NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | program | type | subtype | subsubtype |
|
|
406480 |
1xna   |
4282 | cing | recoord | 4-filtered-FRED | Wattos | check | violation | distance |
data_1xna
save_distance_constraint_statistics_1
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 1
_Distance_constraint_stats_list.Constraint_count 2203
_Distance_constraint_stats_list.Viol_count 225
_Distance_constraint_stats_list.Viol_total 14.600
_Distance_constraint_stats_list.Viol_max 0.354
_Distance_constraint_stats_list.Viol_rms 0.0277
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0066
_Distance_constraint_stats_list.Viol_average_violations_only 0.0649
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 3 GLU 0.030 0.030 1 0 "[ ]"
1 4 ILE 0.000 0.000 . 0 "[ ]"
1 5 ARG 0.000 0.000 . 0 "[ ]"
1 6 LEU 0.035 0.035 1 0 "[ ]"
1 7 ARG 0.082 0.075 1 0 "[ ]"
1 8 HIS 0.093 0.075 1 0 "[ ]"
1 9 VAL 0.024 0.024 1 0 "[ ]"
1 10 VAL 0.000 0.000 . 0 "[ ]"
1 11 SER 0.133 0.091 1 0 "[ ]"
1 12 CYS 0.000 0.000 . 0 "[ ]"
1 13 SER 0.331 0.124 1 0 "[ ]"
1 14 SER 0.031 0.031 1 0 "[ ]"
1 15 GLN 0.259 0.140 1 0 "[ ]"
1 16 ASP 0.039 0.024 1 0 "[ ]"
1 17 SER 0.053 0.043 1 0 "[ ]"
1 18 THR 0.060 0.057 1 0 "[ ]"
1 19 HIS 0.002 0.002 1 0 "[ ]"
1 20 CYS 0.200 0.054 1 0 "[ ]"
1 21 ALA 0.047 0.024 1 0 "[ ]"
1 22 GLU 0.068 0.048 1 0 "[ ]"
1 23 ASN 0.245 0.074 1 0 "[ ]"
1 24 LEU 0.176 0.124 1 0 "[ ]"
1 25 LEU 0.188 0.140 1 0 "[ ]"
1 26 LYS 0.220 0.124 1 0 "[ ]"
1 27 ALA 0.075 0.050 1 0 "[ ]"
1 28 ASP 0.000 0.000 . 0 "[ ]"
1 29 THR 0.081 0.052 1 0 "[ ]"
1 30 TYR 0.052 0.052 1 0 "[ ]"
1 31 ARG 0.000 0.000 . 0 "[ ]"
1 32 LYS 0.024 0.017 1 0 "[ ]"
1 33 TRP 0.431 0.194 1 0 "[ ]"
1 34 ARG 0.079 0.060 1 0 "[ ]"
1 35 ALA 0.174 0.140 1 0 "[ ]"
1 36 ALA 0.056 0.032 1 0 "[ ]"
1 37 LYS 0.238 0.142 1 0 "[ ]"
1 38 ALA 0.265 0.142 1 0 "[ ]"
1 39 GLY 0.000 0.000 . 0 "[ ]"
1 40 GLU 0.427 0.224 1 0 "[ ]"
1 41 LYS 0.304 0.224 1 0 "[ ]"
1 42 THR 0.000 0.000 . 0 "[ ]"
1 43 ILE 0.106 0.105 1 0 "[ ]"
1 44 SER 0.410 0.124 1 0 "[ ]"
1 45 VAL 0.104 0.057 1 0 "[ ]"
1 46 VAL 0.133 0.091 1 0 "[ ]"
1 47 LEU 0.063 0.035 1 0 "[ ]"
1 48 GLN 0.021 0.021 1 0 "[ ]"
1 49 LEU 0.556 0.281 1 0 "[ ]"
1 50 GLU 0.107 0.100 1 0 "[ ]"
1 51 LYS 0.456 0.281 1 0 "[ ]"
1 52 GLU 0.325 0.153 1 0 "[ ]"
1 53 GLU 0.361 0.153 1 0 "[ ]"
1 54 GLN 0.309 0.122 1 0 "[ ]"
1 55 ILE 0.050 0.032 1 0 "[ ]"
1 56 HIS 0.000 0.000 . 0 "[ ]"
1 57 SER 0.462 0.151 1 0 "[ ]"
1 58 VAL 0.255 0.082 1 0 "[ ]"
1 59 ASP 0.211 0.100 1 0 "[ ]"
1 60 ILE 0.657 0.137 1 0 "[ ]"
1 61 GLY 0.539 0.200 1 0 "[ ]"
1 62 ASN 0.364 0.200 1 0 "[ ]"
1 63 ASP 0.105 0.093 1 0 "[ ]"
1 64 GLY 0.012 0.012 1 0 "[ ]"
1 65 SER 0.191 0.151 1 0 "[ ]"
1 66 ALA 0.000 0.000 . 0 "[ ]"
1 67 PHE 0.355 0.151 1 0 "[ ]"
1 68 VAL 0.094 0.080 1 0 "[ ]"
1 69 GLU 0.009 0.009 1 0 "[ ]"
1 70 VAL 0.180 0.068 1 0 "[ ]"
1 71 LEU 0.034 0.029 1 0 "[ ]"
1 72 VAL 0.426 0.147 1 0 "[ ]"
1 73 GLY 0.353 0.170 1 0 "[ ]"
1 74 SER 0.690 0.170 1 0 "[ ]"
1 75 SER 0.520 0.227 1 0 "[ ]"
1 76 ALA 0.572 0.227 1 0 "[ ]"
1 77 GLY 0.000 0.000 . 0 "[ ]"
1 78 GLY 0.000 0.000 . 0 "[ ]"
1 79 ALA 0.000 0.000 . 0 "[ ]"
1 80 GLY 0.000 0.000 . 0 "[ ]"
1 81 GLU 0.000 0.000 . 0 "[ ]"
1 82 GLN 0.000 0.000 . 0 "[ ]"
1 83 ASP 0.000 0.000 . 0 "[ ]"
1 84 TYR 0.235 0.207 1 0 "[ ]"
1 85 GLU 0.308 0.207 1 0 "[ ]"
1 86 VAL 0.031 0.031 1 0 "[ ]"
1 87 LEU 0.240 0.114 1 0 "[ ]"
1 88 LEU 0.180 0.068 1 0 "[ ]"
1 89 VAL 0.000 0.000 . 0 "[ ]"
1 90 THR 0.056 0.056 1 0 "[ ]"
1 91 SER 0.319 0.154 1 0 "[ ]"
1 92 SER 0.215 0.154 1 0 "[ ]"
1 93 PHE 0.321 0.119 1 0 "[ ]"
1 94 MET 0.048 0.048 1 0 "[ ]"
1 95 SER 0.000 0.000 . 0 "[ ]"
1 96 PRO 0.038 0.036 1 0 "[ ]"
1 97 SER 0.000 0.000 . 0 "[ ]"
1 98 GLU 0.039 0.039 1 0 "[ ]"
1 99 SER 0.000 0.000 . 0 "[ ]"
1 100 ARG 0.005 0.005 1 0 "[ ]"
1 101 SER 0.086 0.086 1 0 "[ ]"
1 102 GLY 0.000 0.000 . 0 "[ ]"
1 103 SER 0.445 0.354 1 0 "[ ]"
1 104 ASN 0.635 0.354 1 0 "[ ]"
1 105 PRO 0.237 0.237 1 0 "[ ]"
1 106 ASN 0.474 0.237 1 0 "[ ]"
1 107 ARG 0.000 0.000 . 0 "[ ]"
1 108 VAL 0.364 0.330 1 0 "[ ]"
1 109 ARG 0.384 0.186 1 0 "[ ]"
1 110 MET 0.320 0.186 1 0 "[ ]"
1 111 PHE 0.323 0.101 1 0 "[ ]"
1 112 GLY 0.610 0.174 1 0 "[ ]"
1 113 PRO 0.456 0.174 1 0 "[ ]"
1 114 ASP 0.200 0.162 1 0 "[ ]"
1 115 LYS 0.038 0.038 1 0 "[ ]"
1 116 LEU 0.716 0.162 1 0 "[ ]"
1 117 VAL 0.284 0.114 1 0 "[ ]"
1 118 ARG 0.036 0.036 1 0 "[ ]"
1 119 ALA 0.031 0.031 1 0 "[ ]"
1 120 ALA 0.153 0.072 1 0 "[ ]"
1 121 ALA 0.330 0.153 1 0 "[ ]"
1 122 GLU 0.122 0.122 1 0 "[ ]"
1 123 LYS 0.083 0.051 1 0 "[ ]"
1 124 ARG 0.153 0.074 1 0 "[ ]"
1 125 TRP 0.412 0.072 1 0 "[ ]"
1 126 ASP 0.285 0.114 1 0 "[ ]"
1 127 ARG 0.207 0.111 1 0 "[ ]"
1 128 VAL 0.151 0.077 1 0 "[ ]"
1 129 LYS 0.079 0.045 1 0 "[ ]"
1 130 ILE 0.092 0.057 1 0 "[ ]"
1 131 VAL 0.089 0.080 1 0 "[ ]"
1 132 CYS 0.106 0.105 1 0 "[ ]"
1 133 SER 0.191 0.062 1 0 "[ ]"
1 134 GLN 0.000 0.000 . 0 "[ ]"
1 135 PRO 0.000 0.000 . 0 "[ ]"
1 136 TYR 0.197 0.159 1 0 "[ ]"
1 137 SER 0.216 0.159 1 0 "[ ]"
1 138 LYS 0.000 0.000 . 0 "[ ]"
1 139 ASP 0.423 0.231 1 0 "[ ]"
1 140 SER 0.428 0.231 1 0 "[ ]"
1 141 PRO 0.016 0.016 1 0 "[ ]"
1 142 PHE 0.037 0.022 1 0 "[ ]"
1 143 GLY 0.202 0.093 1 0 "[ ]"
1 144 LEU 0.520 0.137 1 0 "[ ]"
1 145 SER 0.063 0.026 1 0 "[ ]"
1 146 PHE 0.735 0.330 1 0 "[ ]"
1 147 VAL 0.184 0.089 1 0 "[ ]"
1 148 ARG 0.362 0.122 1 0 "[ ]"
1 149 PHE 0.100 0.082 1 0 "[ ]"
1 150 HIS 0.270 0.102 1 0 "[ ]"
1 151 SER 0.032 0.032 1 0 "[ ]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 3 GLU H 1 3 GLU HG2 3.650 . 5.500 4.165 4.165 4.165 . 0 0 "[ ]" 1
2 1 3 GLU H 1 3 GLU HG3 3.650 . 5.500 3.748 3.748 3.748 . 0 0 "[ ]" 1
3 1 3 GLU H 1 151 SER QB 4.090 . 6.380 5.010 5.010 5.010 . 0 0 "[ ]" 1
4 1 3 GLU HA 1 4 ILE H 2.410 . 3.020 2.564 2.564 2.564 . 0 0 "[ ]" 1
5 1 3 GLU HA 1 150 HIS HA 2.145 . 2.490 2.520 2.520 2.520 0.030 1 0 "[ ]" 1
6 1 3 GLU HA 1 151 SER H 2.720 . 3.640 2.518 2.518 2.518 . 0 0 "[ ]" 1
7 1 3 GLU QB 1 150 HIS HA 3.345 . 4.890 3.770 3.770 3.770 . 0 0 "[ ]" 1
8 1 3 GLU QG 1 4 ILE H 3.455 . 5.110 3.495 3.495 3.495 . 0 0 "[ ]" 1
9 1 3 GLU QG 1 151 SER H 4.090 . 6.380 4.202 4.202 4.202 . 0 0 "[ ]" 1
10 1 4 ILE H 1 4 ILE HB 2.985 . 4.170 2.742 2.742 2.742 . 0 0 "[ ]" 1
11 1 4 ILE H 1 4 ILE MD 3.530 . 5.260 4.146 4.146 4.146 . 0 0 "[ ]" 1
12 1 4 ILE H 1 4 ILE HG12 3.540 . 5.280 4.217 4.217 4.217 . 0 0 "[ ]" 1
13 1 4 ILE H 1 4 ILE QG 3.445 . 5.090 3.034 3.034 3.034 . 0 0 "[ ]" 1
14 1 4 ILE H 1 4 ILE HG13 3.540 . 5.280 3.111 3.111 3.111 . 0 0 "[ ]" 1
15 1 4 ILE H 1 150 HIS HA 2.795 . 3.790 2.211 2.211 2.211 . 0 0 "[ ]" 1
16 1 4 ILE H 1 151 SER H 2.935 . 4.070 3.627 3.627 3.627 . 0 0 "[ ]" 1
17 1 4 ILE HA 1 4 ILE MG 2.740 . 3.680 2.413 2.413 2.413 . 0 0 "[ ]" 1
18 1 4 ILE HA 1 5 ARG H 2.255 . 2.710 2.188 2.188 2.188 . 0 0 "[ ]" 1
19 1 4 ILE HB 1 51 LYS QE 3.530 . 5.260 4.572 4.572 4.572 . 0 0 "[ ]" 1
20 1 4 ILE HB 1 149 PHE HA 3.090 . 4.380 4.138 4.138 4.138 . 0 0 "[ ]" 1
21 1 4 ILE HB 1 149 PHE HB2 2.625 . 3.450 2.480 2.480 2.480 . 0 0 "[ ]" 1
22 1 4 ILE HB 1 149 PHE HD2 3.650 . 5.500 4.658 4.658 4.658 . 0 0 "[ ]" 1
23 1 4 ILE MD 1 5 ARG H 3.960 . 6.120 5.123 5.123 5.123 . 0 0 "[ ]" 1
24 1 4 ILE MD 1 53 GLU HB2 2.800 . 3.800 2.865 2.865 2.865 . 0 0 "[ ]" 1
25 1 4 ILE MD 1 53 GLU QG 3.425 . 5.050 2.990 2.990 2.990 . 0 0 "[ ]" 1
26 1 4 ILE MD 1 54 GLN HA 4.165 . 6.530 4.683 4.683 4.683 . 0 0 "[ ]" 1
27 1 4 ILE MD 1 149 PHE HA 4.165 . 6.530 4.500 4.500 4.500 . 0 0 "[ ]" 1
28 1 4 ILE MD 1 149 PHE HD2 4.135 . 6.470 4.991 4.991 4.991 . 0 0 "[ ]" 1
29 1 4 ILE MD 1 151 SER H 3.515 . 5.230 2.813 2.813 2.813 . 0 0 "[ ]" 1
30 1 4 ILE MD 1 151 SER HA 3.170 . 4.540 3.048 3.048 3.048 . 0 0 "[ ]" 1
31 1 4 ILE MD 1 151 SER HB2 3.140 . 4.480 3.097 3.097 3.097 . 0 0 "[ ]" 1
32 1 4 ILE MD 1 151 SER QB 3.035 . 4.270 1.992 1.992 1.992 . 0 0 "[ ]" 1
33 1 4 ILE MD 1 151 SER HB3 3.140 . 4.480 2.017 2.017 2.017 . 0 0 "[ ]" 1
34 1 4 ILE QG 1 150 HIS HA 3.020 . 4.240 2.621 2.621 2.621 . 0 0 "[ ]" 1
35 1 4 ILE QG 1 151 SER H 3.550 . 5.300 2.103 2.103 2.103 . 0 0 "[ ]" 1
36 1 4 ILE QG 1 151 SER HA 3.685 . 5.570 4.081 4.081 4.081 . 0 0 "[ ]" 1
37 1 4 ILE MG 1 5 ARG H 2.985 . 4.170 2.739 2.739 2.739 . 0 0 "[ ]" 1
38 1 4 ILE MG 1 49 LEU HA 3.140 . 4.480 3.831 3.831 3.831 . 0 0 "[ ]" 1
39 1 4 ILE MG 1 49 LEU QB 3.380 . 4.960 2.786 2.786 2.786 . 0 0 "[ ]" 1
40 1 4 ILE MG 1 53 GLU QG 3.160 . 4.520 3.146 3.146 3.146 . 0 0 "[ ]" 1
41 1 4 ILE MG 1 149 PHE H 3.825 . 5.850 4.012 4.012 4.012 . 0 0 "[ ]" 1
42 1 4 ILE MG 1 149 PHE HB2 3.605 . 5.410 2.123 2.123 2.123 . 0 0 "[ ]" 1
43 1 4 ILE MG 1 150 HIS H 3.605 . 5.410 4.518 4.518 4.518 . 0 0 "[ ]" 1
44 1 4 ILE MG 1 151 SER H 3.730 . 5.660 4.748 4.748 4.748 . 0 0 "[ ]" 1
45 1 5 ARG H 1 5 ARG HD2 3.650 . 5.500 4.963 4.963 4.963 . 0 0 "[ ]" 1
46 1 5 ARG H 1 5 ARG QD 3.385 . 4.970 3.814 3.814 3.814 . 0 0 "[ ]" 1
47 1 5 ARG H 1 5 ARG HD3 3.650 . 5.500 3.964 3.964 3.964 . 0 0 "[ ]" 1
48 1 5 ARG H 1 5 ARG HG2 3.650 . 5.500 4.659 4.659 4.659 . 0 0 "[ ]" 1
49 1 5 ARG H 1 5 ARG QG 3.390 . 4.980 3.517 3.517 3.517 . 0 0 "[ ]" 1
50 1 5 ARG H 1 5 ARG HG3 3.650 . 5.500 3.640 3.640 3.640 . 0 0 "[ ]" 1
51 1 5 ARG H 1 50 GLU QB 3.885 . 5.970 3.598 3.598 3.598 . 0 0 "[ ]" 1
52 1 5 ARG HA 1 6 LEU H 2.350 . 2.900 2.385 2.385 2.385 . 0 0 "[ ]" 1
53 1 5 ARG QG 1 6 LEU H 3.110 . 4.420 3.301 3.301 3.301 . 0 0 "[ ]" 1
54 1 5 ARG HG2 1 6 LEU H 3.200 . 4.600 3.489 3.489 3.489 . 0 0 "[ ]" 1
55 1 5 ARG HG3 1 6 LEU H 3.200 . 4.600 4.074 4.074 4.074 . 0 0 "[ ]" 1
56 1 6 LEU H 1 6 LEU QB 2.725 . 3.650 2.130 2.130 2.130 . 0 0 "[ ]" 1
57 1 6 LEU H 1 6 LEU MD1 3.390 . 4.980 2.842 2.842 2.842 . 0 0 "[ ]" 1
58 1 6 LEU H 1 6 LEU QD 3.185 . 4.570 2.793 2.793 2.793 . 0 0 "[ ]" 1
59 1 6 LEU H 1 6 LEU MD2 3.390 . 4.980 4.109 4.109 4.109 . 0 0 "[ ]" 1
60 1 6 LEU H 1 25 LEU QD 4.745 . 7.690 3.647 3.647 3.647 . 0 0 "[ ]" 1
61 1 6 LEU HA 1 7 ARG H 2.520 . 3.240 2.375 2.375 2.375 . 0 0 "[ ]" 1
62 1 6 LEU QB 1 8 HIS H 3.655 . 5.510 3.976 3.976 3.976 . 0 0 "[ ]" 1
63 1 6 LEU QB 1 25 LEU HA 3.360 . 4.920 2.987 2.987 2.987 . 0 0 "[ ]" 1
64 1 6 LEU QB 1 25 LEU QD 4.025 . 6.250 1.817 1.817 1.817 . 0 0 "[ ]" 1
65 1 6 LEU HB2 1 25 LEU HA 3.635 . 5.470 3.470 3.470 3.470 . 0 0 "[ ]" 1
66 1 6 LEU HB2 1 25 LEU MD1 4.895 . 7.990 2.939 2.939 2.939 . 0 0 "[ ]" 1
