0.5435 610:2 Ambig 3.31, 3.58 A
or (resid 27 and name HN) (resid 33 and name HB1) ! 0.3639 610:2 ----- 3.54, 3.68 A
assign (resid 31 and name HN) (resid 30 and name HD2) 3.65 1.85 1.85 ! 0.9984 611:2 Seq 2.19, 2.43 A
assign (resid 31 and name HN) (resid 31 and name HA) 3.65 1.85 1.85 ! 0.9460 612:2 Intra 2.90, 2.92 A
assign (resid 35 and name HN) (resid 7 and name HA) 3.65 1.85 1.85 ! 0.0000 613:2 Long 3.89, 4.32 A
assign (resid 35 and name HN) (resid 5 and name HA) 3.65 1.85 1.85 ! 0.8668 614:2 Long 3.42, 3.94 A
assign (resid 12 and name HN) (resid 12 and name HA1) 3.65 1.85 1.85 ! 0.9225 615:2 Intra 2.91, 2.93 A
assign (resid 12 and name HN) (resid 11 and name HA) 3.65 1.85 1.85 ! 0.9929 616:2 Seq 2.09, 2.12 A
assign (resid 24 and name HN) (resid 24 and name HA) 3.15 1.35 1.35 ! 0.8440 617:2 Intra 2.91, 2.93 A
assign (resid 31 and name HN) (resid 31 and name HD*) 3.15 1.35 1.35 ! 0.6833 618:2 Ambig 2.17, 3.75 A
or (resid 10 and name HN) (resid 7 and name HE21) ! 0.3142 618:2 ----- 2.47, 2.99 A
assign (resid 31 and name HN) (resid 32 and name HN) 2.30 0.50 0.50 ! 0.9711 619:2 Seq 1.91, 2.06 A
assign (resid 13 and name HN) (resid 7 and name HE22) 3.65 1.85 1.85 ! 0.4271 620:2 Ambig 4.39, 5.13 A
or (resid 32 and name HN) (resid 32 and name HD*) ! 0.2883 620:2 ----- 4.68, 4.89 A
or (resid 32 and name HN) (resid 7 and name HE22) ! 0.1477 620:2 ----- 5.24, 5.73 A
assign (resid 13 and name HN) (resid 11 and name HA) 3.65 1.85 1.85 ! 0.6445 621:2 Ambig 3.09, 3.24 A
or (resid 13 and name HN) (resid 10 and name HA1) ! 0.1375 621:2 ----- 4.00, 4.23 A
or (resid 32 and name HN) (resid 10 and name HA1) ! 0.1049 621:2 ----- 4.19, 4.32 A
assign (resid 8 and name HN) (resid 8 and name HB2) 3.65 1.85 1.85 ! 0.5534 622:2 Ambig 3.62, 3.68 A
or (resid 32 and name HN) (resid 31 and name HB1) ! 0.4077 622:2 ----- 3.81, 3.96 A
assign (resid 32 and name HN) (resid 29 and name HB*) 3.65 1.85 1.85 ! 0.9988 623:2 Mid 1.78, 2.56 A
assign (resid 32 and name HE*) (resid 7 and name HG2) 3.65 1.85 1.85 ! 0.0000 624:2 Long 4.73, 6.52 A
assign (resid 7 and name HE22) (resid 7 and name HG2) 3.65 1.85 1.85 ! 0.7861 625:2 Ambig 3.45, 3.65 A
or (resid 32 and name HD*) (resid 7 and name HG2) ! 0.2139 625:2 ----- 4.29, 6.18 A
assign (resid 31 and name HD*) (resid 30 and name HG2) 3.65 1.85 1.85 ! 0.0000 626:2 Seq 3.48, 5.50 A
assign (resid 31 and name HD*) (resid 30 and name HB1) 3.65 1.85 1.85 ! 0.0000 627:2 Seq 4.84, 6.09 A