67 1 6 LEU HB2 1 25 LEU MD2 4.895 . 7.990 3.582 3.582 3.582 . 0 0 "[ ]" 1
68 1 6 LEU HB3 1 25 LEU HA 3.635 . 5.470 3.259 3.259 3.259 . 0 0 "[ ]" 1
69 1 6 LEU HB3 1 25 LEU MD1 4.895 . 7.990 1.880 1.880 1.880 . 0 0 "[ ]" 1
70 1 6 LEU HB3 1 25 LEU MD2 4.895 . 7.990 2.613 2.613 2.613 . 0 0 "[ ]" 1
71 1 6 LEU QD 1 7 ARG H 3.205 . 4.610 3.585 3.585 3.585 . 0 0 "[ ]" 1
72 1 6 LEU QD 1 8 HIS H 4.375 . 6.950 4.406 4.406 4.406 . 0 0 "[ ]" 1
73 1 6 LEU QD 1 25 LEU HA 3.850 . 5.900 3.632 3.632 3.632 . 0 0 "[ ]" 1
74 1 6 LEU QD 1 149 PHE HD2 3.655 . 5.510 1.934 1.934 1.934 . 0 0 "[ ]" 1
75 1 6 LEU QD 1 149 PHE HE2 3.915 . 6.030 2.024 2.024 2.024 . 0 0 "[ ]" 1
76 1 6 LEU MD1 1 7 ARG H 3.480 . 5.160 3.961 3.961 3.961 . 0 0 "[ ]" 1
77 1 6 LEU MD1 1 149 PHE HD2 4.165 . 6.530 1.938 1.938 1.938 . 0 0 "[ ]" 1
78 1 6 LEU MD1 1 149 PHE HE2 4.165 . 6.530 2.070 2.070 2.070 . 0 0 "[ ]" 1
79 1 6 LEU MD2 1 7 ARG H 3.480 . 5.160 4.095 4.095 4.095 . 0 0 "[ ]" 1
80 1 6 LEU MD2 1 149 PHE HD2 4.165 . 6.530 4.003 4.003 4.003 . 0 0 "[ ]" 1
81 1 6 LEU MD2 1 149 PHE HE2 4.165 . 6.530 2.849 2.849 2.849 . 0 0 "[ ]" 1
82 1 6 LEU HG 1 47 LEU HA 3.170 . 4.540 4.575 4.575 4.575 0.035 1 0 "[ ]" 1
83 1 7 ARG H 1 7 ARG HB2 2.935 . 4.070 2.856 2.856 2.856 . 0 0 "[ ]" 1
84 1 7 ARG H 1 7 ARG HB3 2.935 . 4.070 2.741 2.741 2.741 . 0 0 "[ ]" 1
85 1 7 ARG H 1 7 ARG HD2 3.650 . 5.500 5.466 5.466 5.466 . 0 0 "[ ]" 1
86 1 7 ARG H 1 7 ARG HD3 3.650 . 5.500 4.699 4.699 4.699 . 0 0 "[ ]" 1
87 1 7 ARG H 1 7 ARG HG2 3.650 . 5.500 4.817 4.817 4.817 . 0 0 "[ ]" 1
88 1 7 ARG H 1 7 ARG QG 3.235 . 4.670 4.132 4.132 4.132 . 0 0 "[ ]" 1
89 1 7 ARG H 1 7 ARG HG3 3.650 . 5.500 4.497 4.497 4.497 . 0 0 "[ ]" 1
90 1 7 ARG H 1 8 HIS H 2.520 . 3.240 2.187 2.187 2.187 . 0 0 "[ ]" 1
91 1 7 ARG H 1 50 GLU H 3.650 . 5.500 3.454 3.454 3.454 . 0 0 "[ ]" 1
92 1 7 ARG H 1 50 GLU HA 3.170 . 4.540 4.547 4.547 4.547 0.007 1 0 "[ ]" 1
93 1 7 ARG HA 1 8 HIS H 2.640 . 3.480 3.555 3.555 3.555 0.075 1 0 "[ ]" 1
94 1 7 ARG HA 1 25 LEU QD 3.955 . 6.110 2.597 2.597 2.597 . 0 0 "[ ]" 1
95 1 7 ARG QB 1 50 GLU HA 2.770 . 3.740 2.149 2.149 2.149 . 0 0 "[ ]" 1
96 1 7 ARG HB2 1 50 GLU HA 3.000 . 4.200 2.167 2.167 2.167 . 0 0 "[ ]" 1
97 1 7 ARG HB3 1 50 GLU HA 3.000 . 4.200 3.543 3.543 3.543 . 0 0 "[ ]" 1
98 1 7 ARG QD 1 50 GLU HA 3.145 . 4.490 2.253 2.253 2.253 . 0 0 "[ ]" 1
99 1 7 ARG QG 1 8 HIS H 3.190 . 4.580 3.630 3.630 3.630 . 0 0 "[ ]" 1
100 1 7 ARG QG 1 8 HIS HB2 3.735 . 5.670 4.916 4.916 4.916 . 0 0 "[ ]" 1
101 1 7 ARG QG 1 8 HIS HB3 3.840 . 5.880 3.521 3.521 3.521 . 0 0 "[ ]" 1
102 1 7 ARG QG 1 50 GLU HA 3.765 . 5.730 3.728 3.728 3.728 . 0 0 "[ ]" 1
103 1 8 HIS H 1 8 HIS HD2 3.650 . 5.500 3.753 3.753 3.753 . 0 0 "[ ]" 1
104 1 8 HIS H 1 22 GLU QG 4.090 . 6.380 5.751 5.751 5.751 . 0 0 "[ ]" 1
105 1 8 HIS H 1 25 LEU QD 4.220 . 6.640 2.917 2.917 2.917 . 0 0 "[ ]" 1
106 1 8 HIS H 1 48 GLN H 3.075 . 4.350 3.255 3.255 3.255 . 0 0 "[ ]" 1
107 1 8 HIS H 1 50 GLU QB 4.090 . 6.380 5.491 5.491 5.491 . 0 0 "[ ]" 1
108 1 8 HIS HA 1 8 HIS HB2 2.145 . 2.490 2.508 2.508 2.508 0.018 1 0 "[ ]" 1
109 1 8 HIS HA 1 8 HIS HB3 2.175 . 2.550 2.428 2.428 2.428 . 0 0 "[ ]" 1
110 1 8 HIS HA 1 8 HIS HD2 3.650 . 5.500 4.331 4.331 4.331 . 0 0 "[ ]" 1
111 1 8 HIS HA 1 9 VAL H 2.410 . 3.020 2.427 2.427 2.427 . 0 0 "[ ]" 1
112 1 8 HIS HA 1 25 LEU MD1 2.785 . 3.770 2.879 2.879 2.879 . 0 0 "[ ]" 1
113 1 8 HIS HA 1 25 LEU QD 2.520 . 3.240 2.344 2.344 2.344 . 0 0 "[ ]" 1
114 1 8 HIS HA 1 25 LEU MD2 2.785 . 3.770 2.482 2.482 2.482 . 0 0 "[ ]" 1
115 1 8 HIS HB2 1 9 VAL H 2.815 . 3.830 2.521 2.521 2.521 . 0 0 "[ ]" 1
116 1 8 HIS HB2 1 25 LEU MD1 3.945 . 6.090 4.904 4.904 4.904 . 0 0 "[ ]" 1
117 1 8 HIS HB2 1 25 LEU QD 3.735 . 5.670 4.169 4.169 4.169 . 0 0 "[ ]" 1
118 1 8 HIS HB2 1 25 LEU MD2 3.945 . 6.090 4.512 4.512 4.512 . 0 0 "[ ]" 1
119 1 8 HIS HB3 1 9 VAL H 2.890 . 3.980 3.803 3.803 3.803 . 0 0 "[ ]" 1
120 1 8 HIS HB3 1 25 LEU MD1 4.165 . 6.530 4.206 4.206 4.206 . 0 0 "[ ]" 1
121 1 8 HIS HB3 1 25 LEU QD 3.950 . 6.100 3.908 3.908 3.908 . 0 0 "[ ]" 1
122 1 8 HIS HB3 1 25 LEU MD2 4.165 . 6.530 4.640 4.640 4.640 . 0 0 "[ ]" 1
123 1 8 HIS HD2 1 10 VAL HA 2.565 . 3.330 2.515 2.515 2.515 . 0 0 "[ ]" 1
124 1 8 HIS HD2 1 48 GLN HG2 3.650 . 5.500 4.975 4.975 4.975 . 0 0 "[ ]" 1
125 1 8 HIS HD2 1 48 GLN HG3 3.650 . 5.500 3.854 3.854 3.854 . 0 0 "[ ]" 1
126 1 8 HIS HE1 1 48 GLN HG2 3.650 . 5.500 5.451 5.451 5.451 . 0 0 "[ ]" 1
127 1 8 HIS HE1 1 48 GLN QG 3.575 . 5.350 3.806 3.806 3.806 . 0 0 "[ ]" 1
128 1 8 HIS HE1 1 48 GLN HG3 3.650 . 5.500 3.885 3.885 3.885 . 0 0 "[ ]" 1
129 1 8 HIS O 1 48 GLN H 1.900 . 2.000 1.893 1.893 1.893 . 0 0 "[ ]" 1
130 1 8 HIS O 1 48 GLN N 2.850 2.700 3.000 2.838 2.838 2.838 . 0 0 "[ ]" 1
131 1 9 VAL H 1 9 VAL HB 2.955 . 4.110 2.716 2.716 2.716 . 0 0 "[ ]" 1
132 1 9 VAL H 1 9 VAL MG1 3.220 . 4.640 1.946 1.946 1.946 . 0 0 "[ ]" 1
133 1 9 VAL H 1 9 VAL QG 2.995 . 4.190 1.940 1.940 1.940 . 0 0 "[ ]" 1
134 1 9 VAL H 1 9 VAL MG2 3.220 . 4.640 3.795 3.795 3.795 . 0 0 "[ ]" 1
135 1 9 VAL H 1 47 LEU QB 4.090 . 6.380 5.239 5.239 5.239 . 0 0 "[ ]" 1
136 1 9 VAL HA 1 10 VAL H 2.720 . 3.640 2.300 2.300 2.300 . 0 0 "[ ]" 1
137 1 9 VAL HA 1 11 SER H 3.045 . 4.290 4.216 4.216 4.216 . 0 0 "[ ]" 1
138 1 9 VAL HA 1 47 LEU HA 2.270 . 2.740 2.015 2.015 2.015 . 0 0 "[ ]" 1
139 1 9 VAL HA 1 48 GLN H 3.090 . 4.380 2.980 2.980 2.980 . 0 0 "[ ]" 1
140 1 9 VAL HB 1 10 VAL H 3.650 . 5.500 4.603 4.603 4.603 . 0 0 "[ ]" 1
141 1 9 VAL HB 1 21 ALA H 3.650 . 5.500 5.524 5.524 5.524 0.024 1 0 "[ ]" 1
142 1 9 VAL QG 1 11 SER H 3.875 . 5.950 3.267 3.267 3.267 . 0 0 "[ ]" 1
143 1 9 VAL QG 1 11 SER HA 3.875 . 5.950 3.885 3.885 3.885 . 0 0 "[ ]" 1
144 1 9 VAL QG 1 12 CYS QB 3.170 . 4.540 1.976 1.976 1.976 . 0 0 "[ ]" 1
145 1 9 VAL QG 1 14 SER H 4.895 . 7.990 5.569 5.569 5.569 . 0 0 "[ ]" 1
146 1 9 VAL QG 1 15 GLN HE21 4.945 . 8.090 6.018 6.018 6.018 . 0 0 "[ ]" 1
147 1 9 VAL QG 1 21 ALA HA 4.245 . 6.690 4.552 4.552 4.552 . 0 0 "[ ]" 1
148 1 9 VAL QG 1 21 ALA MB 4.065 . 6.330 2.241 2.241 2.241 . 0 0 "[ ]" 1
149 1 9 VAL QG 1 22 GLU H 4.000 . 6.200 3.228 3.228 3.228 . 0 0 "[ ]" 1
150 1 9 VAL QG 1 22 GLU QG 4.950 . 8.100 2.320 2.320 2.320 . 0 0 "[ ]" 1
151 1 9 VAL QG 1 47 LEU HA 4.450 . 7.100 2.932 2.932 2.932 . 0 0 "[ ]" 1
152 1 9 VAL MG1 1 12 CYS HB2 3.770 . 5.740 4.597 4.597 4.597 . 0 0 "[ ]" 1
153 1 9 VAL MG1 1 12 CYS HB3 3.770 . 5.740 3.347 3.347 3.347 . 0 0 "[ ]" 1
154 1 9 VAL MG2 1 12 CYS HB2 3.770 . 5.740 3.332 3.332 3.332 . 0 0 "[ ]" 1
155 1 9 VAL MG2 1 12 CYS HB3 3.770 . 5.740 2.008 2.008 2.008 . 0 0 "[ ]" 1
156 1 10 VAL H 1 11 SER H 2.750 . 3.700 3.105 3.105 3.105 . 0 0 "[ ]" 1
157 1 10 VAL H 1 46 VAL HB 3.650 . 5.500 4.898 4.898 4.898 . 0 0 "[ ]" 1
158 1 10 VAL H 1 47 LEU HA 2.985 . 4.170 2.508 2.508 2.508 . 0 0 "[ ]" 1
159 1 10 VAL H 1 48 GLN H 3.110 . 4.420 2.413 2.413 2.413 . 0 0 "[ ]" 1
160 1 10 VAL HB 1 11 SER H 3.325 . 4.850 3.882 3.882 3.882 . 0 0 "[ ]" 1
161 1 10 VAL MG1 1 48 GLN H 3.685 . 5.570 2.912 2.912 2.912 . 0 0 "[ ]" 1
162 1 10 VAL MG1 1 48 GLN HG2 3.995 . 6.190 2.818 2.818 2.818 . 0 0 "[ ]" 1
163 1 10 VAL MG1 1 48 GLN HG3 3.995 . 6.190 3.410 3.410 3.410 . 0 0 "[ ]" 1
164 1 10 VAL MG2 1 11 SER H 3.185 . 4.570 2.760 2.760 2.760 . 0 0 "[ ]" 1
165 1 10 VAL MG2 1 11 SER HA 3.080 . 4.360 3.580 3.580 3.580 . 0 0 "[ ]" 1
166 1 10 VAL MG2 1 127 ARG HD2 2.755 . 3.710 2.813 2.813 2.813 . 0 0 "[ ]" 1
167 1 10 VAL MG2 1 127 ARG HD3 2.755 . 3.710 2.093 2.093 2.093 . 0 0 "[ ]" 1
168 1 11 SER H 1 46 VAL H 3.075 . 4.350 3.859 3.859 3.859 . 0 0 "[ ]" 1
169 1 11 SER H 1 46 VAL HB 3.060 . 4.320 2.180 2.180 2.180 . 0 0 "[ ]" 1
170 1 11 SER H 1 46 VAL O 1.900 . 2.000 2.091 2.091 2.091 0.091 1 0 "[ ]" 1
171 1 11 SER H 1 47 LEU HG 3.650 . 5.500 5.434 5.434 5.434 . 0 0 "[ ]" 1
172 1 11 SER QB 1 46 VAL H 4.090 . 6.380 3.276 3.276 3.276 . 0 0 "[ ]" 1
173 1 11 SER N 1 46 VAL O 2.850 2.700 3.000 2.912 2.912 2.912 . 0 0 "[ ]" 1
174 1 11 SER O 1 46 VAL H 1.900 . 2.000 2.020 2.020 2.020 0.020 1 0 "[ ]" 1
175 1 11 SER O 1 46 VAL N 2.850 2.700 3.000 2.678 2.678 2.678 0.022 1 0 "[ ]" 1
176 1 12 CYS HA 1 45 VAL HA 2.175 . 2.550 1.975 1.975 1.975 . 0 0 "[ ]" 1
177 1 12 CYS HA 1 45 VAL HB 3.000 . 4.200 4.096 4.096 4.096 . 0 0 "[ ]" 1
178 1 12 CYS HA 1 45 VAL MG2 3.065 . 4.330 3.162 3.162 3.162 . 0 0 "[ ]" 1
179 1 12 CYS HA 1 46 VAL H 2.660 . 3.520 2.340 2.340 2.340 . 0 0 "[ ]" 1
180 1 12 CYS QB 1 14 SER H 3.475 . 5.150 3.051 3.051 3.051 . 0 0 "[ ]" 1
181 1 12 CYS QB 1 21 ALA MB 3.220 . 4.640 3.093 3.093 3.093 . 0 0 "[ ]" 1
182 1 12 CYS QB 1 45 VAL HA 3.280 . 4.760 3.256 3.256 3.256 . 0 0 "[ ]" 1
183 1 12 CYS QB 1 45 VAL MG2 3.170 . 4.540 2.836 2.836 2.836 . 0 0 "[ ]" 1
184 1 12 CYS QB 1 46 VAL H 4.090 . 6.380 3.825 3.825 3.825 . 0 0 "[ ]" 1
185 1 12 CYS HB2 1 13 SER H 3.650 . 5.500 3.004 3.004 3.004 . 0 0 "[ ]" 1
186 1 12 CYS HB2 1 14 SER H 3.650 . 5.500 3.086 3.086 3.086 . 0 0 "[ ]" 1
187 1 12 CYS HB2 1 21 ALA MB 3.420 . 5.040 3.468 3.468 3.468 . 0 0 "[ ]" 1
188 1 12 CYS HB2 1 45 VAL HA 3.355 . 4.910 3.598 3.598 3.598 . 0 0 "[ ]" 1
189 1 12 CYS HB2 1 45 VAL MG2 3.265 . 4.730 3.343 3.343 3.343 . 0 0 "[ ]" 1
190 1 12 CYS HB3 1 13 SER H 3.650 . 5.500 4.040 4.040 4.040 . 0 0 "[ ]" 1
191 1 12 CYS HB3 1 14 SER H 3.650 . 5.500 4.810 4.810 4.810 . 0 0 "[ ]" 1
192 1 12 CYS HB3 1 21 ALA MB 3.420 . 5.040 3.476 3.476 3.476 . 0 0 "[ ]" 1
193 1 12 CYS HB3 1 45 VAL HA 3.355 . 4.910 3.718 3.718 3.718 . 0 0 "[ ]" 1
194 1 12 CYS HB3 1 45 VAL MG2 3.265 . 4.730 3.065 3.065 3.065 . 0 0 "[ ]" 1
195 1 13 SER H 1 14 SER H 2.550 . 3.300 2.711 2.711 2.711 . 0 0 "[ ]" 1
196 1 13 SER H 1 33 TRP HZ2 3.650 . 5.500 4.154 4.154 4.154 . 0 0 "[ ]" 1
197 1 13 SER H 1 44 SER H 2.920 . 4.040 3.787 3.787 3.787 . 0 0 "[ ]" 1
198 1 13 SER H 1 44 SER HB2 3.280 . 4.760 3.254 3.254 3.254 . 0 0 "[ ]" 1
199 1 13 SER H 1 44 SER QB 3.080 . 4.360 3.204 3.204 3.204 . 0 0 "[ ]" 1
200 1 13 SER H 1 44 SER HB3 3.280 . 4.760 4.802 4.802 4.802 0.042 1 0 "[ ]" 1
201 1 13 SER H 1 44 SER O 1.900 . 2.000 1.779 1.779 1.779 0.021 1 0 "[ ]" 1
202 1 13 SER H 1 45 VAL H 3.110 . 4.420 4.220 4.220 4.220 . 0 0 "[ ]" 1
203 1 13 SER H 1 45 VAL HA 2.520 . 3.240 2.472 2.472 2.472 . 0 0 "[ ]" 1
204 1 13 SER HA 1 14 SER H 2.580 . 3.360 2.739 2.739 2.739 . 0 0 "[ ]" 1
205 1 13 SER QB 1 44 SER H 3.425 . 5.050 2.633 2.633 2.633 . 0 0 "[ ]" 1
206 1 13 SER N 1 44 SER O 2.850 2.700 3.000 2.651 2.651 2.651 0.049 1 0 "[ ]" 1
207 1 13 SER O 1 44 SER H 1.900 . 2.000 2.124 2.124 2.124 0.124 1 0 "[ ]" 1
208 1 13 SER O 1 44 SER N 2.850 2.700 3.000 3.094 3.094 3.094 0.094 1 0 "[ ]" 1
209 1 14 SER H 1 15 GLN H 2.875 . 3.950 3.063 3.063 3.063 . 0 0 "[ ]" 1
210 1 14 SER H 1 33 TRP HZ2 3.090 . 4.380 4.074 4.074 4.074 . 0 0 "[ ]" 1
211 1 14 SER H 1 43 ILE MG 4.025 . 6.250 5.280 5.280 5.280 . 0 0 "[ ]" 1
212 1 14 SER H 1 44 SER H 3.295 . 4.790 4.297 4.297 4.297 . 0 0 "[ ]" 1
213 1 14 SER HA 1 15 GLN H 2.485 . 3.170 2.304 2.304 2.304 . 0 0 "[ ]" 1
214 1 14 SER HA 1 35 ALA HA 2.860 . 3.920 3.855 3.855 3.855 . 0 0 "[ ]" 1
215 1 14 SER HA 1 35 ALA MB 3.745 . 5.690 4.021 4.021 4.021 . 0 0 "[ ]" 1
216 1 14 SER HA 1 36 ALA MB 3.280 . 4.760 2.832 2.832 2.832 . 0 0 "[ ]" 1
217 1 14 SER HA 1 43 ILE HB 3.450 . 5.100 4.536 4.536 4.536 . 0 0 "[ ]" 1
218 1 14 SER HA 1 43 ILE MG 3.620 . 5.440 3.743 3.743 3.743 . 0 0 "[ ]" 1
219 1 14 SER QB 1 15 GLN H 3.060 . 4.320 3.778 3.778 3.778 . 0 0 "[ ]" 1
220 1 14 SER QB 1 35 ALA MB 3.455 . 5.110 2.893 2.893 2.893 . 0 0 "[ ]" 1
221 1 14 SER QB 1 43 ILE HA 3.425 . 5.050 2.555 2.555 2.555 . 0 0 "[ ]" 1
222 1 14 SER QB 1 43 ILE HB 3.190 . 4.580 1.846 1.846 1.846 . 0 0 "[ ]" 1
223 1 14 SER QB 1 43 ILE MD 3.365 . 4.930 3.051 3.051 3.051 . 0 0 "[ ]" 1
224 1 14 SER QB 1 43 ILE MG 2.965 . 4.130 1.857 1.857 1.857 . 0 0 "[ ]" 1
225 1 14 SER HB2 1 15 GLN H 3.185 . 4.570 4.601 4.601 4.601 0.031 1 0 "[ ]" 1
226 1 14 SER HB2 1 35 ALA MB 3.730 . 5.660 4.354 4.354 4.354 . 0 0 "[ ]" 1
227 1 14 SER HB2 1 43 ILE HB 3.420 . 5.040 2.054 2.054 2.054 . 0 0 "[ ]" 1
228 1 14 SER HB2 1 43 ILE MG 3.065 . 4.330 2.871 2.871 2.871 . 0 0 "[ ]" 1
229 1 14 SER HB3 1 15 GLN H 3.185 . 4.570 4.015 4.015 4.015 . 0 0 "[ ]" 1
230 1 14 SER HB3 1 35 ALA MB 3.730 . 5.660 2.937 2.937 2.937 . 0 0 "[ ]" 1
231 1 14 SER HB3 1 43 ILE HB 3.420 . 5.040 2.090 2.090 2.090 . 0 0 "[ ]" 1
232 1 14 SER HB3 1 43 ILE MG 3.065 . 4.330 1.881 1.881 1.881 . 0 0 "[ ]" 1
233 1 15 GLN H 1 15 GLN HE21 3.650 . 5.500 1.913 1.913 1.913 . 0 0 "[ ]" 1
234 1 15 GLN H 1 15 GLN HE22 3.650 . 5.500 3.565 3.565 3.565 . 0 0 "[ ]" 1
235 1 15 GLN H 1 15 GLN QG 3.205 . 4.610 2.582 2.582 2.582 . 0 0 "[ ]" 1
236 1 15 GLN H 1 16 ASP H 3.230 . 4.660 4.312 4.312 4.312 . 0 0 "[ ]" 1
237 1 15 GLN H 1 21 ALA MB 4.165 . 6.530 5.292 5.292 5.292 . 0 0 "[ ]" 1
238 1 15 GLN H 1 33 TRP HE1 3.650 . 5.500 4.314 4.314 4.314 . 0 0 "[ ]" 1
239 1 15 GLN H 1 43 ILE MG 4.165 . 6.530 5.072 5.072 5.072 . 0 0 "[ ]" 1
240 1 15 GLN HA 1 16 ASP H 2.610 . 3.420 2.269 2.269 2.269 . 0 0 "[ ]" 1
241 1 15 GLN HA 1 20 CYS HA 2.640 . 3.480 3.534 3.534 3.534 0.054 1 0 "[ ]" 1
242 1 15 GLN HA 1 21 ALA H 3.215 . 4.630 3.681 3.681 3.681 . 0 0 "[ ]" 1
243 1 15 GLN HA 1 21 ALA MB 3.310 . 4.820 3.942 3.942 3.942 . 0 0 "[ ]" 1
244 1 15 GLN HA 1 33 TRP HD1 2.720 . 3.640 3.607 3.607 3.607 . 0 0 "[ ]" 1
245 1 15 GLN HA 1 33 TRP HE1 2.795 . 3.790 2.327 2.327 2.327 . 0 0 "[ ]" 1
246 1 15 GLN HA 1 35 ALA HA 2.410 . 3.020 3.054 3.054 3.054 0.034 1 0 "[ ]" 1
247 1 15 GLN HA 1 36 ALA MB 3.700 . 5.600 3.799 3.799 3.799 . 0 0 "[ ]" 1
248 1 15 GLN QB 1 15 GLN HE21 3.965 . 6.130 2.961 2.961 2.961 . 0 0 "[ ]" 1
249 1 15 GLN QB 1 20 CYS HA 3.150 . 4.500 2.564 2.564 2.564 . 0 0 "[ ]" 1
250 1 15 GLN QB 1 20 CYS QB 3.050 . 4.300 2.679 2.679 2.679 . 0 0 "[ ]" 1
251 1 15 GLN QB 1 21 ALA H 3.720 . 5.640 1.833 1.833 1.833 . 0 0 "[ ]" 1
252 1 15 GLN QB 1 33 TRP HD1 3.720 . 5.640 3.194 3.194 3.194 . 0 0 "[ ]" 1
253 1 15 GLN QB 1 33 TRP HE1 2.890 . 3.980 2.146 2.146 2.146 . 0 0 "[ ]" 1
254 1 15 GLN QB 1 35 ALA HA 3.995 . 6.190 4.714 4.714 4.714 . 0 0 "[ ]" 1
255 1 15 GLN HB2 1 20 CYS HA 3.230 . 4.660 2.677 2.677 2.677 . 0 0 "[ ]" 1
256 1 15 GLN HB2 1 20 CYS HB2 3.605 . 5.410 2.837 2.837 2.837 . 0 0 "[ ]" 1
257 1 15 GLN HB2 1 20 CYS HB3 3.605 . 5.410 3.691 3.691 3.691 . 0 0 "[ ]" 1
258 1 15 GLN HB2 1 33 TRP HE1 3.125 . 4.450 3.776 3.776 3.776 . 0 0 "[ ]" 1
259 1 15 GLN HB3 1 20 CYS HA 3.230 . 4.660 3.283 3.283 3.283 . 0 0 "[ ]" 1
260 1 15 GLN HB3 1 20 CYS HB2 3.605 . 5.410 3.816 3.816 3.816 . 0 0 "[ ]" 1
261 1 15 GLN HB3 1 20 CYS HB3 3.605 . 5.410 4.945 4.945 4.945 . 0 0 "[ ]" 1
262 1 15 GLN HB3 1 33 TRP HE1 3.125 . 4.450 2.158 2.158 2.158 . 0 0 "[ ]" 1
263 1 15 GLN HE21 1 16 ASP QB 4.090 . 6.380 5.575 5.575 5.575 . 0 0 "[ ]" 1
264 1 15 GLN HE21 1 21 ALA H 3.650 . 5.500 5.244 5.244 5.244 . 0 0 "[ ]" 1
265 1 15 GLN HE21 1 21 ALA MB 4.150 . 6.500 5.252 5.252 5.252 . 0 0 "[ ]" 1
266 1 15 GLN HE21 1 35 ALA HA 3.650 . 5.500 5.640 5.640 5.640 0.140 1 0 "[ ]" 1
267 1 15 GLN QG 1 20 CYS HA 3.670 . 5.540 4.660 4.660 4.660 . 0 0 "[ ]" 1
268 1 16 ASP H 1 16 ASP QB 2.785 . 3.770 2.226 2.226 2.226 . 0 0 "[ ]" 1
269 1 16 ASP H 1 20 CYS HA 3.045 . 4.290 2.339 2.339 2.339 . 0 0 "[ ]" 1
270 1 16 ASP H 1 21 ALA H 3.000 . 4.200 3.982 3.982 3.982 . 0 0 "[ ]" 1
271 1 16 ASP H 1 21 ALA MB 4.100 . 6.400 5.014 5.014 5.014 . 0 0 "[ ]" 1
272 1 16 ASP H 1 33 TRP HD1 3.200 . 4.600 4.268 4.268 4.268 . 0 0 "[ ]" 1
273 1 16 ASP H 1 33 TRP HE1 3.295 . 4.790 4.256 4.256 4.256 . 0 0 "[ ]" 1
274 1 16 ASP H 1 34 ARG H 2.815 . 3.830 3.833 3.833 3.833 0.003 1 0 "[ ]" 1
275 1 16 ASP H 1 36 ALA HA 2.920 . 4.040 3.212 3.212 3.212 . 0 0 "[ ]" 1
276 1 16 ASP H 1 36 ALA MB 3.745 . 5.690 4.125 4.125 4.125 . 0 0 "[ ]" 1
277 1 16 ASP HA 1 17 SER H 2.300 . 2.800 2.747 2.747 2.747 . 0 0 "[ ]" 1
278 1 16 ASP HA 1 36 ALA HA 2.195 . 2.590 1.989 1.989 1.989 . 0 0 "[ ]" 1
279 1 16 ASP QB 1 17 SER H 3.050 . 4.300 2.260 2.260 2.260 . 0 0 "[ ]" 1
280 1 16 ASP QB 1 18 THR H 3.625 . 5.450 3.428 3.428 3.428 . 0 0 "[ ]" 1
281 1 16 ASP QB 1 19 HIS H 4.090 . 6.380 2.753 2.753 2.753 . 0 0 "[ ]" 1
282 1 16 ASP QB 1 20 CYS H 3.545 . 5.290 4.469 4.469 4.469 . 0 0 "[ ]" 1
283 1 16 ASP QB 1 36 ALA HA 2.635 . 3.470 2.821 2.821 2.821 . 0 0 "[ ]" 1
284 1 16 ASP HB2 1 17 SER H 3.185 . 4.570 3.655 3.655 3.655 . 0 0 "[ ]" 1
285 1 16 ASP HB2 1 20 CYS H 3.650 . 5.500 5.511 5.511 5.511 0.011 1 0 "[ ]" 1
286 1 16 ASP HB2 1 36 ALA HA 2.875 . 3.950 2.886 2.886 2.886 . 0 0 "[ ]" 1
287 1 16 ASP HB3 1 17 SER H 3.185 . 4.570 2.282 2.282 2.282 . 0 0 "[ ]" 1
288 1 16 ASP HB3 1 20 CYS H 3.650 . 5.500 4.725 4.725 4.725 . 0 0 "[ ]" 1
289 1 16 ASP HB3 1 36 ALA HA 2.875 . 3.950 3.974 3.974 3.974 0.024 1 0 "[ ]" 1
290 1 17 SER H 1 17 SER HA 2.350 . 2.900 2.943 2.943 2.943 0.043 1 0 "[ ]" 1
291 1 17 SER H 1 19 HIS H 3.140 . 4.480 4.011 4.011 4.011 . 0 0 "[ ]" 1
292 1 17 SER HA 1 20 CYS HB2 3.230 . 4.660 4.670 4.670 4.670 0.010 1 0 "[ ]" 1
293 1 17 SER HA 1 20 CYS QB 3.120 . 4.440 3.140 3.140 3.140 . 0 0 "[ ]" 1
294 1 17 SER HA 1 20 CYS HB3 3.230 . 4.660 3.191 3.191 3.191 . 0 0 "[ ]" 1
295 1 18 THR H 1 18 THR HB 2.610 . 3.420 3.477 3.477 3.477 0.057 1 0 "[ ]" 1
296 1 18 THR H 1 18 THR MG 3.185 . 4.570 2.917 2.917 2.917 . 0 0 "[ ]" 1
297 1 18 THR H 1 19 HIS H 2.330 . 2.860 2.862 2.862 2.862 0.002 1 0 "[ ]" 1
298 1 18 THR HA 1 18 THR HB 2.285 . 2.770 2.725 2.725 2.725 . 0 0 "[ ]" 1
299 1 18 THR HA 1 18 THR MG 2.615 . 3.430 2.178 2.178 2.178 . 0 0 "[ ]" 1
300 1 18 THR HB 1 19 HIS H 2.890 . 3.980 2.721 2.721 2.721 . 0 0 "[ ]" 1
301 1 18 THR HB 1 19 HIS HB2 3.650 . 5.500 4.667 4.667 4.667 . 0 0 "[ ]" 1
302 1 18 THR HB 1 19 HIS HD2 2.890 . 3.980 2.830 2.830 2.830 . 0 0 "[ ]" 1
303 1 18 THR MG 1 19 HIS H 3.545 . 5.290 3.945 3.945 3.945 . 0 0 "[ ]" 1
304 1 18 THR MG 1 31 ARG QD 4.600 . 7.400 4.296 4.296 4.296 . 0 0 "[ ]" 1
305 1 19 HIS H 1 19 HIS HB2 2.935 . 4.070 2.492 2.492 2.492 . 0 0 "[ ]" 1
306 1 19 HIS H 1 19 HIS HD2 3.650 . 5.500 2.531 2.531 2.531 . 0 0 "[ ]" 1
307 1 19 HIS H 1 20 CYS H 3.245 . 4.690 3.721 3.721 3.721 . 0 0 "[ ]" 1
308 1 19 HIS HA 1 20 CYS H 2.410 . 3.020 2.472 2.472 2.472 . 0 0 "[ ]" 1
309 1 19 HIS HA 1 23 ASN HD21 3.295 . 4.790 2.152 2.152 2.152 . 0 0 "[ ]" 1
310 1 19 HIS HA 1 23 ASN HD22 3.650 . 5.500 2.107 2.107 2.107 . 0 0 "[ ]" 1
311 1 19 HIS HB2 1 20 CYS H 3.605 . 5.410 4.457 4.457 4.457 . 0 0 "[ ]" 1
312 1 19 HIS HB3 1 20 CYS H 3.465 . 5.130 4.307 4.307 4.307 . 0 0 "[ ]" 1
313 1 20 CYS H 1 22 GLU H 3.215 . 4.630 4.650 4.650 4.650 0.020 1 0 "[ ]" 1
314 1 20 CYS H 1 23 ASN H 2.905 . 4.010 4.039 4.039 4.039 0.029 1 0 "[ ]" 1
315 1 20 CYS H 1 23 ASN HB2 2.955 . 4.110 4.141 4.141 4.141 0.031 1 0 "[ ]" 1
316 1 20 CYS H 1 23 ASN HD21 2.720 . 3.640 2.127 2.127 2.127 . 0 0 "[ ]" 1
317 1 20 CYS H 1 23 ASN HD22 3.030 . 4.260 2.084 2.084 2.084 . 0 0 "[ ]" 1
318 1 20 CYS HA 1 21 ALA MB 3.870 . 5.940 4.154 4.154 4.154 . 0 0 "[ ]" 1
319 1 20 CYS HA 1 22 GLU H 3.140 . 4.480 4.128 4.128 4.128 . 0 0 "[ ]" 1
320 1 20 CYS HA 1 33 TRP HD1 3.215 . 4.630 3.759 3.759 3.759 . 0 0 "[ ]" 1
321 1 20 CYS HA 1 33 TRP HE1 3.570 . 5.340 4.592 4.592 4.592 . 0 0 "[ ]" 1
322 1 20 CYS QB 1 21 ALA H 3.625 . 5.450 2.349 2.349 2.349 . 0 0 "[ ]" 1
323 1 20 CYS O 1 23 ASN H 1.900 . 2.000 2.045 2.045 2.045 0.045 1 0 "[ ]" 1
324 1 20 CYS O 1 23 ASN N 2.850 2.700 3.000 2.995 2.995 2.995 . 0 0 "[ ]" 1
325 1 21 ALA H 1 22 GLU H 2.765 . 3.730 2.623 2.623 2.623 . 0 0 "[ ]" 1
326 1 21 ALA H 1 33 TRP HD1 3.450 . 5.100 3.162 3.162 3.162 . 0 0 "[ ]" 1
327 1 21 ALA H 1 33 TRP HE1 3.650 . 5.500 3.549 3.549 3.549 . 0 0 "[ ]" 1
328 1 21 ALA HA 1 23 ASN H 3.525 . 5.250 3.543 3.543 3.543 . 0 0 "[ ]" 1
329 1 21 ALA HA 1 24 LEU H 3.185 . 4.570 3.762 3.762 3.762 . 0 0 "[ ]" 1
330 1 21 ALA HA 1 24 LEU QB 4.090 . 6.380 4.554 4.554 4.554 . 0 0 "[ ]" 1
331 1 21 ALA HA 1 24 LEU QD 4.265 . 6.730 2.320 2.320 2.320 . 0 0 "[ ]" 1
332 1 21 ALA HA 1 24 LEU HG 2.455 . 3.110 2.971 2.971 2.971 . 0 0 "[ ]" 1
333 1 21 ALA HA 1 33 TRP HA 2.580 . 3.360 2.787 2.787 2.787 . 0 0 "[ ]" 1
334 1 21 ALA HA 1 33 TRP HB2 2.470 . 3.140 3.155 3.155 3.155 0.015 1 0 "[ ]" 1
335 1 21 ALA HA 1 33 TRP HB3 3.140 . 4.480 4.484 4.484 4.484 0.004 1 0 "[ ]" 1
336 1 21 ALA HA 1 33 TRP HD1 2.580 . 3.360 2.029 2.029 2.029 . 0 0 "[ ]" 1
337 1 21 ALA MB 1 33 TRP HD1 4.165 . 6.530 2.795 2.795 2.795 . 0 0 "[ ]" 1
338 1 21 ALA MB 1 33 TRP HE1 3.420 . 5.040 2.491 2.491 2.491 . 0 0 "[ ]" 1
339 1 21 ALA O 1 24 LEU H 1.900 . 2.000 2.004 2.004 2.004 0.004 1 0 "[ ]" 1
340 1 21 ALA O 1 24 LEU N 2.850 2.700 3.000 2.945 2.945 2.945 . 0 0 "[ ]" 1
341 1 22 GLU H 1 22 GLU HG2 3.245 . 4.690 4.460 4.460 4.460 . 0 0 "[ ]" 1