assign (resid 31 and name HE*) (resid 30 and name HG2) 3.65 1.85 1.85 ! 0.5286 628:2 Ambig 3.37, 5.32 A
or (resid 34 and name HE22) (resid 34 and name HG*) ! 0.4645 628:2 ----- 3.45, 3.82 A
assign (resid 31 and name HE*) (resid 30 and name HB1) 3.65 1.85 1.85 ! 0.0000 629:2 Seq 5.05, 6.24 A
assign (resid 33 and name HN) (resid 7 and name HG1) 3.15 1.35 1.35 ! 0.9584 630:2 Long 2.05, 2.23 A
assign (resid 9 and name HN) (resid 7 and name HG2) 3.65 1.85 1.85 ! 0.0000 631:2 Mid 2.83, 3.19 A
assign (resid 33 and name HN) (resid 7 and name HG2) 3.65 1.85 1.85 ! 0.0000 632:2 Long 3.35, 3.64 A
assign (resid 31 and name HE*) (resid 11 and name HG11) 3.65 1.85 1.85 ! 0.7702 635:2 Ambig 5.03, 6.02 A
or (resid 34 and name HE22) (resid 36 and name HB*) ! 0.2298 635:2 ----- 6.15, 7.29 A
assign (resid 31 and name HD*) (resid 11 and name HG11) 3.65 1.85 1.85 ! 0.0000 636:2 Long 4.64, 5.60 A
assign (resid 13 and name HD*) (resid 7 and name HG1) 3.65 1.85 1.85 ! 0.8054 637:2 Long 4.55, 5.29 A
assign (resid 13 and name HE*) (resid 2 and name HG2) 3.65 1.85 1.85 ! 0.8086 638:2 Long 4.07, 5.43 A
assign (resid 13 and name HD*) (resid 7 and name HB1) 3.65 1.85 1.85 ! 0.0000 639:2 Long 3.61, 5.12 A
assign (resid 31 and name HE*) (resid 29 and name HB*) 4.15 2.35 2.35 ! 0.0000 640:2 Mid 5.23, 7.57 A
assign (resid 32 and name HD*) (resid 29 and name HB*) 3.65 1.85 1.85 ! 0.0000 641:2 Mid 3.96, 5.86 A
assign (resid 13 and name HE*) (resid 13 and name HB2) 3.65 1.85 1.85 ! 0.0000 643:2 Intra 4.73, 5.08 A
assign (resid 13 and name HE*) (resid 9 and name HA1) 3.65 1.85 1.85 ! 0.8340 644:2 Mid 5.38, 7.10 A
assign (resid 33 and name HN) (resid 33 and name HB1) 3.15 1.35 1.35 ! 0.0000 645:2 Intra 3.75, 3.78 A
assign (resid 13 and name HD*) (resid 15 and name HA1) 3.65 1.85 1.85 ! 0.8985 646:2 Mid 4.12, 4.74 A
assign (resid 31 and name HD*) (resid 10 and name HA1) 3.65 1.85 1.85 ! 0.6096 647:2 Ambig 4.44, 5.91 A
or (resid 31 and name HD*) (resid 11 and name HA) ! 0.3904 647:2 ----- 4.78, 6.41 A
assign (resid 31 and name HD*) (resid 30 and name HD1) 3.65 1.85 1.85 ! 0.0000 648:2 Seq 4.27, 6.28 A
assign (resid 31 and name HE*) (resid 30 and name HD2) 3.65 1.85 1.85 ! 0.9063 649:2 Seq 3.59, 5.45 A
assign (resid 33 and name HN) (resid 10 and name HA1) 3.65 1.85 1.85 ! 0.9596 650:2 Long 3.00, 3.43 A
assign (resid 13 and name HE*) (resid 15 and name HA2) 3.65 1.85 1.85 ! 0.0000 651:2 Mid 4.43, 5.13 A