342 1 22 GLU H 1 22 GLU QG 3.145 . 4.490 3.766 3.766 3.766 . 0 0 "[ ]" 1
343 1 22 GLU H 1 22 GLU HG3 3.245 . 4.690 4.060 4.060 4.060 . 0 0 "[ ]" 1
344 1 22 GLU H 1 23 ASN H 2.610 . 3.420 2.679 2.679 2.679 . 0 0 "[ ]" 1
345 1 22 GLU H 1 33 TRP HD1 3.650 . 5.500 4.869 4.869 4.869 . 0 0 "[ ]" 1
346 1 22 GLU HA 1 24 LEU H 3.355 . 4.910 3.505 3.505 3.505 . 0 0 "[ ]" 1
347 1 22 GLU HA 1 25 LEU H 2.935 . 4.070 3.480 3.480 3.480 . 0 0 "[ ]" 1
348 1 22 GLU HA 1 25 LEU MD1 3.855 . 5.910 4.979 4.979 4.979 . 0 0 "[ ]" 1
349 1 22 GLU HA 1 25 LEU QD 3.265 . 4.730 2.306 2.306 2.306 . 0 0 "[ ]" 1
350 1 22 GLU HA 1 25 LEU MD2 3.855 . 5.910 2.310 2.310 2.310 . 0 0 "[ ]" 1
351 1 22 GLU HB2 1 23 ASN H 3.650 . 5.500 3.871 3.871 3.871 . 0 0 "[ ]" 1
352 1 22 GLU HB3 1 23 ASN H 3.650 . 5.500 3.280 3.280 3.280 . 0 0 "[ ]" 1
353 1 22 GLU QG 1 25 LEU QD 4.275 . 6.750 2.677 2.677 2.677 . 0 0 "[ ]" 1
354 1 22 GLU HG2 1 23 ASN H 3.650 . 5.500 4.801 4.801 4.801 . 0 0 "[ ]" 1
355 1 22 GLU HG3 1 23 ASN H 3.650 . 5.500 5.365 5.365 5.365 . 0 0 "[ ]" 1
356 1 22 GLU O 1 25 LEU H 1.900 . 2.000 2.048 2.048 2.048 0.048 1 0 "[ ]" 1
357 1 22 GLU O 1 25 LEU N 2.850 2.700 3.000 2.947 2.947 2.947 . 0 0 "[ ]" 1
358 1 23 ASN H 1 23 ASN HB2 2.625 . 3.450 2.287 2.287 2.287 . 0 0 "[ ]" 1
359 1 23 ASN H 1 23 ASN HB3 2.690 . 3.580 3.575 3.575 3.575 . 0 0 "[ ]" 1
360 1 23 ASN H 1 23 ASN HD21 3.650 . 5.500 3.154 3.154 3.154 . 0 0 "[ ]" 1
361 1 23 ASN H 1 23 ASN HD22 3.465 . 5.130 4.082 4.082 4.082 . 0 0 "[ ]" 1
362 1 23 ASN H 1 24 LEU H 2.580 . 3.360 2.580 2.580 2.580 . 0 0 "[ ]" 1
363 1 23 ASN H 1 24 LEU QB 3.795 . 5.790 4.744 4.744 4.744 . 0 0 "[ ]" 1
364 1 23 ASN H 1 24 LEU MD1 3.945 . 6.090 4.377 4.377 4.377 . 0 0 "[ ]" 1
365 1 23 ASN H 1 24 LEU QD 3.590 . 5.380 4.127 4.127 4.127 . 0 0 "[ ]" 1
366 1 23 ASN H 1 24 LEU MD2 3.945 . 6.090 5.053 5.053 5.053 . 0 0 "[ ]" 1
367 1 23 ASN H 1 24 LEU HG 2.830 . 3.860 3.719 3.719 3.719 . 0 0 "[ ]" 1
368 1 23 ASN H 1 25 LEU H 3.435 . 5.070 4.268 4.268 4.268 . 0 0 "[ ]" 1
369 1 23 ASN HA 1 23 ASN HB2 2.365 . 2.930 3.004 3.004 3.004 0.074 1 0 "[ ]" 1
370 1 23 ASN HA 1 23 ASN HB3 2.365 . 2.930 2.598 2.598 2.598 . 0 0 "[ ]" 1
371 1 23 ASN HB2 1 24 LEU H 3.650 . 5.500 3.168 3.168 3.168 . 0 0 "[ ]" 1
372 1 23 ASN HB3 1 24 LEU H 3.650 . 5.500 3.856 3.856 3.856 . 0 0 "[ ]" 1
373 1 23 ASN HB3 1 31 ARG QB 3.315 . 4.830 2.391 2.391 2.391 . 0 0 "[ ]" 1
374 1 23 ASN HD21 1 24 LEU HG 3.650 . 5.500 5.549 5.549 5.549 0.049 1 0 "[ ]" 1
375 1 23 ASN HD22 1 31 ARG QB 4.090 . 6.380 3.162 3.162 3.162 . 0 0 "[ ]" 1
376 1 23 ASN O 1 26 LYS H 1.900 . 2.000 2.018 2.018 2.018 0.018 1 0 "[ ]" 1
377 1 23 ASN O 1 26 LYS N 2.850 2.700 3.000 2.925 2.925 2.925 . 0 0 "[ ]" 1
378 1 24 LEU H 1 24 LEU MD1 3.155 . 4.510 3.096 3.096 3.096 . 0 0 "[ ]" 1
379 1 24 LEU H 1 24 LEU QD 2.975 . 4.150 2.894 2.894 2.894 . 0 0 "[ ]" 1
380 1 24 LEU H 1 24 LEU MD2 3.155 . 4.510 3.474 3.474 3.474 . 0 0 "[ ]" 1
381 1 24 LEU H 1 24 LEU HG 2.860 . 3.920 1.928 1.928 1.928 . 0 0 "[ ]" 1
382 1 24 LEU H 1 25 LEU H 2.735 . 3.670 2.560 2.560 2.560 . 0 0 "[ ]" 1
383 1 24 LEU H 1 25 LEU QD 4.950 . 8.100 3.427 3.427 3.427 . 0 0 "[ ]" 1
384 1 24 LEU H 1 26 LYS H 2.875 . 3.950 4.074 4.074 4.074 0.124 1 0 "[ ]" 1
385 1 24 LEU HA 1 24 LEU MD1 3.840 . 5.880 3.908 3.908 3.908 . 0 0 "[ ]" 1
386 1 24 LEU HA 1 24 LEU MD2 3.840 . 5.880 2.475 2.475 2.475 . 0 0 "[ ]" 1
387 1 24 LEU QB 1 25 LEU H 3.825 . 5.850 2.842 2.842 2.842 . 0 0 "[ ]" 1
388 1 24 LEU QB 1 146 PHE HA 3.455 . 5.110 3.640 3.640 3.640 . 0 0 "[ ]" 1
389 1 24 LEU QD 1 25 LEU H 4.700 . 7.600 4.050 4.050 4.050 . 0 0 "[ ]" 1
390 1 24 LEU QD 1 26 LYS H 4.825 . 7.850 5.072 5.072 5.072 . 0 0 "[ ]" 1
391 1 24 LEU QD 1 33 TRP H 4.950 . 8.100 2.578 2.578 2.578 . 0 0 "[ ]" 1
392 1 24 LEU QD 1 33 TRP HB2 4.795 . 7.790 1.826 1.826 1.826 . 0 0 "[ ]" 1
393 1 24 LEU QD 1 33 TRP HB3 3.205 . 4.610 2.795 2.795 2.795 . 0 0 "[ ]" 1
394 1 24 LEU QD 1 33 TRP HE3 4.080 . 6.360 3.460 3.460 3.460 . 0 0 "[ ]" 1
395 1 24 LEU QD 1 146 PHE HA 3.645 . 5.490 2.203 2.203 2.203 . 0 0 "[ ]" 1
396 1 24 LEU MD1 1 33 TRP HB3 3.390 . 4.980 3.765 3.765 3.765 . 0 0 "[ ]" 1
397 1 24 LEU MD2 1 33 TRP HB3 3.390 . 4.980 2.881 2.881 2.881 . 0 0 "[ ]" 1
398 1 25 LEU H 1 25 LEU HB2 2.410 . 3.020 2.195 2.195 2.195 . 0 0 "[ ]" 1
399 1 25 LEU H 1 25 LEU HB3 2.580 . 3.360 3.500 3.500 3.500 0.140 1 0 "[ ]" 1
400 1 25 LEU H 1 25 LEU MD1 3.205 . 4.610 3.847 3.847 3.847 . 0 0 "[ ]" 1
401 1 25 LEU H 1 25 LEU QD 2.985 . 4.170 1.990 1.990 1.990 . 0 0 "[ ]" 1
402 1 25 LEU H 1 25 LEU MD2 3.205 . 4.610 1.997 1.997 1.997 . 0 0 "[ ]" 1
403 1 25 LEU H 1 26 LYS H 2.485 . 3.170 2.639 2.639 2.639 . 0 0 "[ ]" 1
404 1 25 LEU HA 1 25 LEU MD1 2.675 . 3.550 1.898 1.898 1.898 . 0 0 "[ ]" 1
405 1 25 LEU HA 1 25 LEU QD 2.460 . 3.120 1.809 1.809 1.809 . 0 0 "[ ]" 1
406 1 25 LEU HA 1 25 LEU MD2 2.675 . 3.550 2.278 2.278 2.278 . 0 0 "[ ]" 1
407 1 25 LEU HA 1 26 LYS H 2.675 . 3.550 3.480 3.480 3.480 . 0 0 "[ ]" 1
408 1 25 LEU QD 1 26 LYS H 4.640 . 7.480 3.863 3.863 3.863 . 0 0 "[ ]" 1
409 1 25 LEU QD 1 27 ALA H 4.950 . 8.100 4.970 4.970 4.970 . 0 0 "[ ]" 1
410 1 26 LYS H 1 26 LYS HB2 2.660 . 3.520 2.721 2.721 2.721 . 0 0 "[ ]" 1
411 1 26 LYS H 1 26 LYS HB3 2.985 . 4.170 3.797 3.797 3.797 . 0 0 "[ ]" 1
412 1 26 LYS H 1 26 LYS QE 4.090 . 6.380 4.667 4.667 4.667 . 0 0 "[ ]" 1
413 1 26 LYS H 1 26 LYS HG2 3.650 . 5.500 2.488 2.488 2.488 . 0 0 "[ ]" 1
414 1 26 LYS H 1 26 LYS QG 3.260 . 4.720 2.459 2.459 2.459 . 0 0 "[ ]" 1
415 1 26 LYS H 1 26 LYS HG3 3.650 . 5.500 3.848 3.848 3.848 . 0 0 "[ ]" 1
416 1 26 LYS H 1 27 ALA H 2.565 . 3.330 3.380 3.380 3.380 0.050 1 0 "[ ]" 1
417 1 26 LYS HA 1 27 ALA H 2.330 . 2.860 2.526 2.526 2.526 . 0 0 "[ ]" 1
418 1 26 LYS HB2 1 29 THR HB 2.815 . 3.830 3.859 3.859 3.859 0.029 1 0 "[ ]" 1
419 1 26 LYS HB2 1 29 THR MG 2.875 . 3.950 3.180 3.180 3.180 . 0 0 "[ ]" 1
420 1 26 LYS QD 1 27 ALA H 4.090 . 6.380 4.424 4.424 4.424 . 0 0 "[ ]" 1
421 1 26 LYS QG 1 27 ALA H 4.090 . 6.380 4.702 4.702 4.702 . 0 0 "[ ]" 1
422 1 26 LYS QG 1 29 THR HB 3.565 . 5.330 4.418 4.418 4.418 . 0 0 "[ ]" 1
423 1 27 ALA H 1 28 ASP H 2.440 . 3.080 2.810 2.810 2.810 . 0 0 "[ ]" 1
424 1 27 ALA H 1 28 ASP QB 4.090 . 6.380 4.776 4.776 4.776 . 0 0 "[ ]" 1
425 1 27 ALA HA 1 147 VAL H 3.045 . 4.290 4.315 4.315 4.315 0.025 1 0 "[ ]" 1
426 1 27 ALA MB 1 28 ASP H 2.860 . 3.920 2.868 2.868 2.868 . 0 0 "[ ]" 1
427 1 27 ALA MB 1 29 THR H 4.165 . 6.530 5.195 5.195 5.195 . 0 0 "[ ]" 1
428 1 27 ALA MB 1 147 VAL H 3.575 . 5.350 3.488 3.488 3.488 . 0 0 "[ ]" 1
429 1 28 ASP H 1 29 THR MG 4.165 . 6.530 3.584 3.584 3.584 . 0 0 "[ ]" 1
430 1 28 ASP HA 1 29 THR H 2.485 . 3.170 2.368 2.368 2.368 . 0 0 "[ ]" 1
431 1 29 THR H 1 29 THR MG 3.250 . 4.700 3.569 3.569 3.569 . 0 0 "[ ]" 1
432 1 29 THR H 1 30 TYR HB3 3.650 . 5.500 5.189 5.189 5.189 . 0 0 "[ ]" 1
433 1 29 THR HA 1 29 THR MG 2.615 . 3.430 2.068 2.068 2.068 . 0 0 "[ ]" 1
434 1 29 THR HA 1 30 TYR HB3 3.045 . 4.290 4.342 4.342 4.342 0.052 1 0 "[ ]" 1
435 1 29 THR HA 1 30 TYR HD1 3.650 . 5.500 3.092 3.092 3.092 . 0 0 "[ ]" 1
436 1 29 THR HA 1 30 TYR HE1 3.650 . 5.500 4.661 4.661 4.661 . 0 0 "[ ]" 1
437 1 29 THR HB 1 30 TYR H 2.845 . 3.890 2.237 2.237 2.237 . 0 0 "[ ]" 1
438 1 29 THR HB 1 30 TYR HB3 3.605 . 5.410 4.256 4.256 4.256 . 0 0 "[ ]" 1
439 1 29 THR HB 1 30 TYR HD1 3.650 . 5.500 2.384 2.384 2.384 . 0 0 "[ ]" 1
440 1 29 THR HB 1 30 TYR HE1 3.650 . 5.500 3.020 3.020 3.020 . 0 0 "[ ]" 1
441 1 29 THR MG 1 30 TYR H 3.945 . 6.090 3.709 3.709 3.709 . 0 0 "[ ]" 1
442 1 30 TYR H 1 30 TYR HD1 3.125 . 4.450 3.178 3.178 3.178 . 0 0 "[ ]" 1
443 1 30 TYR H 1 31 ARG H 2.955 . 4.110 1.970 1.970 1.970 . 0 0 "[ ]" 1
444 1 30 TYR HD1 1 31 ARG H 3.650 . 5.500 4.949 4.949 4.949 . 0 0 "[ ]" 1
445 1 31 ARG H 1 31 ARG QB 2.835 . 3.870 2.815 2.815 2.815 . 0 0 "[ ]" 1
446 1 31 ARG H 1 31 ARG QD 4.090 . 6.380 5.097 5.097 5.097 . 0 0 "[ ]" 1
447 1 31 ARG H 1 31 ARG QG 4.090 . 6.380 3.568 3.568 3.568 . 0 0 "[ ]" 1
448 1 32 LYS H 1 32 LYS HD2 3.480 . 5.160 3.242 3.242 3.242 . 0 0 "[ ]" 1
449 1 32 LYS H 1 32 LYS QD 3.140 . 4.480 3.183 3.183 3.183 . 0 0 "[ ]" 1
450 1 32 LYS H 1 32 LYS HD3 3.480 . 5.160 4.643 4.643 4.643 . 0 0 "[ ]" 1
451 1 32 LYS H 1 32 LYS HG2 3.650 . 5.500 4.230 4.230 4.230 . 0 0 "[ ]" 1
452 1 32 LYS H 1 32 LYS HG3 3.650 . 5.500 2.824 2.824 2.824 . 0 0 "[ ]" 1
453 1 32 LYS H 1 33 TRP H 3.280 . 4.760 4.345 4.345 4.345 . 0 0 "[ ]" 1
454 1 32 LYS QB 1 33 TRP H 3.375 . 4.950 1.984 1.984 1.984 . 0 0 "[ ]" 1
455 1 32 LYS QB 1 145 SER HA 2.475 . 3.150 1.898 1.898 1.898 . 0 0 "[ ]" 1
456 1 32 LYS HB2 1 145 SER HA 2.580 . 3.360 2.844 2.844 2.844 . 0 0 "[ ]" 1
457 1 32 LYS HB3 1 145 SER HA 2.580 . 3.360 1.928 1.928 1.928 . 0 0 "[ ]" 1
458 1 32 LYS QD 1 145 SER HA 2.380 . 2.960 2.629 2.629 2.629 . 0 0 "[ ]" 1
459 1 32 LYS QD 1 145 SER QB 4.495 . 7.190 3.485 3.485 3.485 . 0 0 "[ ]" 1
460 1 32 LYS HD2 1 145 SER HA 2.625 . 3.450 3.457 3.457 3.457 0.007 1 0 "[ ]" 1
461 1 32 LYS HD3 1 145 SER HA 2.625 . 3.450 2.725 2.725 2.725 . 0 0 "[ ]" 1
462 1 32 LYS QG 1 33 TRP H 3.375 . 4.950 3.911 3.911 3.911 . 0 0 "[ ]" 1
463 1 32 LYS QG 1 145 SER QB 4.050 . 6.300 2.877 2.877 2.877 . 0 0 "[ ]" 1
464 1 32 LYS HG2 1 145 SER HA 2.720 . 3.640 2.165 2.165 2.165 . 0 0 "[ ]" 1
465 1 32 LYS HG2 1 145 SER HB2 4.525 . 7.250 4.300 4.300 4.300 . 0 0 "[ ]" 1
466 1 32 LYS HG2 1 145 SER HB3 4.525 . 7.250 2.959 2.959 2.959 . 0 0 "[ ]" 1
467 1 32 LYS HG3 1 145 SER HA 2.720 . 3.640 3.657 3.657 3.657 0.017 1 0 "[ ]" 1
468 1 32 LYS HG3 1 145 SER HB2 4.525 . 7.250 6.057 6.057 6.057 . 0 0 "[ ]" 1
469 1 32 LYS HG3 1 145 SER HB3 4.525 . 7.250 4.675 4.675 4.675 . 0 0 "[ ]" 1
470 1 33 TRP H 1 33 TRP HB2 2.970 . 4.140 2.723 2.723 2.723 . 0 0 "[ ]" 1
471 1 33 TRP H 1 33 TRP HD1 3.295 . 4.790 4.825 4.825 4.825 0.035 1 0 "[ ]" 1
472 1 33 TRP H 1 144 LEU O 1.900 . 2.000 2.038 2.038 2.038 0.038 1 0 "[ ]" 1
473 1 33 TRP HA 1 33 TRP HD1 2.210 . 2.620 2.109 2.109 2.109 . 0 0 "[ ]" 1
474 1 33 TRP HA 1 33 TRP HE1 3.650 . 5.500 4.629 4.629 4.629 . 0 0 "[ ]" 1
475 1 33 TRP HA 1 34 ARG H 2.485 . 3.170 2.219 2.219 2.219 . 0 0 "[ ]" 1
476 1 33 TRP HB2 1 33 TRP HE3 2.505 . 3.210 3.404 3.404 3.404 0.194 1 0 "[ ]" 1
477 1 33 TRP HB2 1 34 ARG H 3.060 . 4.320 4.155 4.155 4.155 . 0 0 "[ ]" 1
478 1 33 TRP HB3 1 33 TRP HD1 2.765 . 3.730 3.818 3.818 3.818 0.088 1 0 "[ ]" 1
479 1 33 TRP HB3 1 34 ARG H 3.650 . 5.500 3.966 3.966 3.966 . 0 0 "[ ]" 1
480 1 33 TRP HD1 1 34 ARG H 2.830 . 3.860 2.015 2.015 2.015 . 0 0 "[ ]" 1
481 1 33 TRP HE1 1 34 ARG H 3.650 . 5.500 3.741 3.741 3.741 . 0 0 "[ ]" 1
482 1 33 TRP HE1 1 35 ALA HA 3.030 . 4.260 3.725 3.725 3.725 . 0 0 "[ ]" 1
483 1 33 TRP HE1 1 36 ALA MB 4.165 . 6.530 5.430 5.430 5.430 . 0 0 "[ ]" 1
484 1 33 TRP HE1 1 43 ILE MD 4.100 . 6.400 4.253 4.253 4.253 . 0 0 "[ ]" 1
485 1 33 TRP HE1 1 43 ILE MG 4.165 . 6.530 4.886 4.886 4.886 . 0 0 "[ ]" 1
486 1 33 TRP HE1 1 45 VAL HA 3.650 . 5.500 5.512 5.512 5.512 0.012 1 0 "[ ]" 1
487 1 33 TRP HE3 1 132 CYS QB 3.115 . 4.430 4.009 4.009 4.009 . 0 0 "[ ]" 1
488 1 33 TRP HE3 1 143 GLY HA2 3.325 . 4.850 4.446 4.446 4.446 . 0 0 "[ ]" 1
489 1 33 TRP HE3 1 143 GLY HA3 3.325 . 4.850 3.481 3.481 3.481 . 0 0 "[ ]" 1
490 1 33 TRP HE3 1 144 LEU H 3.650 . 5.500 2.582 2.582 2.582 . 0 0 "[ ]" 1
491 1 33 TRP HE3 1 144 LEU HB2 3.650 . 5.500 1.977 1.977 1.977 . 0 0 "[ ]" 1
492 1 33 TRP HE3 1 144 LEU QB 3.560 . 5.320 1.969 1.969 1.969 . 0 0 "[ ]" 1
493 1 33 TRP HE3 1 144 LEU HB3 3.650 . 5.500 3.719 3.719 3.719 . 0 0 "[ ]" 1
494 1 33 TRP HE3 1 144 LEU MD1 4.085 . 6.370 2.382 2.382 2.382 . 0 0 "[ ]" 1
495 1 33 TRP HE3 1 144 LEU QD 3.500 . 5.200 2.301 2.301 2.301 . 0 0 "[ ]" 1
496 1 33 TRP HE3 1 144 LEU MD2 4.085 . 6.370 3.037 3.037 3.037 . 0 0 "[ ]" 1
497 1 33 TRP HE3 1 144 LEU HG 3.650 . 5.500 4.598 4.598 4.598 . 0 0 "[ ]" 1
498 1 33 TRP HH2 1 43 ILE HA 3.650 . 5.500 3.921 3.921 3.921 . 0 0 "[ ]" 1
499 1 33 TRP HH2 1 43 ILE MD 3.650 . 5.500 2.778 2.778 2.778 . 0 0 "[ ]" 1
500 1 33 TRP HH2 1 43 ILE MG 4.165 . 6.530 3.815 3.815 3.815 . 0 0 "[ ]" 1
501 1 33 TRP HH2 1 44 SER H 3.650 . 5.500 3.409 3.409 3.409 . 0 0 "[ ]" 1
502 1 33 TRP HH2 1 44 SER HA 2.625 . 3.450 3.066 3.066 3.066 . 0 0 "[ ]" 1
503 1 33 TRP HH2 1 45 VAL H 3.400 . 5.000 4.021 4.021 4.021 . 0 0 "[ ]" 1
504 1 33 TRP HH2 1 45 VAL HB 3.620 . 5.440 3.571 3.571 3.571 . 0 0 "[ ]" 1
505 1 33 TRP HH2 1 45 VAL MG1 3.435 . 5.070 3.230 3.230 3.230 . 0 0 "[ ]" 1
506 1 33 TRP HH2 1 132 CYS H 3.650 . 5.500 2.959 2.959 2.959 . 0 0 "[ ]" 1
507 1 33 TRP HH2 1 144 LEU QD 4.405 . 7.010 4.497 4.497 4.497 . 0 0 "[ ]" 1
508 1 33 TRP HZ2 1 43 ILE HA 3.650 . 5.500 4.339 4.339 4.339 . 0 0 "[ ]" 1
509 1 33 TRP HZ2 1 43 ILE MD 3.050 . 4.300 3.125 3.125 3.125 . 0 0 "[ ]" 1
510 1 33 TRP HZ2 1 43 ILE MG 3.515 . 5.230 3.607 3.607 3.607 . 0 0 "[ ]" 1
511 1 33 TRP HZ2 1 44 SER H 3.650 . 5.500 3.448 3.448 3.448 . 0 0 "[ ]" 1
512 1 33 TRP HZ2 1 44 SER HA 3.635 . 5.470 4.466 4.466 4.466 . 0 0 "[ ]" 1
513 1 33 TRP HZ2 1 45 VAL HB 3.650 . 5.500 2.670 2.670 2.670 . 0 0 "[ ]" 1
514 1 33 TRP HZ2 1 45 VAL MG1 4.165 . 6.530 3.657 3.657 3.657 . 0 0 "[ ]" 1
515 1 33 TRP HZ3 1 43 ILE H 3.620 . 5.440 5.141 5.141 5.141 . 0 0 "[ ]" 1
516 1 33 TRP HZ3 1 43 ILE MD 3.650 . 5.500 2.462 2.462 2.462 . 0 0 "[ ]" 1
517 1 33 TRP HZ3 1 43 ILE MG 3.760 . 5.720 4.920 4.920 4.920 . 0 0 "[ ]" 1
518 1 33 TRP HZ3 1 130 ILE MG 4.115 . 6.430 3.312 3.312 3.312 . 0 0 "[ ]" 1
519 1 33 TRP HZ3 1 132 CYS HB2 3.650 . 5.500 2.524 2.524 2.524 . 0 0 "[ ]" 1
520 1 33 TRP HZ3 1 132 CYS QB 3.390 . 4.980 2.370 2.370 2.370 . 0 0 "[ ]" 1
521 1 33 TRP HZ3 1 132 CYS HB3 3.650 . 5.500 2.873 2.873 2.873 . 0 0 "[ ]" 1
522 1 33 TRP HZ3 1 144 LEU QD 4.500 . 7.200 2.533 2.533 2.533 . 0 0 "[ ]" 1
523 1 33 TRP HZ3 1 144 LEU HG 3.650 . 5.500 5.545 5.545 5.545 0.045 1 0 "[ ]" 1
524 1 33 TRP N 1 144 LEU O 2.850 2.700 3.000 2.893 2.893 2.893 . 0 0 "[ ]" 1
525 1 34 ARG H 1 34 ARG HD2 3.650 . 5.500 5.301 5.301 5.301 . 0 0 "[ ]" 1
526 1 34 ARG H 1 34 ARG QD 3.530 . 5.260 4.584 4.584 4.584 . 0 0 "[ ]" 1
527 1 34 ARG H 1 34 ARG HD3 3.650 . 5.500 5.016 5.016 5.016 . 0 0 "[ ]" 1
528 1 34 ARG H 1 34 ARG QG 4.090 . 6.380 2.999 2.999 2.999 . 0 0 "[ ]" 1
529 1 34 ARG H 1 43 ILE MD 4.165 . 6.530 5.072 5.072 5.072 . 0 0 "[ ]" 1
530 1 34 ARG HA 1 34 ARG HD2 3.650 . 5.500 4.879 4.879 4.879 . 0 0 "[ ]" 1
531 1 34 ARG HA 1 34 ARG HD3 3.650 . 5.500 4.438 4.438 4.438 . 0 0 "[ ]" 1
532 1 34 ARG HA 1 43 ILE MD 4.165 . 6.530 4.200 4.200 4.200 . 0 0 "[ ]" 1
533 1 34 ARG HA 1 143 GLY QA 2.910 . 4.020 3.306 3.306 3.306 . 0 0 "[ ]" 1
534 1 34 ARG HA 1 144 LEU H 3.030 . 4.260 4.320 4.320 4.320 0.060 1 0 "[ ]" 1
535 1 34 ARG QB 1 34 ARG QD 2.765 . 3.730 2.172 2.172 2.172 . 0 0 "[ ]" 1
536 1 34 ARG QB 1 34 ARG HE 4.010 . 6.220 2.762 2.762 2.762 . 0 0 "[ ]" 1
537 1 34 ARG QB 1 142 PHE H 3.405 . 5.010 3.878 3.878 3.878 . 0 0 "[ ]" 1
538 1 34 ARG HB2 1 142 PHE H 3.650 . 5.500 5.515 5.515 5.515 0.015 1 0 "[ ]" 1
539 1 34 ARG HB3 1 142 PHE H 3.650 . 5.500 3.963 3.963 3.963 . 0 0 "[ ]" 1
540 1 34 ARG QG 1 143 GLY H 4.090 . 6.380 4.429 4.429 4.429 . 0 0 "[ ]" 1
541 1 35 ALA H 1 43 ILE MD 3.825 . 5.850 3.309 3.309 3.309 . 0 0 "[ ]" 1
542 1 35 ALA H 1 43 ILE MG 4.165 . 6.530 3.675 3.675 3.675 . 0 0 "[ ]" 1
543 1 35 ALA H 1 141 PRO QB 4.090 . 6.380 3.202 3.202 3.202 . 0 0 "[ ]" 1
544 1 35 ALA H 1 142 PHE H 3.420 . 5.040 2.678 2.678 2.678 . 0 0 "[ ]" 1
545 1 35 ALA H 1 142 PHE QB 4.090 . 6.380 4.749 4.749 4.749 . 0 0 "[ ]" 1
546 1 35 ALA H 1 142 PHE O 1.900 . 2.000 1.999 1.999 1.999 . 0 0 "[ ]" 1
547 1 35 ALA HA 1 36 ALA MB 4.135 . 6.470 3.996 3.996 3.996 . 0 0 "[ ]" 1
548 1 35 ALA HA 1 37 LYS H 3.090 . 4.380 3.941 3.941 3.941 . 0 0 "[ ]" 1
549 1 35 ALA HA 1 43 ILE HB 3.525 . 5.250 3.994 3.994 3.994 . 0 0 "[ ]" 1
550 1 35 ALA HA 1 43 ILE MD 3.080 . 4.360 3.444 3.444 3.444 . 0 0 "[ ]" 1
551 1 35 ALA HA 1 43 ILE MG 3.125 . 4.450 2.625 2.625 2.625 . 0 0 "[ ]" 1
552 1 35 ALA MB 1 37 LYS H 2.985 . 4.170 2.539 2.539 2.539 . 0 0 "[ ]" 1
553 1 35 ALA MB 1 38 ALA HA 4.165 . 6.530 3.811 3.811 3.811 . 0 0 "[ ]" 1
554 1 35 ALA MB 1 43 ILE MD 3.685 . 5.570 2.680 2.680 2.680 . 0 0 "[ ]" 1
555 1 35 ALA MB 1 43 ILE MG 3.515 . 5.230 1.818 1.818 1.818 . 0 0 "[ ]" 1
556 1 35 ALA MB 1 141 PRO HA 3.095 . 4.390 3.381 3.381 3.381 . 0 0 "[ ]" 1
557 1 35 ALA MB 1 142 PHE H 3.185 . 4.570 2.913 2.913 2.913 . 0 0 "[ ]" 1
558 1 35 ALA N 1 142 PHE O 2.850 2.700 3.000 2.954 2.954 2.954 . 0 0 "[ ]" 1
559 1 36 ALA H 1 37 LYS H 2.520 . 3.240 2.768 2.768 2.768 . 0 0 "[ ]" 1
560 1 36 ALA H 1 43 ILE MG 3.435 . 5.070 3.820 3.820 3.820 . 0 0 "[ ]" 1
561 1 36 ALA HA 1 37 LYS H 2.625 . 3.450 3.482 3.482 3.482 0.032 1 0 "[ ]" 1
562 1 36 ALA MB 1 37 LYS H 3.030 . 4.260 2.941 2.941 2.941 . 0 0 "[ ]" 1
563 1 37 LYS H 1 37 LYS HB2 2.795 . 3.790 3.854 3.854 3.854 0.064 1 0 "[ ]" 1
564 1 37 LYS H 1 37 LYS HB3 2.795 . 3.790 3.342 3.342 3.342 . 0 0 "[ ]" 1
565 1 37 LYS H 1 37 LYS QD 4.090 . 6.380 3.650 3.650 3.650 . 0 0 "[ ]" 1
566 1 37 LYS H 1 37 LYS QG 3.160 . 4.520 1.979 1.979 1.979 . 0 0 "[ ]" 1
567 1 37 LYS H 1 38 ALA H 3.000 . 4.200 4.342 4.342 4.342 0.142 1 0 "[ ]" 1
568 1 37 LYS H 1 43 ILE MG 4.165 . 6.530 4.534 4.534 4.534 . 0 0 "[ ]" 1
569 1 37 LYS HA 1 38 ALA H 2.380 . 2.960 2.650 2.650 2.650 . 0 0 "[ ]" 1
570 1 37 LYS QB 1 38 ALA H 2.570 . 3.340 2.014 2.014 2.014 . 0 0 "[ ]" 1
571 1 37 LYS HB2 1 38 ALA H 2.690 . 3.580 2.025 2.025 2.025 . 0 0 "[ ]" 1
572 1 37 LYS HB3 1 38 ALA H 2.690 . 3.580 3.536 3.536 3.536 . 0 0 "[ ]" 1
573 1 37 LYS QG 1 38 ALA H 4.090 . 6.380 3.119 3.119 3.119 . 0 0 "[ ]" 1
574 1 37 LYS QG 1 39 GLY H 4.090 . 6.380 5.348 5.348 5.348 . 0 0 "[ ]" 1
575 1 38 ALA H 1 39 GLY H 3.200 . 4.600 4.420 4.420 4.420 . 0 0 "[ ]" 1
576 1 38 ALA HA 1 39 GLY H 2.455 . 3.110 2.774 2.774 2.774 . 0 0 "[ ]" 1
577 1 38 ALA HA 1 40 GLU H 2.675 . 3.550 3.673 3.673 3.673 0.123 1 0 "[ ]" 1
578 1 38 ALA HA 1 140 SER HA 3.370 . 4.940 4.565 4.565 4.565 . 0 0 "[ ]" 1
579 1 38 ALA HA 1 141 PRO HA 2.330 . 2.860 2.134 2.134 2.134 . 0 0 "[ ]" 1
580 1 38 ALA HA 1 141 PRO QB 3.330 . 4.860 2.855 2.855 2.855 . 0 0 "[ ]" 1
581 1 38 ALA HA 1 141 PRO QG 3.285 . 4.770 4.261 4.261 4.261 . 0 0 "[ ]" 1
582 1 38 ALA MB 1 40 GLU H 3.465 . 5.130 4.013 4.013 4.013 . 0 0 "[ ]" 1
583 1 38 ALA MB 1 140 SER HA 3.000 . 4.200 3.030 3.030 3.030 . 0 0 "[ ]" 1
584 1 38 ALA MB 1 141 PRO HA 3.185 . 4.570 3.421 3.421 3.421 . 0 0 "[ ]" 1
585 1 38 ALA MB 1 141 PRO QB 3.625 . 5.450 3.688 3.688 3.688 . 0 0 "[ ]" 1
586 1 38 ALA MB 1 141 PRO QG 4.525 . 7.250 4.026 4.026 4.026 . 0 0 "[ ]" 1
587 1 39 GLY H 1 40 GLU H 2.565 . 3.330 2.604 2.604 2.604 . 0 0 "[ ]" 1
588 1 39 GLY H 1 139 ASP H 3.045 . 4.290 3.778 3.778 3.778 . 0 0 "[ ]" 1
589 1 39 GLY H 1 140 SER H 3.280 . 4.760 4.294 4.294 4.294 . 0 0 "[ ]" 1
590 1 39 GLY H 1 141 PRO QB 3.980 . 6.160 5.397 5.397 5.397 . 0 0 "[ ]" 1
591 1 39 GLY QA 1 137 SER H 3.220 . 4.640 3.858 3.858 3.858 . 0 0 "[ ]" 1
592 1 39 GLY HA2 1 138 LYS HA 2.380 . 2.960 1.964 1.964 1.964 . 0 0 "[ ]" 1
593 1 39 GLY HA3 1 138 LYS HA 2.380 . 2.960 2.852 2.852 2.852 . 0 0 "[ ]" 1
594 1 40 GLU H 1 40 GLU HB2 2.690 . 3.580 2.324 2.324 2.324 . 0 0 "[ ]" 1
595 1 40 GLU H 1 40 GLU HG2 3.540 . 5.280 3.923 3.923 3.923 . 0 0 "[ ]" 1
596 1 40 GLU H 1 40 GLU QG 3.225 . 4.650 3.186 3.186 3.186 . 0 0 "[ ]" 1
597 1 40 GLU H 1 40 GLU HG3 3.540 . 5.280 3.370 3.370 3.370 . 0 0 "[ ]" 1
598 1 40 GLU H 1 41 LYS H 2.845 . 3.890 4.114 4.114 4.114 0.224 1 0 "[ ]" 1
599 1 40 GLU H 1 136 TYR HD1 3.650 . 5.500 4.823 4.823 4.823 . 0 0 "[ ]" 1
600 1 40 GLU H 1 136 TYR HE1 3.650 . 5.500 4.662 4.662 4.662 . 0 0 "[ ]" 1
601 1 40 GLU H 1 141 PRO QB 4.090 . 6.380 5.615 5.615 5.615 . 0 0 "[ ]" 1
602 1 40 GLU HA 1 41 LYS H 2.380 . 2.960 2.270 2.270 2.270 . 0 0 "[ ]" 1
603 1 40 GLU QG 1 41 LYS H 3.420 . 5.040 4.223 4.223 4.223 . 0 0 "[ ]" 1
604 1 40 GLU QG 1 137 SER H 3.440 . 5.080 4.673 4.673 4.673 . 0 0 "[ ]" 1
605 1 40 GLU QG 1 142 PHE H 3.160 . 4.520 2.519 2.519 2.519 . 0 0 "[ ]" 1
606 1 40 GLU QG 1 143 GLY H 3.610 . 5.420 4.182 4.182 4.182 . 0 0 "[ ]" 1
607 1 40 GLU HG2 1 41 LYS H 3.650 . 5.500 5.581 5.581 5.581 0.081 1 0 "[ ]" 1
608 1 40 GLU HG3 1 41 LYS H 3.650 . 5.500 4.372 4.372 4.372 . 0 0 "[ ]" 1
609 1 41 LYS H 1 41 LYS HB2 2.750 . 3.700 2.759 2.759 2.759 . 0 0 "[ ]" 1
610 1 41 LYS H 1 41 LYS HB3 2.750 . 3.700 2.610 2.610 2.610 . 0 0 "[ ]" 1
611 1 41 LYS H 1 41 LYS QD 4.090 . 6.380 4.604 4.604 4.604 . 0 0 "[ ]" 1
612 1 41 LYS H 1 41 LYS QG 3.745 . 5.690 4.043 4.043 4.043 . 0 0 "[ ]" 1
613 1 41 LYS H 1 42 THR H 2.595 . 3.390 2.280 2.280 2.280 . 0 0 "[ ]" 1
614 1 41 LYS QG 1 42 THR H 4.090 . 6.380 3.629 3.629 3.629 . 0 0 "[ ]" 1