assign (resid 33 and name HN) (resid 7 and name HA) 3.15 1.35 1.35 ! 0.6192 652:2 Ambig 3.26, 3.62 A
or (resid 33 and name HN) (resid 10 and name HA2) ! 0.3808 652:2 ----- 3.54, 3.77 A
assign (resid 31 and name HE*) (resid 31 and name HA) 3.65 1.85 1.85 ! 0.7888 653:2 Ambig 4.69, 5.30 A
or (resid 34 and name HE22) (resid 4 and name HA) ! 0.2112 653:2 ----- 5.84, 7.03 A
assign (resid 31 and name HD*) (resid 30 and name HA) 3.65 1.85 1.85 ! 0.0000 654:2 Seq 4.98, 5.98 A
assign (resid 31 and name HD*) (resid 12 and name HA1) 3.65 1.85 1.85 ! 0.9068 655:2 Long 3.53, 6.12 A
assign (resid 9 and name HN) (resid 9 and name HA2) 3.65 1.85 1.85 ! 0.9966 656:2 Intra 2.90, 2.93 A
assign (resid 32 and name HE*) (resid 32 and name HA) 3.65 1.85 1.85 ! 0.0000 657:2 Intra 4.63, 5.26 A
assign (resid 32 and name HE*) (resid 34 and name HA) 3.65 1.85 1.85 ! 0.0000 658:2 Mid 4.46, 5.36 A
assign (resid 13 and name HD*) (resid 15 and name HN) 3.65 1.85 1.85 ! 0.7004 659:2 Ambig 3.20, 3.76 A
or (resid 13 and name HD*) (resid 8 and name HA) ! 0.2996 659:2 ----- 3.68, 5.05 A
assign (resid 32 and name HD*) (resid 33 and name HA) 3.65 1.85 1.85 ! 0.9639 660:2 Seq 3.74, 5.07 A
assign (resid 31 and name HE*) (resid 30 and name HD1) 4.15 2.35 2.35 ! 0.0000 661:2 Seq 5.15, 7.04 A
assign (resid 13 and name HD*) (resid 14 and name HA) 3.65 1.85 1.85 ! 0.7799 662:2 Ambig 4.53, 5.57 A
or (resid 13 and name HD*) (resid 16 and name HA) ! 0.2201 662:2 ----- 5.59, 7.34 A
assign (resid 31 and name HD*) (resid 31 and name HN) 3.15 1.35 1.35 ! 0.0000 663:2 Intra 2.17, 3.75 A
assign (resid 32 and name HD*) (resid 29 and name HN) 3.65 1.85 1.85 ! 0.6344 664:2 Ambig 3.35, 5.06 A
or (resid 7 and name HE22) (resid 10 and name HN) ! 0.1791 664:2 ----- 4.13, 4.35 A
assign (resid 35 and name HA) (resid 26 and name HG2) 3.15 1.35 1.35 ! 0.5942 666:2 Ambig 3.90, 5.79 A
or (resid 35 and name HA) (resid 19 and name HB2) ! 0.3507 666:2 ----- 4.26, 4.57 A
assign (resid 35 and name HA) (resid 34 and name HG*) 3.15 1.35 1.35 ! 0.0000 667:2 Seq 4.09, 5.03 A
assign (resid 8 and name HA) (resid 7 and name HG2) 3.65 1.85 1.85 ! 0.9231 668:2 Seq 3.95, 4.13 A
assign (resid 10 and name HA2) (resid 13 and name HB2) 3.65 1.85 1.85 ! 0.0000 670:2 Mid 4.53, 4.60 A
assign (resid 10 and name HA2) (resid 13 and name HB1) 3.65 1.85 1.85 ! 0.7054 671:2 Ambig 4.72, 4.81 A
or (resid 10 and name HA2) (resid 31 and name HB2) ! 0.2946 671:2 ----- 5.46, 5.62 A
assign (resid 10 and name HA2) (resid 32 and name HN) 3.65 1.85 1.85 ! 0.6724 672:2 Ambig 4.18, 4.32 A
or (resid 10 and name HA2) (resid 13 and name HN) ! 0.2519 672:2 ----- 4.93, 5.08 A
assign (resid 7 and name HA) (resid 35 and name HN) 3.65 1.85 1.85 ! 0.0000 673:2 Long 3.89, 4.32 A
assign (resid 7 and name HA) (resid 8 and name HN) 3.15 1.35 1.35 ! 0.9995 674:2 Seq 2.02, 2.09 A
assign (resid 30 and name HA) (resid 32 and name HN) 3.65 1.85 1.85 ! 0.0000 675:2 Mid 4.17, 4.39 A
assign (resid 30 and name HA) (resid 31 and name HN) 3.65 1.85 1.85 ! 0.8550 676:2 Seq 3.26, 3.38 A
assign (resid 30 and name HD1) (resid 31 and name HN) 3.65 1.85 1.85 ! 0.8209 679:2 Seq 3.55, 3.66 A
assign (resid 33 and name HB1) (resid 28 and name HN) 3.15 1.35 1.35 ! 0.5354 680:2 Ambig 3.31, 3.58 A
or (resid 33 and name HB1) (resid 27 and name HN) ! 0.3585 680:2 ----- 3.54, 3.68 A
assign (resid 30 and name HD2) (resid 31 and name HD*) 3.15 1.35 1.35 ! 0.0000 681:2 Seq 2.50, 4.59 A
assign (resid 33 and name HB1) (resid 33 and name HN) 3.65 1.85 1.85 ! 0.0000 682:2 Intra 3.75, 3.78 A
assign (resid 6 and name HA2) (resid 2 and name HG2) 3.65 1.85 1.85 ! 0.8824 683:2 Mid 4.17, 4.83 A
assign (resid 30 and name HD1) (resid 30 and name HB1) 3.65 1.85 1.85 ! 0.0000 684:2 Intra 3.99, 4.03 A
assign (resid 8 and name HB2) (resid 17 and name HG2*) 3.65 1.85 1.85 ! 0.0000 685:2 Long 4.51, 5.73 A
assign (resid 33 and name HB1) (resid 27 and name HG1*) 3.65 1.85 1.85 ! 0.0000 686:2 Long 3.82, 4.82 A
assign (resid 29 and name HB*) (resid 27 and name HG1*) 3.65 1.85 1.85 ! 0.0000 687:2 Mid 5.62, 6.38 A
assign (resid 25 and name HB2) (resid 18 and name HG2*) 3.65 1.85 1.85 ! 0.4156 688:2 Ambig 5.26, 6.90 A
or (resid 29 and name HB*) (resid 28 and name HD1*) ! 0.2891 688:2 ----- 5.58, 7.31 A
or (resid 25 and name HB2) (resid 27 and name HG2*) ! 0.1741 688:2 ----- 6.08, 7.16 A
assign (resid 29 and name HB*) (resid 30 and name HB2) 3.65 1.85 1.85 ! 0.0000 689:2 Seq 4.84, 5.60 A
assign (resid 4 and name HB*) (resid 5 and name HB*) 3.65 1.85 1.85 ! 0.5143 690:2 Ambig 4.36, 5.61 A
or (resid 4 and name HB*) (resid 20 and name HB*) ! 0.4857 690:2 ----- 4.40, 7.07 A
assign (resid 31 and name HB1) (resid 11 and name HB) 3.65 1.85 1.85 ! 0.0000 691:2 Long 4.00, 4.61 A
assign (resid 24 and name HB) (resid 26 and name HG2) 3.65 1.85 1.85 ! 0.8156 692:2 Mid 3.57, 3.88 A
assign (resid 24 and name HB) (resid 26 and name HG1) 3.65 1.85 1.85 ! 0.9884 693:2 Mid 3.26, 3.79 A