615 1 41 LYS QG 1 42 THR HB 4.090 . 6.380 4.897 4.897 4.897 . 0 0 "[ ]" 1
616 1 41 LYS QG 1 134 GLN H 3.810 . 5.820 4.204 4.204 4.204 . 0 0 "[ ]" 1
617 1 42 THR HA 1 42 THR HB 2.225 . 2.650 2.595 2.595 2.595 . 0 0 "[ ]" 1
618 1 42 THR HA 1 42 THR MG 2.705 . 3.610 2.102 2.102 2.102 . 0 0 "[ ]" 1
619 1 42 THR HA 1 43 ILE H 2.380 . 2.960 2.203 2.203 2.203 . 0 0 "[ ]" 1
620 1 42 THR HA 1 43 ILE MG 3.980 . 6.160 4.126 4.126 4.126 . 0 0 "[ ]" 1
621 1 42 THR HA 1 131 VAL MG1 3.530 . 5.260 4.315 4.315 4.315 . 0 0 "[ ]" 1
622 1 42 THR HA 1 133 SER HA 2.175 . 2.550 2.340 2.340 2.340 . 0 0 "[ ]" 1
623 1 42 THR HA 1 134 GLN H 2.765 . 3.730 3.393 3.393 3.393 . 0 0 "[ ]" 1
624 1 42 THR HA 1 136 TYR QE 4.220 . 6.640 5.682 5.682 5.682 . 0 0 "[ ]" 1
625 1 42 THR HB 1 131 VAL MG1 2.985 . 4.170 3.577 3.577 3.577 . 0 0 "[ ]" 1
626 1 42 THR HB 1 133 SER HA 3.140 . 4.480 4.066 4.066 4.066 . 0 0 "[ ]" 1
627 1 42 THR MG 1 43 ILE H 3.390 . 4.980 3.881 3.881 3.881 . 0 0 "[ ]" 1
628 1 42 THR MG 1 133 SER HA 3.140 . 4.480 2.156 2.156 2.156 . 0 0 "[ ]" 1
629 1 42 THR MG 1 133 SER HB2 3.280 . 4.760 3.640 3.640 3.640 . 0 0 "[ ]" 1
630 1 42 THR MG 1 133 SER QB 3.175 . 4.550 3.188 3.188 3.188 . 0 0 "[ ]" 1
631 1 42 THR MG 1 133 SER HB3 3.280 . 4.760 3.523 3.523 3.523 . 0 0 "[ ]" 1
632 1 43 ILE H 1 43 ILE MD 3.745 . 5.690 3.772 3.772 3.772 . 0 0 "[ ]" 1
633 1 43 ILE H 1 43 ILE QG 3.080 . 4.360 2.015 2.015 2.015 . 0 0 "[ ]" 1
634 1 43 ILE H 1 132 CYS H 2.905 . 4.010 3.361 3.361 3.361 . 0 0 "[ ]" 1
635 1 43 ILE H 1 132 CYS QB 4.060 . 6.320 3.155 3.155 3.155 . 0 0 "[ ]" 1
636 1 43 ILE H 1 132 CYS O 1.900 . 2.000 2.105 2.105 2.105 0.105 1 0 "[ ]" 1
637 1 43 ILE H 1 133 SER HA 2.860 . 3.920 3.650 3.650 3.650 . 0 0 "[ ]" 1
638 1 43 ILE HA 1 43 ILE HB 2.255 . 2.710 2.562 2.562 2.562 . 0 0 "[ ]" 1
639 1 43 ILE HA 1 43 ILE MG 2.690 . 3.580 2.120 2.120 2.120 . 0 0 "[ ]" 1
640 1 43 ILE HA 1 44 SER H 2.640 . 3.480 2.268 2.268 2.268 . 0 0 "[ ]" 1
641 1 43 ILE HB 1 44 SER H 3.075 . 4.350 2.965 2.965 2.965 . 0 0 "[ ]" 1
642 1 43 ILE MD 1 44 SER H 4.165 . 6.530 4.769 4.769 4.769 . 0 0 "[ ]" 1
643 1 43 ILE MD 1 132 CYS H 4.165 . 6.530 3.926 3.926 3.926 . 0 0 "[ ]" 1
644 1 43 ILE MD 1 132 CYS HB2 4.165 . 6.530 3.216 3.216 3.216 . 0 0 "[ ]" 1
645 1 43 ILE MD 1 132 CYS QB 3.865 . 5.930 2.411 2.411 2.411 . 0 0 "[ ]" 1
646 1 43 ILE MD 1 132 CYS HB3 4.165 . 6.530 2.491 2.491 2.491 . 0 0 "[ ]" 1
647 1 43 ILE MD 1 142 PHE H 4.055 . 6.310 4.395 4.395 4.395 . 0 0 "[ ]" 1
648 1 43 ILE MD 1 143 GLY HA2 3.340 . 4.880 2.403 2.403 2.403 . 0 0 "[ ]" 1
649 1 43 ILE MD 1 143 GLY QA 3.225 . 4.650 2.162 2.162 2.162 . 0 0 "[ ]" 1
650 1 43 ILE MD 1 143 GLY HA3 3.340 . 4.880 2.453 2.453 2.453 . 0 0 "[ ]" 1
651 1 43 ILE MD 1 144 LEU H 4.100 . 6.400 3.673 3.673 3.673 . 0 0 "[ ]" 1
652 1 43 ILE QG 1 44 SER H 3.860 . 5.920 4.125 4.125 4.125 . 0 0 "[ ]" 1
653 1 43 ILE QG 1 132 CYS QB 3.205 . 4.610 1.840 1.840 1.840 . 0 0 "[ ]" 1
654 1 43 ILE HG12 1 132 CYS HB2 3.810 . 5.820 4.059 4.059 4.059 . 0 0 "[ ]" 1
655 1 43 ILE HG12 1 132 CYS HB3 3.810 . 5.820 2.345 2.345 2.345 . 0 0 "[ ]" 1
656 1 43 ILE HG13 1 132 CYS HB2 3.810 . 5.820 3.220 3.220 3.220 . 0 0 "[ ]" 1
657 1 43 ILE HG13 1 132 CYS HB3 3.810 . 5.820 1.942 1.942 1.942 . 0 0 "[ ]" 1
658 1 43 ILE MG 1 44 SER H 3.390 . 4.980 3.707 3.707 3.707 . 0 0 "[ ]" 1
659 1 43 ILE MG 1 142 PHE H 4.165 . 6.530 4.786 4.786 4.786 . 0 0 "[ ]" 1
660 1 43 ILE N 1 132 CYS O 2.850 2.700 3.000 3.000 3.000 3.000 0.000 1 0 "[ ]" 1
661 1 43 ILE O 1 132 CYS H 1.900 . 2.000 1.978 1.978 1.978 . 0 0 "[ ]" 1
662 1 43 ILE O 1 132 CYS N 2.850 2.700 3.000 2.764 2.764 2.764 . 0 0 "[ ]" 1
663 1 44 SER H 1 45 VAL H 3.420 . 5.040 4.486 4.486 4.486 . 0 0 "[ ]" 1
664 1 44 SER H 1 131 VAL HA 3.280 . 4.760 4.633 4.633 4.633 . 0 0 "[ ]" 1
665 1 44 SER HA 1 45 VAL H 2.380 . 2.960 2.278 2.278 2.278 . 0 0 "[ ]" 1
666 1 44 SER HA 1 45 VAL MG1 3.590 . 5.380 3.574 3.574 3.574 . 0 0 "[ ]" 1
667 1 44 SER HA 1 129 LYS QE 4.075 . 6.350 4.699 4.699 4.699 . 0 0 "[ ]" 1
668 1 44 SER HA 1 130 ILE H 3.650 . 5.500 5.183 5.183 5.183 . 0 0 "[ ]" 1
669 1 44 SER HA 1 131 VAL HA 2.285 . 2.770 1.935 1.935 1.935 . 0 0 "[ ]" 1
670 1 44 SER HA 1 131 VAL MG1 3.280 . 4.760 2.603 2.603 2.603 . 0 0 "[ ]" 1
671 1 44 SER HA 1 131 VAL MG2 3.170 . 4.540 2.416 2.416 2.416 . 0 0 "[ ]" 1
672 1 44 SER HA 1 132 CYS H 3.000 . 4.200 3.318 3.318 3.318 . 0 0 "[ ]" 1
673 1 44 SER QB 1 45 VAL HB 4.090 . 6.380 4.987 4.987 4.987 . 0 0 "[ ]" 1
674 1 44 SER QB 1 129 LYS QE 3.105 . 4.410 2.836 2.836 2.836 . 0 0 "[ ]" 1
675 1 44 SER QB 1 131 VAL HA 3.050 . 4.300 3.333 3.333 3.333 . 0 0 "[ ]" 1
676 1 44 SER QB 1 131 VAL HB 3.685 . 5.570 4.442 4.442 4.442 . 0 0 "[ ]" 1
677 1 44 SER QB 1 131 VAL MG1 3.355 . 4.910 2.713 2.713 2.713 . 0 0 "[ ]" 1
678 1 44 SER QB 1 131 VAL MG2 2.980 . 4.160 1.907 1.907 1.907 . 0 0 "[ ]" 1
679 1 44 SER HB2 1 45 VAL H 3.000 . 4.200 3.374 3.374 3.374 . 0 0 "[ ]" 1
680 1 44 SER HB2 1 129 LYS HE2 3.435 . 5.070 4.256 4.256 4.256 . 0 0 "[ ]" 1
681 1 44 SER HB2 1 129 LYS HE3 3.435 . 5.070 4.453 4.453 4.453 . 0 0 "[ ]" 1
682 1 44 SER HB2 1 131 VAL HA 3.185 . 4.570 4.650 4.650 4.650 0.080 1 0 "[ ]" 1
683 1 44 SER HB2 1 131 VAL MG1 3.450 . 5.100 4.010 4.010 4.010 . 0 0 "[ ]" 1
684 1 44 SER HB2 1 131 VAL MG2 3.110 . 4.420 3.358 3.358 3.358 . 0 0 "[ ]" 1
685 1 44 SER HB3 1 45 VAL H 3.000 . 4.200 3.148 3.148 3.148 . 0 0 "[ ]" 1
686 1 44 SER HB3 1 129 LYS HE2 3.435 . 5.070 3.026 3.026 3.026 . 0 0 "[ ]" 1
687 1 44 SER HB3 1 129 LYS HE3 3.435 . 5.070 3.820 3.820 3.820 . 0 0 "[ ]" 1
688 1 44 SER HB3 1 131 VAL HA 3.185 . 4.570 3.415 3.415 3.415 . 0 0 "[ ]" 1
689 1 44 SER HB3 1 131 VAL MG1 3.450 . 5.100 2.759 2.759 2.759 . 0 0 "[ ]" 1
690 1 44 SER HB3 1 131 VAL MG2 3.110 . 4.420 1.918 1.918 1.918 . 0 0 "[ ]" 1
691 1 45 VAL H 1 45 VAL MG1 3.205 . 4.610 2.254 2.254 2.254 . 0 0 "[ ]" 1
692 1 45 VAL H 1 130 ILE H 2.735 . 3.670 3.275 3.275 3.275 . 0 0 "[ ]" 1
693 1 45 VAL H 1 130 ILE HB 3.125 . 4.450 3.554 3.554 3.554 . 0 0 "[ ]" 1
694 1 45 VAL H 1 130 ILE MG 3.495 . 5.190 4.217 4.217 4.217 . 0 0 "[ ]" 1
695 1 45 VAL H 1 130 ILE O 1.900 . 2.000 1.782 1.782 1.782 0.018 1 0 "[ ]" 1
696 1 45 VAL H 1 131 VAL HA 2.610 . 3.420 3.230 3.230 3.230 . 0 0 "[ ]" 1
697 1 45 VAL H 1 131 VAL MG1 3.605 . 5.410 4.380 4.380 4.380 . 0 0 "[ ]" 1
698 1 45 VAL H 1 131 VAL MG2 3.495 . 5.190 2.869 2.869 2.869 . 0 0 "[ ]" 1
699 1 45 VAL HA 1 45 VAL HB 2.395 . 2.990 2.470 2.470 2.470 . 0 0 "[ ]" 1
700 1 45 VAL HA 1 45 VAL MG2 2.720 . 3.640 2.398 2.398 2.398 . 0 0 "[ ]" 1
701 1 45 VAL HA 1 46 VAL H 2.440 . 3.080 2.211 2.211 2.211 . 0 0 "[ ]" 1
702 1 45 VAL MG1 1 46 VAL H 4.025 . 6.250 4.156 4.156 4.156 . 0 0 "[ ]" 1
703 1 45 VAL MG1 1 47 LEU HG 3.030 . 4.260 3.223 3.223 3.223 . 0 0 "[ ]" 1
704 1 45 VAL MG1 1 130 ILE H 3.685 . 5.570 3.148 3.148 3.148 . 0 0 "[ ]" 1
705 1 45 VAL MG1 1 130 ILE HB 2.740 . 3.680 1.859 1.859 1.859 . 0 0 "[ ]" 1
706 1 45 VAL MG1 1 130 ILE MG 3.935 . 6.070 2.585 2.585 2.585 . 0 0 "[ ]" 1
707 1 45 VAL MG2 1 46 VAL H 3.205 . 4.610 3.199 3.199 3.199 . 0 0 "[ ]" 1
708 1 45 VAL MG2 1 130 ILE HB 3.250 . 4.700 3.881 3.881 3.881 . 0 0 "[ ]" 1
709 1 45 VAL N 1 130 ILE O 2.850 2.700 3.000 2.643 2.643 2.643 0.057 1 0 "[ ]" 1
710 1 45 VAL O 1 130 ILE H 1.900 . 2.000 2.017 2.017 2.017 0.017 1 0 "[ ]" 1
711 1 45 VAL O 1 130 ILE N 2.850 2.700 3.000 2.934 2.934 2.934 . 0 0 "[ ]" 1
712 1 46 VAL H 1 46 VAL HB 2.970 . 4.140 2.690 2.690 2.690 . 0 0 "[ ]" 1
713 1 46 VAL H 1 46 VAL MG1 3.125 . 4.450 3.821 3.821 3.821 . 0 0 "[ ]" 1
714 1 46 VAL HA 1 47 LEU H 2.365 . 2.930 2.154 2.154 2.154 . 0 0 "[ ]" 1
715 1 46 VAL HA 1 129 LYS HA 2.395 . 2.990 1.925 1.925 1.925 . 0 0 "[ ]" 1
716 1 46 VAL HB 1 47 LEU H 3.650 . 5.500 4.166 4.166 4.166 . 0 0 "[ ]" 1
717 1 46 VAL MG1 1 129 LYS HA 4.040 . 6.280 2.244 2.244 2.244 . 0 0 "[ ]" 1
718 1 46 VAL MG1 1 129 LYS QB 4.060 . 6.320 2.406 2.406 2.406 . 0 0 "[ ]" 1
719 1 46 VAL MG1 1 130 ILE H 3.375 . 4.950 3.995 3.995 3.995 . 0 0 "[ ]" 1
720 1 47 LEU H 1 47 LEU MD1 3.620 . 5.440 1.950 1.950 1.950 . 0 0 "[ ]" 1
721 1 47 LEU H 1 47 LEU QD 3.450 . 5.100 1.946 1.946 1.946 . 0 0 "[ ]" 1
722 1 47 LEU H 1 47 LEU MD2 3.620 . 5.440 3.995 3.995 3.995 . 0 0 "[ ]" 1
723 1 47 LEU H 1 47 LEU HG 3.185 . 4.570 2.719 2.719 2.719 . 0 0 "[ ]" 1
724 1 47 LEU H 1 128 VAL H 2.830 . 3.860 3.417 3.417 3.417 . 0 0 "[ ]" 1
725 1 47 LEU H 1 128 VAL MG1 3.405 . 5.010 2.224 2.224 2.224 . 0 0 "[ ]" 1
726 1 47 LEU H 1 128 VAL O 1.900 . 2.000 2.029 2.029 2.029 0.029 1 0 "[ ]" 1
727 1 47 LEU H 1 129 LYS HA 2.890 . 3.980 3.467 3.467 3.467 . 0 0 "[ ]" 1
728 1 47 LEU H 1 130 ILE H 3.280 . 4.760 3.600 3.600 3.600 . 0 0 "[ ]" 1
729 1 47 LEU HA 1 48 GLN H 2.535 . 3.270 2.306 2.306 2.306 . 0 0 "[ ]" 1
730 1 47 LEU QB 1 48 GLN H 3.375 . 4.950 2.772 2.772 2.772 . 0 0 "[ ]" 1
731 1 47 LEU QB 1 128 VAL MG1 3.340 . 4.880 2.328 2.328 2.328 . 0 0 "[ ]" 1
732 1 47 LEU HB2 1 128 VAL MG1 3.450 . 5.100 2.350 2.350 2.350 . 0 0 "[ ]" 1
733 1 47 LEU HB3 1 128 VAL MG1 3.450 . 5.100 3.774 3.774 3.774 . 0 0 "[ ]" 1
734 1 47 LEU QD 1 48 GLN H 4.005 . 6.210 4.125 4.125 4.125 . 0 0 "[ ]" 1
735 1 47 LEU QD 1 128 VAL H 4.005 . 6.210 4.271 4.271 4.271 . 0 0 "[ ]" 1
736 1 47 LEU QD 1 149 PHE QE 6.010 . 10.220 2.734 2.734 2.734 . 0 0 "[ ]" 1
737 1 47 LEU N 1 128 VAL O 2.850 2.700 3.000 2.758 2.758 2.758 . 0 0 "[ ]" 1
738 1 47 LEU O 1 128 VAL H 1.900 . 2.000 1.917 1.917 1.917 . 0 0 "[ ]" 1
739 1 47 LEU O 1 128 VAL N 2.850 2.700 3.000 2.844 2.844 2.844 . 0 0 "[ ]" 1
740 1 48 GLN H 1 48 GLN HG2 3.650 . 5.500 4.275 4.275 4.275 . 0 0 "[ ]" 1
741 1 48 GLN H 1 48 GLN HG3 3.650 . 5.500 4.553 4.553 4.553 . 0 0 "[ ]" 1
742 1 48 GLN HA 1 48 GLN HE22 3.245 . 4.690 4.711 4.711 4.711 0.021 1 0 "[ ]" 1
743 1 48 GLN HA 1 48 GLN HG2 2.830 . 3.860 2.023 2.023 2.023 . 0 0 "[ ]" 1
744 1 48 GLN HA 1 48 GLN QG 2.740 . 3.680 2.007 2.007 2.007 . 0 0 "[ ]" 1
745 1 48 GLN HA 1 48 GLN HG3 2.830 . 3.860 3.369 3.369 3.369 . 0 0 "[ ]" 1
746 1 48 GLN HA 1 49 LEU H 2.425 . 3.050 2.405 2.405 2.405 . 0 0 "[ ]" 1
747 1 48 GLN HA 1 127 ARG HA 2.410 . 3.020 2.286 2.286 2.286 . 0 0 "[ ]" 1
748 1 48 GLN HA 1 127 ARG QB 3.780 . 5.760 3.870 3.870 3.870 . 0 0 "[ ]" 1
749 1 48 GLN HA 1 128 VAL H 2.735 . 3.670 3.349 3.349 3.349 . 0 0 "[ ]" 1