assign (resid 13 and name HB1) (resid 13 and name HE*) 3.65 1.85 1.85 ! 0.5356 694:2 Ambig 4.56, 5.03 A
or (resid 8 and name HB1) (resid 13 and name HE*) ! 0.4644 694:2 ----- 4.67, 6.33 A
assign (resid 32 and name HB*) (resid 32 and name HE*) 3.65 1.85 1.85 ! 0.9213 695:2 Intra 4.61, 5.05 A
assign (resid 13 and name HB2) (resid 13 and name HE*) 3.65 1.85 1.85 ! 0.0000 697:2 Intra 4.73, 5.08 A
assign (resid 31 and name HB1) (resid 32 and name HN) 3.65 1.85 1.85 ! 0.9128 699:2 Seq 3.81, 3.96 A
assign (resid 29 and name HB*) (resid 32 and name HN) 3.65 1.85 1.85 ! 0.9988 700:2 Mid 1.78, 2.56 A
assign (resid 31 and name HB1) (resid 31 and name HN) 3.65 1.85 1.85 ! 0.9421 701:2 Intra 3.65, 3.72 A
assign (resid 25 and name HB2) (resid 26 and name HN) 3.65 1.85 1.85 ! 0.7457 702:2 Ambig 4.31, 4.41 A
or (resid 25 and name HB2) (resid 36 and name HN) ! 0.1773 702:2 ----- 5.48, 5.70 A
assign (resid 7 and name HB2) (resid 13 and name HE*) 4.15 2.35 2.35 ! 0.0000 703:2 Long 4.90, 6.11 A
assign (resid 7 and name HB2) (resid 32 and name HD*) 3.65 1.85 1.85 ! 0.9264 704:2 Long 2.58, 4.67 A
assign (resid 35 and name HB2) (resid 23 and name HG2*) 3.65 1.85 1.85 ! 0.4897 705:2 Ambig 3.38, 4.89 A
or (resid 33 and name HB2) (resid 27 and name HG2*) ! 0.3625 705:2 ----- 3.55, 4.74 A
assign (resid 7 and name HG1) (resid 7 and name HB1) 2.65 0.85 0.85 ! 0.8482 706:2 Intra 3.00, 3.01 A
assign (resid 30 and name HG1) (resid 29 and name HB*) 3.65 1.85 1.85 ! 0.0000 708:2 Seq 4.66, 5.39 A
assign (resid 19 and name HB2) (resid 35 and name HB1) 3.15 1.35 1.35 ! 0.0000 709:2 Long 3.23, 3.62 A
assign (resid 28 and name HB2) (resid 33 and name HA) 3.65 1.85 1.85 ! 0.5938 710:2 Ambig 3.22, 3.52 A
or (resid 2 and name HB1) (resid 8 and name HA) ! 0.4062 710:2 ----- 3.44, 3.91 A
assign (resid 7 and name HG2) (resid 13 and name HE*) 3.65 1.85 1.85 ! 0.0000 711:2 Long 3.70, 4.38 A
assign (resid 30 and name HB2) (resid 31 and name HE*) 3.65 1.85 1.85 ! 0.0000 712:2 Seq 3.49, 4.66 A
assign (resid 7 and name HG2) (resid 13 and name HD*) 3.65 1.85 1.85 ! 0.7046 713:2 Ambig 2.87, 3.88 A
or (resid 7 and name HG2) (resid 7 and name HE22) ! 0.2322 713:2 ----- 3.45, 3.65 A
assign (resid 30 and name HB2) (resid 30 and name HD1) 3.15 1.35 1.35 ! 0.0000 714:2 Intra 3.88, 3.98 A
assign (resid 36 and name HB*) (resid 26 and name HG1) 3.15 1.35 1.35 ! 0.0000 715:2 Long 1.97, 3.65 A
assign (resid 27 and name HG2*) (resid 33 and name HB1) 3.65 1.85 1.85 ! 0.0000 716:2 Long 2.66, 3.74 A
assign (resid 27 and name HG1*) (resid 29 and name HB*) 3.65 1.85 1.85 ! 0.0000 717:2 Mid 5.62, 6.38 A
assign (resid 27 and name HG1*) (resid 33 and name HB1) 3.65 1.85 1.85 ! 0.0000 718:2 Long 3.82, 4.82 A
assign (resid 36 and name HD2*) (resid 23 and name HB) 3.65 1.85 1.85 ! 0.8757 720:2 Long 5.25, 6.42 A
assign (resid 36 and name HD2*) (resid 35 and name HA) 3.65 1.85 1.85 ! 0.7028 721:2 Ambig 4.91, 5.94 A
or (resid 36 and name HD1*) (resid 35 and name HA) ! 0.2972 721:2 ----- 5.67, 6.37 A
assign (resid 28 and name HD1*) (resid 33 and name HA) 3.65 1.85 1.85 ! 0.9615 722:2 Long 3.99, 4.98 A
assign (resid 28 and name HD2*) (resid 33 and name HA) 3.65 1.85 1.85 ! 0.8953 723:2 Long 4.46, 5.31 A
assign (resid 36 and name HD2*) (resid 4 and name HD2) 3.65 1.85 1.85 ! 0.9938 725:2 Long 2.47, 4.14 A
assign (resid 27 and name HG1*) (resid 32 and name HN) 3.65 1.85 1.85 ! 0.0000 726:2 Long 5.01, 5.91 A
assign (resid 10 and name HN) (resid 33 and name HB2) 3.15 1.35 1.35 ! 0.7889 727:2 Ambig 2.92, 3.12 A
or (resid 28 and name HN) (resid 33 and name HB2) ! 0.0649 727:2 ----- 4.42, 4.62 A
assign (resid 31 and name HN) (resid 29 and name HB*) 3.65 1.85 1.85 ! 0.8566 728:2 Mid 2.40, 2.93 A
assign (resid 11 and name HN) (resid 31 and name HA) 3.65 1.85 1.85 ! 0.0000 729:2 Long 1.79, 2.04 A
assign (resid 11 and name HN) (resid 10 and name HA1) 3.65 1.85 1.85 ! 0.5112 730:2 Ambig 2.78, 2.90 A
or (resid 11 and name HN) (resid 11 and name HA) ! 0.4813 730:2 ----- 2.81, 2.83 A
assign (resid 11 and name HN) (resid 11 and name HG11) 3.65 1.85 1.85 ! 0.0000 731:2 Intra 2.09, 2.18 A
assign (resid 11 and name HN) (resid 11 and name HB) 3.65 1.85 1.85 ! 0.9925 732:2 Intra 2.43, 2.50 A
assign (resid 21 and name HN) (resid 20 and name HA) 3.65 1.85 1.85 ! 0.9829 733:2 Seq 2.10, 2.28 A
assign (resid 1 and name HA) (resid 1 and name HB) 2.65 0.85 0.85 ! 0.9643 734:2 Intra 2.51, 2.84 A
assign (resid 23 and name HB) (resid 36 and name HA) 2.65 0.85 0.85 ! 0.6771 735:2 Ambig 3.36, 3.68 A
or (resid 1 and name HA) (resid 16 and name HA) ! 0.1763 735:2 ----- 4.20, 5.48 A
assign (resid 23 and name HB) (resid 35 and name HA) 3.15 1.35 1.35 ! 0.0000 736:2 Long 3.31, 3.59 A
assign (resid 3 and name HB2) (resid 101 and name H1) 2.65 0.85 0.85 ! 0.9956 737:2 Long 2.25, 2.80 A
assign (resid 10 and name HA2) (resid 32 and name HA) 3.65 1.85 1.85 ! 0.9547 739:2 Long 3.99, 4.15 A