750 1 48 GLN QB 1 48 GLN HE21 4.090 . 6.380 3.942 3.942 3.942 . 0 0 "[ ]" 1
751 1 48 GLN HE21 1 75 SER QB 4.090 . 6.380 3.229 3.229 3.229 . 0 0 "[ ]" 1
752 1 48 GLN HE21 1 127 ARG QD 4.090 . 6.380 3.966 3.966 3.966 . 0 0 "[ ]" 1
753 1 48 GLN HE22 1 49 LEU H 2.890 . 3.980 2.980 2.980 2.980 . 0 0 "[ ]" 1
754 1 48 GLN HE22 1 75 SER QB 4.090 . 6.380 4.169 4.169 4.169 . 0 0 "[ ]" 1
755 1 48 GLN QG 1 49 LEU H 3.920 . 6.040 2.693 2.693 2.693 . 0 0 "[ ]" 1
756 1 49 LEU H 1 49 LEU MD1 3.915 . 6.030 3.781 3.781 3.781 . 0 0 "[ ]" 1
757 1 49 LEU H 1 49 LEU QD 3.700 . 5.600 3.272 3.272 3.272 . 0 0 "[ ]" 1
758 1 49 LEU H 1 49 LEU MD2 3.915 . 6.030 3.583 3.583 3.583 . 0 0 "[ ]" 1
759 1 49 LEU H 1 50 GLU H 3.030 . 4.260 4.360 4.360 4.360 0.100 1 0 "[ ]" 1
760 1 49 LEU H 1 51 LYS H 3.170 . 4.540 4.602 4.602 4.602 0.062 1 0 "[ ]" 1
761 1 49 LEU H 1 126 ASP HA 3.125 . 4.450 3.807 3.807 3.807 . 0 0 "[ ]" 1
762 1 49 LEU H 1 126 ASP QB 4.090 . 6.380 3.480 3.480 3.480 . 0 0 "[ ]" 1
763 1 49 LEU H 1 126 ASP O 1.900 . 2.000 1.963 1.963 1.963 . 0 0 "[ ]" 1
764 1 49 LEU HA 1 50 GLU H 2.380 . 2.960 2.180 2.180 2.180 . 0 0 "[ ]" 1
765 1 49 LEU HA 1 51 LYS H 3.245 . 4.690 3.716 3.716 3.716 . 0 0 "[ ]" 1
766 1 49 LEU QB 1 126 ASP HA 2.740 . 3.680 1.975 1.975 1.975 . 0 0 "[ ]" 1
767 1 49 LEU QD 1 50 GLU H 4.420 . 7.040 3.669 3.669 3.669 . 0 0 "[ ]" 1
768 1 49 LEU QD 1 51 LYS H 4.250 . 6.700 3.961 3.961 3.961 . 0 0 "[ ]" 1
769 1 49 LEU QD 1 126 ASP HA 3.145 . 4.490 1.981 1.981 1.981 . 0 0 "[ ]" 1
770 1 49 LEU QD 1 126 ASP QB 4.770 . 7.740 3.527 3.527 3.527 . 0 0 "[ ]" 1
771 1 49 LEU MD1 1 126 ASP HA 3.730 . 5.660 1.984 1.984 1.984 . 0 0 "[ ]" 1
772 1 49 LEU MD2 1 126 ASP HA 3.730 . 5.660 4.210 4.210 4.210 . 0 0 "[ ]" 1
773 1 49 LEU HG 1 126 ASP HA 2.765 . 3.730 3.310 3.310 3.310 . 0 0 "[ ]" 1
774 1 49 LEU N 1 126 ASP O 2.850 2.700 3.000 2.848 2.848 2.848 . 0 0 "[ ]" 1
775 1 49 LEU O 1 51 LYS H 1.900 . 2.000 2.281 2.281 2.281 0.281 1 0 "[ ]" 1
776 1 49 LEU O 1 51 LYS N 2.850 2.700 3.000 2.587 2.587 2.587 0.113 1 0 "[ ]" 1
777 1 50 GLU H 1 50 GLU QG 3.485 . 5.170 3.993 3.993 3.993 . 0 0 "[ ]" 1
778 1 50 GLU H 1 51 LYS H 2.735 . 3.670 2.964 2.964 2.964 . 0 0 "[ ]" 1
779 1 50 GLU QG 1 51 LYS H 4.075 . 6.350 4.138 4.138 4.138 . 0 0 "[ ]" 1
780 1 51 LYS H 1 51 LYS QD 3.515 . 5.230 4.459 4.459 4.459 . 0 0 "[ ]" 1
781 1 51 LYS H 1 51 LYS QE 4.090 . 6.380 4.486 4.486 4.486 . 0 0 "[ ]" 1
782 1 51 LYS H 1 51 LYS HG2 3.230 . 4.660 3.088 3.088 3.088 . 0 0 "[ ]" 1
783 1 51 LYS H 1 51 LYS QG 2.960 . 4.120 2.444 2.444 2.444 . 0 0 "[ ]" 1
784 1 51 LYS H 1 51 LYS HG3 3.230 . 4.660 2.562 2.562 2.562 . 0 0 "[ ]" 1
785 1 51 LYS HA 1 52 GLU H 2.580 . 3.360 2.243 2.243 2.243 . 0 0 "[ ]" 1
786 1 51 LYS QE 1 54 GLN H 4.090 . 6.380 5.675 5.675 5.675 . 0 0 "[ ]" 1
787 1 51 LYS QG 1 52 GLU H 3.595 . 5.390 4.161 4.161 4.161 . 0 0 "[ ]" 1
788 1 51 LYS HG2 1 53 GLU HG2 3.650 . 5.500 4.137 4.137 4.137 . 0 0 "[ ]" 1
789 1 51 LYS HG2 1 53 GLU HG3 3.650 . 5.500 3.962 3.962 3.962 . 0 0 "[ ]" 1
790 1 51 LYS HG3 1 53 GLU HG2 3.650 . 5.500 2.893 2.893 2.893 . 0 0 "[ ]" 1
791 1 51 LYS HG3 1 53 GLU HG3 3.650 . 5.500 2.346 2.346 2.346 . 0 0 "[ ]" 1
792 1 52 GLU H 1 52 GLU HB2 2.210 . 2.620 2.402 2.402 2.402 . 0 0 "[ ]" 1
793 1 52 GLU H 1 52 GLU HB3 2.565 . 3.330 2.766 2.766 2.766 . 0 0 "[ ]" 1
794 1 52 GLU H 1 52 GLU HG2 3.260 . 4.720 4.536 4.536 4.536 . 0 0 "[ ]" 1
795 1 52 GLU H 1 52 GLU QG 3.145 . 4.490 3.952 3.952 3.952 . 0 0 "[ ]" 1
796 1 52 GLU H 1 52 GLU HG3 3.260 . 4.720 4.349 4.349 4.349 . 0 0 "[ ]" 1
797 1 52 GLU H 1 53 GLU H 3.015 . 4.230 4.383 4.383 4.383 0.153 1 0 "[ ]" 1
798 1 52 GLU H 1 126 ASP HA 3.420 . 5.040 4.882 4.882 4.882 . 0 0 "[ ]" 1
799 1 52 GLU HA 1 52 GLU HG2 2.610 . 3.420 2.745 2.745 2.745 . 0 0 "[ ]" 1
800 1 52 GLU HA 1 52 GLU QG 2.520 . 3.240 2.268 2.268 2.268 . 0 0 "[ ]" 1
801 1 52 GLU HA 1 52 GLU HG3 2.610 . 3.420 2.417 2.417 2.417 . 0 0 "[ ]" 1
802 1 52 GLU HA 1 53 GLU H 2.350 . 2.900 2.131 2.131 2.131 . 0 0 "[ ]" 1
803 1 52 GLU HA 1 125 TRP H 3.075 . 4.350 4.351 4.351 4.351 0.001 1 0 "[ ]" 1
804 1 52 GLU HA 1 126 ASP HA 2.315 . 2.830 2.592 2.592 2.592 . 0 0 "[ ]" 1
805 1 52 GLU HA 1 126 ASP HB2 2.505 . 3.210 3.222 3.222 3.222 0.012 1 0 "[ ]" 1
806 1 52 GLU HA 1 126 ASP QB 2.410 . 3.020 1.957 1.957 1.957 . 0 0 "[ ]" 1
807 1 52 GLU HA 1 126 ASP HB3 2.505 . 3.210 1.974 1.974 1.974 . 0 0 "[ ]" 1
808 1 52 GLU HB2 1 53 GLU H 3.650 . 5.500 4.484 4.484 4.484 . 0 0 "[ ]" 1
809 1 52 GLU HB3 1 53 GLU H 2.935 . 4.070 4.142 4.142 4.142 0.072 1 0 "[ ]" 1
810 1 52 GLU HB3 1 126 ASP HA 3.570 . 5.340 5.414 5.414 5.414 0.074 1 0 "[ ]" 1
811 1 52 GLU QG 1 124 ARG QB 3.020 . 4.240 2.164 2.164 2.164 . 0 0 "[ ]" 1
812 1 52 GLU QG 1 124 ARG QD 4.525 . 7.250 4.105 4.105 4.105 . 0 0 "[ ]" 1
813 1 52 GLU QG 1 126 ASP HA 3.120 . 4.440 3.383 3.383 3.383 . 0 0 "[ ]" 1
814 1 52 GLU QG 1 126 ASP QB 3.160 . 4.520 1.964 1.964 1.964 . 0 0 "[ ]" 1
815 1 52 GLU HG2 1 124 ARG HA 3.650 . 5.500 3.668 3.668 3.668 . 0 0 "[ ]" 1
816 1 52 GLU HG2 1 124 ARG HB2 3.420 . 5.040 3.484 3.484 3.484 . 0 0 "[ ]" 1
817 1 52 GLU HG2 1 124 ARG HB3 3.420 . 5.040 2.199 2.199 2.199 . 0 0 "[ ]" 1
818 1 52 GLU HG2 1 126 ASP HA 3.340 . 4.880 4.557 4.557 4.557 . 0 0 "[ ]" 1
819 1 52 GLU HG2 1 126 ASP HB2 3.670 . 5.540 5.144 5.144 5.144 . 0 0 "[ ]" 1
820 1 52 GLU HG2 1 126 ASP HB3 3.670 . 5.540 3.401 3.401 3.401 . 0 0 "[ ]" 1
821 1 52 GLU HG3 1 124 ARG HA 3.650 . 5.500 5.118 5.118 5.118 . 0 0 "[ ]" 1
822 1 52 GLU HG3 1 124 ARG HB2 3.420 . 5.040 5.051 5.051 5.051 0.011 1 0 "[ ]" 1
823 1 52 GLU HG3 1 124 ARG HB3 3.420 . 5.040 3.952 3.952 3.952 . 0 0 "[ ]" 1
824 1 52 GLU HG3 1 126 ASP HA 3.340 . 4.880 3.488 3.488 3.488 . 0 0 "[ ]" 1
825 1 52 GLU HG3 1 126 ASP HB2 3.670 . 5.540 3.674 3.674 3.674 . 0 0 "[ ]" 1
826 1 52 GLU HG3 1 126 ASP HB3 3.670 . 5.540 1.985 1.985 1.985 . 0 0 "[ ]" 1
827 1 53 GLU H 1 53 GLU HB3 2.935 . 4.070 3.777 3.777 3.777 . 0 0 "[ ]" 1
828 1 53 GLU H 1 53 GLU HG2 3.650 . 5.500 3.929 3.929 3.929 . 0 0 "[ ]" 1
829 1 53 GLU H 1 53 GLU QG 3.510 . 5.220 2.671 2.671 2.671 . 0 0 "[ ]" 1
830 1 53 GLU H 1 53 GLU HG3 3.650 . 5.500 2.718 2.718 2.718 . 0 0 "[ ]" 1
831 1 53 GLU H 1 54 GLN H 3.045 . 4.290 4.392 4.392 4.392 0.102 1 0 "[ ]" 1
832 1 53 GLU H 1 124 ARG HA 2.955 . 4.110 3.950 3.950 3.950 . 0 0 "[ ]" 1
833 1 53 GLU H 1 124 ARG QB 4.090 . 6.380 3.952 3.952 3.952 . 0 0 "[ ]" 1
834 1 53 GLU H 1 125 TRP H 2.735 . 3.670 3.172 3.172 3.172 . 0 0 "[ ]" 1
835 1 53 GLU H 1 125 TRP O 1.900 . 2.000 2.033 2.033 2.033 0.033 1 0 "[ ]" 1
836 1 53 GLU H 1 126 ASP HA 2.815 . 3.830 3.540 3.540 3.540 . 0 0 "[ ]" 1
837 1 53 GLU H 1 126 ASP QB 3.965 . 6.130 3.852 3.852 3.852 . 0 0 "[ ]" 1
838 1 53 GLU HA 1 54 GLN H 2.365 . 2.930 2.571 2.571 2.571 . 0 0 "[ ]" 1
839 1 53 GLU HA 1 124 ARG QD 3.315 . 4.830 3.504 3.504 3.504 . 0 0 "[ ]" 1
840 1 53 GLU HA 1 124 ARG HG2 3.215 . 4.630 2.237 2.237 2.237 . 0 0 "[ ]" 1
841 1 53 GLU HA 1 124 ARG QG 3.080 . 4.360 2.225 2.225 2.225 . 0 0 "[ ]" 1
842 1 53 GLU HA 1 124 ARG HG3 3.215 . 4.630 3.969 3.969 3.969 . 0 0 "[ ]" 1
843 1 53 GLU HB2 1 54 GLN H 2.765 . 3.730 2.206 2.206 2.206 . 0 0 "[ ]" 1
844 1 53 GLU HB3 1 54 GLN H 3.140 . 4.480 3.157 3.157 3.157 . 0 0 "[ ]" 1
845 1 53 GLU QG 1 54 GLN H 3.525 . 5.250 4.208 4.208 4.208 . 0 0 "[ ]" 1
846 1 53 GLU HG2 1 54 GLN H 3.650 . 5.500 4.634 4.634 4.634 . 0 0 "[ ]" 1
847 1 53 GLU HG3 1 54 GLN H 3.650 . 5.500 4.827 4.827 4.827 . 0 0 "[ ]" 1
848 1 53 GLU N 1 125 TRP O 2.850 2.700 3.000 2.858 2.858 2.858 . 0 0 "[ ]" 1
849 1 53 GLU O 1 125 TRP H 1.900 . 2.000 1.808 1.808 1.808 . 0 0 "[ ]" 1
850 1 53 GLU O 1 125 TRP N 2.850 2.700 3.000 2.717 2.717 2.717 . 0 0 "[ ]" 1
851 1 54 GLN H 1 54 GLN HB2 2.905 . 4.010 2.498 2.498 2.498 . 0 0 "[ ]" 1
852 1 54 GLN H 1 54 GLN HB3 2.920 . 4.040 3.653 3.653 3.653 . 0 0 "[ ]" 1
853 1 54 GLN H 1 54 GLN HE21 3.650 . 5.500 4.743 4.743 4.743 . 0 0 "[ ]" 1
854 1 54 GLN H 1 54 GLN HG2 3.650 . 5.500 3.731 3.731 3.731 . 0 0 "[ ]" 1
855 1 54 GLN H 1 54 GLN HG3 3.650 . 5.500 2.338 2.338 2.338 . 0 0 "[ ]" 1
856 1 54 GLN H 1 55 ILE H 3.650 . 5.500 4.515 4.515 4.515 . 0 0 "[ ]" 1
857 1 54 GLN H 1 55 ILE MD 4.165 . 6.530 4.566 4.566 4.566 . 0 0 "[ ]" 1
858 1 54 GLN H 1 124 ARG HA 3.370 . 4.940 3.470 3.470 3.470 . 0 0 "[ ]" 1
859 1 54 GLN H 1 124 ARG QG 3.750 . 5.700 3.057 3.057 3.057 . 0 0 "[ ]" 1
860 1 54 GLN H 1 125 TRP H 3.480 . 5.160 4.536 4.536 4.536 . 0 0 "[ ]" 1
861 1 54 GLN HA 1 54 GLN HG2 2.455 . 3.110 2.666 2.666 2.666 . 0 0 "[ ]" 1
862 1 54 GLN HA 1 54 GLN QG 2.340 . 2.880 2.448 2.448 2.448 . 0 0 "[ ]" 1
863 1 54 GLN HA 1 54 GLN HG3 2.455 . 3.110 2.850 2.850 2.850 . 0 0 "[ ]" 1
864 1 54 GLN HA 1 55 ILE H 2.485 . 3.170 2.700 2.700 2.700 . 0 0 "[ ]" 1
865 1 54 GLN HA 1 124 ARG HA 2.210 . 2.620 2.630 2.630 2.630 0.010 1 0 "[ ]" 1
866 1 54 GLN HA 1 124 ARG QG 3.035 . 4.270 3.888 3.888 3.888 . 0 0 "[ ]" 1
867 1 54 GLN HA 1 125 TRP H 2.610 . 3.420 3.020 3.020 3.020 . 0 0 "[ ]" 1
868 1 54 GLN HB2 1 54 GLN HE21 3.650 . 5.500 2.484 2.484 2.484 . 0 0 "[ ]" 1
869 1 54 GLN HB3 1 54 GLN HE21 3.650 . 5.500 2.133 2.133 2.133 . 0 0 "[ ]" 1
870 1 54 GLN HB3 1 124 ARG H 3.650 . 5.500 5.574 5.574 5.574 0.074 1 0 "[ ]" 1
871 1 54 GLN HE21 1 121 ALA MB 4.165 . 6.530 5.067 5.067 5.067 . 0 0 "[ ]" 1
872 1 54 GLN HE21 1 122 GLU H 3.650 . 5.500 4.900 4.900 4.900 . 0 0 "[ ]" 1
873 1 54 GLN HE21 1 122 GLU HA 2.955 . 4.110 1.987 1.987 1.987 . 0 0 "[ ]" 1
874 1 54 GLN HE22 1 122 GLU HA 3.110 . 4.420 3.243 3.243 3.243 . 0 0 "[ ]" 1
875 1 54 GLN QG 1 122 GLU HA 2.905 . 4.010 2.988 2.988 2.988 . 0 0 "[ ]" 1
876 1 54 GLN QG 1 124 ARG HA 2.900 . 4.000 2.629 2.629 2.629 . 0 0 "[ ]" 1
877 1 54 GLN QG 1 124 ARG QG 3.465 . 5.130 2.154 2.154 2.154 . 0 0 "[ ]" 1
878 1 54 GLN HG2 1 55 ILE H 3.650 . 5.500 4.067 4.067 4.067 . 0 0 "[ ]" 1
879 1 54 GLN HG2 1 122 GLU HA 3.045 . 4.290 3.039 3.039 3.039 . 0 0 "[ ]" 1
880 1 54 GLN HG2 1 124 ARG HA 3.015 . 4.230 3.155 3.155 3.155 . 0 0 "[ ]" 1
881 1 54 GLN HG2 1 124 ARG HG2 4.075 . 6.350 3.787 3.787 3.787 . 0 0 "[ ]" 1
882 1 54 GLN HG2 1 124 ARG HG3 4.075 . 6.350 3.111 3.111 3.111 . 0 0 "[ ]" 1
883 1 54 GLN HG3 1 55 ILE H 3.650 . 5.500 4.652 4.652 4.652 . 0 0 "[ ]" 1
884 1 54 GLN HG3 1 122 GLU HA 3.045 . 4.290 4.412 4.412 4.412 0.122 1 0 "[ ]" 1
885 1 54 GLN HG3 1 124 ARG HA 3.015 . 4.230 2.814 2.814 2.814 . 0 0 "[ ]" 1