assign (resid 33 and name HA) (resid 28 and name HD2*) 3.15 1.35 1.35 ! 0.4964 740:2 Ambig 4.46, 5.31 A
or (resid 33 and name HA) (resid 27 and name HG2*) ! 0.4456 740:2 ----- 4.55, 5.46 A
assign (resid 17 and name HG2*) (resid 9 and name HA2) 3.65 1.85 1.85 ! 0.0000 741:2 Long 1.94, 3.53 A
assign (resid 13 and name HB1) (resid 10 and name HA1) 3.15 1.35 1.35 ! 0.4326 742:2 Ambig 3.75, 3.97 A
or (resid 13 and name HB1) (resid 9 and name HA1) ! 0.1577 742:2 ----- 4.44, 4.79 A
or (resid 13 and name HB1) (resid 11 and name HA) ! 0.1338 742:2 ----- 4.56, 4.86 A
or (resid 25 and name HB1) (resid 9 and name HA1) ! 0.1226 742:2 ----- 4.63, 4.86 A
assign (resid 13 and name HB1) (resid 9 and name HA2) 3.15 1.35 1.35 ! 0.9067 743:2 Mid 2.81, 3.20 A
assign (resid 33 and name HB1) (resid 9 and name HA1) 3.15 1.35 1.35 ! 0.9139 744:2 Ambig 3.51, 3.52 A
or (resid 33 and name HB1) (resid 10 and name HA1) ! 0.0000 744:2 ----- 0.00, 0.00 A
assign (resid 31 and name HA) (resid 10 and name HA1) 2.65 0.85 0.85 ! 0.9064 745:2 Long 2.49, 2.78 A
assign (resid 32 and name HA) (resid 10 and name HA1) 2.65 0.85 0.85 ! 0.6297 746:2 Ambig 3.08, 3.37 A
or (resid 17 and name HB) (resid 9 and name HA1) ! 0.3091 746:2 ----- 3.47, 4.38 A
assign (resid 32 and name HD*) (resid 7 and name HA) 3.65 1.85 1.85 ! 0.8207 747:2 Long 4.18, 5.30 A
assign (resid 4 and name HD2) (resid 23 and name HB) 3.65 1.85 1.85 ! 0.0000 748:2 Long 3.12, 3.76 A
assign (resid 32 and name HA) (resid 10 and name HA2) 3.15 1.35 1.35 ! 0.5184 749:2 Ambig 3.99, 4.15 A
or (resid 13 and name HA) (resid 12 and name HA1) ! 0.4570 749:2 ----- 4.07, 4.19 A
assign (resid 13 and name HB2) (resid 10 and name HA2) 3.65 1.85 1.85 ! 0.5613 750:2 Ambig 4.53, 4.60 A
or (resid 13 and name HB2) (resid 12 and name HA1) ! 0.4387 750:2 ----- 4.72, 4.93 A
assign (resid 20 and name HB*) (resid 101 and name H2) 4.15 2.35 2.35 ! 0.5858 752:2 Ambig 3.28, 7.18 A
or (resid 20 and name HB*) (resid 101 and name H62) ! 0.2335 752:2 ----- 3.82, 7.99 A
assign (resid 10 and name HA2) (resid 11 and name HD1*) 3.65 1.85 1.85 ! 0.0000 753:2 Seq 5.80, 6.37 A
assign (resid 9 and name HA1) (resid 33 and name HB1) 3.15 1.35 1.35 ! 0.9139 754:2 Ambig 3.51, 3.52 A
or (resid 10 and name HA1) (resid 33 and name HB1) ! 0.0000 754:2 ----- 0.00, 0.00 A
assign (resid 27 and name HA) (resid 10 and name HA2) 3.65 1.85 1.85 ! 0.0000 756:2 Long 4.63, 4.67 A
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