886 1 54 GLN HG3 1 124 ARG HG2 4.075 . 6.350 2.461 2.461 2.461 . 0 0 "[ ]" 1
887 1 54 GLN HG3 1 124 ARG HG3 4.075 . 6.350 2.501 2.501 2.501 . 0 0 "[ ]" 1
888 1 55 ILE H 1 55 ILE MD 3.730 . 5.660 2.672 2.672 2.672 . 0 0 "[ ]" 1
889 1 55 ILE H 1 55 ILE HG12 3.385 . 4.970 4.535 4.535 4.535 . 0 0 "[ ]" 1
890 1 55 ILE H 1 55 ILE HG13 3.385 . 4.970 3.524 3.524 3.524 . 0 0 "[ ]" 1
891 1 55 ILE H 1 121 ALA O 1.900 . 2.000 1.932 1.932 1.932 . 0 0 "[ ]" 1
892 1 55 ILE H 1 125 TRP HD1 3.650 . 5.500 4.378 4.378 4.378 . 0 0 "[ ]" 1
893 1 55 ILE HA 1 55 ILE MD 3.250 . 4.700 3.479 3.479 3.479 . 0 0 "[ ]" 1
894 1 55 ILE HA 1 55 ILE QG 2.810 . 3.820 2.331 2.331 2.331 . 0 0 "[ ]" 1
895 1 55 ILE HA 1 56 HIS H 2.470 . 3.140 2.167 2.167 2.167 . 0 0 "[ ]" 1
896 1 55 ILE HA 1 151 SER HA 2.270 . 2.740 2.772 2.772 2.772 0.032 1 0 "[ ]" 1
897 1 55 ILE HB 1 55 ILE MD 2.675 . 3.550 2.014 2.014 2.014 . 0 0 "[ ]" 1
898 1 55 ILE HB 1 56 HIS H 3.650 . 5.500 4.270 4.270 4.270 . 0 0 "[ ]" 1
899 1 55 ILE HB 1 57 SER H 3.495 . 5.190 5.208 5.208 5.208 0.018 1 0 "[ ]" 1
900 1 55 ILE HB 1 125 TRP HD1 3.650 . 5.500 4.334 4.334 4.334 . 0 0 "[ ]" 1
901 1 55 ILE MD 1 56 HIS H 4.165 . 6.530 5.097 5.097 5.097 . 0 0 "[ ]" 1
902 1 55 ILE MD 1 72 VAL HA 4.085 . 6.370 4.464 4.464 4.464 . 0 0 "[ ]" 1
903 1 55 ILE MD 1 125 TRP H 3.760 . 5.720 3.110 3.110 3.110 . 0 0 "[ ]" 1
904 1 55 ILE MD 1 125 TRP HB2 3.110 . 4.420 2.370 2.370 2.370 . 0 0 "[ ]" 1
905 1 55 ILE MD 1 125 TRP HB3 3.205 . 4.610 3.747 3.747 3.747 . 0 0 "[ ]" 1
906 1 55 ILE MD 1 125 TRP HD1 2.925 . 4.050 1.962 1.962 1.962 . 0 0 "[ ]" 1
907 1 55 ILE MD 1 125 TRP HE1 3.980 . 6.160 3.709 3.709 3.709 . 0 0 "[ ]" 1
908 1 55 ILE MG 1 56 HIS H 3.545 . 5.290 2.840 2.840 2.840 . 0 0 "[ ]" 1
909 1 55 ILE MG 1 56 HIS HA 3.620 . 5.440 3.833 3.833 3.833 . 0 0 "[ ]" 1
910 1 55 ILE MG 1 57 SER H 3.340 . 4.880 2.876 2.876 2.876 . 0 0 "[ ]" 1
911 1 55 ILE MG 1 149 PHE HD1 2.970 . 4.140 3.371 3.371 3.371 . 0 0 "[ ]" 1
912 1 55 ILE N 1 121 ALA O 2.850 2.700 3.000 2.890 2.890 2.890 . 0 0 "[ ]" 1
913 1 56 HIS H 1 56 HIS HB3 2.955 . 4.110 2.651 2.651 2.651 . 0 0 "[ ]" 1
914 1 56 HIS H 1 57 SER H 2.565 . 3.330 1.983 1.983 1.983 . 0 0 "[ ]" 1
915 1 56 HIS H 1 151 SER HA 3.060 . 4.320 1.967 1.967 1.967 . 0 0 "[ ]" 1
916 1 56 HIS HA 1 56 HIS HB2 2.380 . 2.960 2.520 2.520 2.520 . 0 0 "[ ]" 1
917 1 56 HIS HA 1 56 HIS HD2 3.555 . 5.310 4.012 4.012 4.012 . 0 0 "[ ]" 1
918 1 56 HIS HA 1 57 SER H 2.690 . 3.580 3.514 3.514 3.514 . 0 0 "[ ]" 1
919 1 56 HIS HA 1 116 LEU QD 4.145 . 6.490 2.127 2.127 2.127 . 0 0 "[ ]" 1
920 1 56 HIS HB2 1 57 SER H 3.125 . 4.450 3.971 3.971 3.971 . 0 0 "[ ]" 1
921 1 56 HIS HB3 1 57 SER H 3.650 . 5.500 2.873 2.873 2.873 . 0 0 "[ ]" 1
922 1 56 HIS HB3 1 151 SER H 3.650 . 5.500 5.298 5.298 5.298 . 0 0 "[ ]" 1
923 1 56 HIS HD2 1 57 SER H 3.495 . 5.190 4.298 4.298 4.298 . 0 0 "[ ]" 1
924 1 57 SER H 1 58 VAL QG 4.510 . 7.220 3.727 3.727 3.727 . 0 0 "[ ]" 1
925 1 57 SER H 1 150 HIS H 2.660 . 3.520 3.622 3.622 3.622 0.102 1 0 "[ ]" 1
926 1 57 SER H 1 150 HIS HB2 3.170 . 4.540 4.497 4.497 4.497 . 0 0 "[ ]" 1
927 1 57 SER H 1 150 HIS O 1.900 . 2.000 2.033 2.033 2.033 0.033 1 0 "[ ]" 1
928 1 57 SER H 1 151 SER HA 3.140 . 4.480 3.272 3.272 3.272 . 0 0 "[ ]" 1
929 1 57 SER HA 1 57 SER HB2 2.395 . 2.990 2.997 2.997 2.997 0.007 1 0 "[ ]" 1
930 1 57 SER HA 1 57 SER HB3 2.395 . 2.990 2.655 2.655 2.655 . 0 0 "[ ]" 1
931 1 57 SER HA 1 58 VAL H 2.330 . 2.860 2.263 2.263 2.263 . 0 0 "[ ]" 1
932 1 57 SER HA 1 58 VAL HB 3.030 . 4.260 4.339 4.339 4.339 0.079 1 0 "[ ]" 1
933 1 57 SER HA 1 112 GLY H 3.045 . 4.290 4.225 4.225 4.225 . 0 0 "[ ]" 1
934 1 57 SER HA 1 112 GLY HA2 2.660 . 3.520 1.943 1.943 1.943 . 0 0 "[ ]" 1
935 1 57 SER HA 1 112 GLY QA 2.540 . 3.280 1.936 1.936 1.936 . 0 0 "[ ]" 1
936 1 57 SER HA 1 112 GLY HA3 2.660 . 3.520 3.671 3.671 3.671 0.151 1 0 "[ ]" 1
937 1 57 SER HA 1 113 PRO HD2 3.650 . 5.500 5.081 5.081 5.081 . 0 0 "[ ]" 1
938 1 57 SER HA 1 113 PRO HD3 3.340 . 4.880 4.096 4.096 4.096 . 0 0 "[ ]" 1
939 1 57 SER HA 1 116 LEU QD 3.570 . 5.340 3.036 3.036 3.036 . 0 0 "[ ]" 1
940 1 57 SER QB 1 58 VAL H 2.860 . 3.920 2.915 2.915 2.915 . 0 0 "[ ]" 1
941 1 57 SER QB 1 112 GLY QA 3.075 . 4.350 3.134 3.134 3.134 . 0 0 "[ ]" 1
942 1 57 SER QB 1 116 LEU QD 4.895 . 7.990 4.452 4.452 4.452 . 0 0 "[ ]" 1
943 1 57 SER QB 1 150 HIS H 4.090 . 6.380 4.251 4.251 4.251 . 0 0 "[ ]" 1
944 1 57 SER QB 1 151 SER H 4.090 . 6.380 5.543 5.543 5.543 . 0 0 "[ ]" 1
945 1 57 SER HB2 1 58 VAL H 2.985 . 4.170 4.168 4.168 4.168 . 0 0 "[ ]" 1
946 1 57 SER HB2 1 112 GLY HA2 3.610 . 5.420 3.973 3.973 3.973 . 0 0 "[ ]" 1
947 1 57 SER HB2 1 112 GLY HA3 3.610 . 5.420 5.442 5.442 5.442 0.022 1 0 "[ ]" 1
948 1 57 SER HB3 1 58 VAL H 2.985 . 4.170 2.977 2.977 2.977 . 0 0 "[ ]" 1
949 1 57 SER HB3 1 112 GLY HA2 3.610 . 5.420 3.369 3.369 3.369 . 0 0 "[ ]" 1
950 1 57 SER HB3 1 112 GLY HA3 3.610 . 5.420 4.831 4.831 4.831 . 0 0 "[ ]" 1
951 1 57 SER N 1 150 HIS O 2.850 2.700 3.000 2.921 2.921 2.921 . 0 0 "[ ]" 1
952 1 57 SER O 1 150 HIS H 1.900 . 2.000 2.049 2.049 2.049 0.049 1 0 "[ ]" 1
953 1 57 SER O 1 150 HIS N 2.850 2.700 3.000 2.865 2.865 2.865 . 0 0 "[ ]" 1
954 1 58 VAL H 1 58 VAL HB 2.815 . 3.830 2.565 2.565 2.565 . 0 0 "[ ]" 1
955 1 58 VAL H 1 111 PHE H 2.860 . 3.920 2.753 2.753 2.753 . 0 0 "[ ]" 1
956 1 58 VAL H 1 111 PHE QB 4.090 . 6.380 2.703 2.703 2.703 . 0 0 "[ ]" 1
957 1 58 VAL H 1 111 PHE HD1 3.650 . 5.500 3.804 3.804 3.804 . 0 0 "[ ]" 1
958 1 58 VAL H 1 111 PHE O 1.900 . 2.000 1.796 1.796 1.796 0.004 1 0 "[ ]" 1
959 1 58 VAL H 1 112 GLY QA 3.780 . 5.760 3.227 3.227 3.227 . 0 0 "[ ]" 1
960 1 58 VAL HA 1 59 ASP H 2.240 . 2.680 2.432 2.432 2.432 . 0 0 "[ ]" 1
961 1 58 VAL HA 1 149 PHE HD1 3.435 . 5.070 2.868 2.868 2.868 . 0 0 "[ ]" 1
962 1 58 VAL HA 1 150 HIS H 2.315 . 2.830 2.861 2.861 2.861 0.031 1 0 "[ ]" 1
963 1 58 VAL HA 1 150 HIS HD2 2.890 . 3.980 3.716 3.716 3.716 . 0 0 "[ ]" 1
964 1 58 VAL HB 1 59 ASP H 3.590 . 5.380 3.795 3.795 3.795 . 0 0 "[ ]" 1
965 1 58 VAL HB 1 111 PHE HD1 3.045 . 4.290 2.637 2.637 2.637 . 0 0 "[ ]" 1
966 1 58 VAL HB 1 111 PHE HE1 3.185 . 4.570 4.596 4.596 4.596 0.026 1 0 "[ ]" 1
967 1 58 VAL HB 1 112 GLY H 3.635 . 5.470 5.286 5.286 5.286 . 0 0 "[ ]" 1
968 1 58 VAL HB 1 149 PHE HA 3.650 . 5.500 4.822 4.822 4.822 . 0 0 "[ ]" 1
969 1 58 VAL HB 1 150 HIS H 3.650 . 5.500 5.507 5.507 5.507 0.007 1 0 "[ ]" 1
970 1 58 VAL QG 1 59 ASP H 3.920 . 6.040 1.893 1.893 1.893 . 0 0 "[ ]" 1
971 1 58 VAL QG 1 60 ILE H 4.680 . 7.560 4.023 4.023 4.023 . 0 0 "[ ]" 1
972 1 58 VAL QG 1 111 PHE H 4.140 . 6.480 3.674 3.674 3.674 . 0 0 "[ ]" 1
973 1 58 VAL QG 1 111 PHE HD1 4.385 . 6.970 2.439 2.439 2.439 . 0 0 "[ ]" 1
974 1 58 VAL QG 1 111 PHE HE1 4.605 . 7.410 3.144 3.144 3.144 . 0 0 "[ ]" 1
975 1 58 VAL QG 1 149 PHE HA 3.750 . 5.700 2.529 2.529 2.529 . 0 0 "[ ]" 1
976 1 58 VAL QG 1 149 PHE HB2 4.170 . 6.540 4.212 4.212 4.212 . 0 0 "[ ]" 1
977 1 58 VAL QG 1 149 PHE HD1 3.720 . 5.640 1.718 1.718 1.718 0.082 1 0 "[ ]" 1
978 1 58 VAL QG 1 149 PHE HE1 3.505 . 5.210 1.888 1.888 1.888 . 0 0 "[ ]" 1
979 1 58 VAL QG 1 150 HIS H 4.260 . 6.720 3.020 3.020 3.020 . 0 0 "[ ]" 1
980 1 58 VAL MG1 1 149 PHE HE1 3.900 . 6.000 1.917 1.917 1.917 . 0 0 "[ ]" 1
981 1 58 VAL MG2 1 149 PHE HE1 3.900 . 6.000 2.838 2.838 2.838 . 0 0 "[ ]" 1
982 1 58 VAL N 1 111 PHE O 2.850 2.700 3.000 2.726 2.726 2.726 . 0 0 "[ ]" 1
983 1 58 VAL O 1 111 PHE H 1.900 . 2.000 1.773 1.773 1.773 0.027 1 0 "[ ]" 1
984 1 58 VAL O 1 111 PHE N 2.850 2.700 3.000 2.746 2.746 2.746 . 0 0 "[ ]" 1
985 1 59 ASP H 1 60 ILE H 3.090 . 4.380 4.255 4.255 4.255 . 0 0 "[ ]" 1
986 1 59 ASP H 1 60 ILE QG 4.090 . 6.380 4.497 4.497 4.497 . 0 0 "[ ]" 1
987 1 59 ASP H 1 111 PHE HD1 3.650 . 5.500 4.023 4.023 4.023 . 0 0 "[ ]" 1
988 1 59 ASP H 1 111 PHE HE1 3.650 . 5.500 4.960 4.960 4.960 . 0 0 "[ ]" 1
989 1 59 ASP H 1 148 ARG H 2.795 . 3.790 3.360 3.360 3.360 . 0 0 "[ ]" 1
990 1 59 ASP H 1 148 ARG QG 3.685 . 5.570 4.966 4.966 4.966 . 0 0 "[ ]" 1
991 1 59 ASP H 1 148 ARG O 1.900 . 2.000 2.004 2.004 2.004 0.004 1 0 "[ ]" 1
992 1 59 ASP H 1 149 PHE HA 2.905 . 4.010 2.944 2.944 2.944 . 0 0 "[ ]" 1
993 1 59 ASP H 1 150 HIS HD2 3.400 . 5.000 3.999 3.999 3.999 . 0 0 "[ ]" 1
994 1 59 ASP HA 1 60 ILE H 2.255 . 2.710 2.216 2.216 2.216 . 0 0 "[ ]" 1
995 1 59 ASP HA 1 60 ILE QG 3.750 . 5.700 5.076 5.076 5.076 . 0 0 "[ ]" 1
996 1 59 ASP HA 1 110 MET HA 2.160 . 2.520 2.145 2.145 2.145 . 0 0 "[ ]" 1
997 1 59 ASP HA 1 110 MET QB 3.175 . 4.550 2.670 2.670 2.670 . 0 0 "[ ]" 1
998 1 59 ASP HA 1 110 MET HG2 3.060 . 4.320 2.290 2.290 2.290 . 0 0 "[ ]" 1
999 1 59 ASP HA 1 110 MET HG3 2.780 . 3.760 3.773 3.773 3.773 0.013 1 0 "[ ]" 1
1000 1 59 ASP HA 1 111 PHE H 2.675 . 3.550 3.277 3.277 3.277 . 0 0 "[ ]" 1
1001 1 59 ASP HA 1 111 PHE HD1 2.875 . 3.950 3.294 3.294 3.294 . 0 0 "[ ]" 1
1002 1 59 ASP HA 1 148 ARG QB 3.890 . 5.980 4.394 4.394 4.394 . 0 0 "[ ]" 1
1003 1 59 ASP QB 1 110 MET HA 4.090 . 6.380 4.315 4.315 4.315 . 0 0 "[ ]" 1
1004 1 59 ASP QB 1 146 PHE HE1 3.235 . 4.670 2.664 2.664 2.664 . 0 0 "[ ]" 1
1005 1 59 ASP QB 1 148 ARG H 3.560 . 5.320 3.459 3.459 3.459 . 0 0 "[ ]" 1
1006 1 59 ASP QB 1 148 ARG HE 3.825 . 5.850 3.439 3.439 3.439 . 0 0 "[ ]" 1
1007 1 59 ASP QB 1 148 ARG QG 2.970 . 4.140 3.143 3.143 3.143 . 0 0 "[ ]" 1
1008 1 59 ASP HB2 1 60 ILE H 3.435 . 5.070 4.449 4.449 4.449 . 0 0 "[ ]" 1
1009 1 59 ASP HB2 1 148 ARG H 3.650 . 5.500 3.833 3.833 3.833 . 0 0 "[ ]" 1
1010 1 59 ASP HB2 1 148 ARG HG2 3.470 . 5.140 4.920 4.920 4.920 . 0 0 "[ ]" 1
1011 1 59 ASP HB2 1 148 ARG HG3 3.470 . 5.140 3.923 3.923 3.923 . 0 0 "[ ]" 1
1012 1 59 ASP HB3 1 60 ILE H 3.435 . 5.070 3.462 3.462 3.462 . 0 0 "[ ]" 1
1013 1 59 ASP HB3 1 148 ARG H 3.650 . 5.500 3.938 3.938 3.938 . 0 0 "[ ]" 1
1014 1 59 ASP HB3 1 148 ARG HG2 3.470 . 5.140 4.919 4.919 4.919 . 0 0 "[ ]" 1
1015 1 59 ASP HB3 1 148 ARG HG3 3.470 . 5.140 3.423 3.423 3.423 . 0 0 "[ ]" 1
1016 1 59 ASP N 1 148 ARG O 2.850 2.700 3.000 2.960 2.960 2.960 . 0 0 "[ ]" 1
1017 1 59 ASP O 1 148 ARG H 1.900 . 2.000 1.706 1.706 1.706 0.094 1 0 "[ ]" 1
1018 1 59 ASP O 1 148 ARG N 2.850 2.700 3.000 2.600 2.600 2.600 0.100 1 0 "[ ]" 1
1019 1 60 ILE H 1 60 ILE HB 2.735 . 3.670 2.777 2.777 2.777 . 0 0 "[ ]" 1
1020 1 60 ILE H 1 60 ILE MD 3.650 . 5.500 3.003 3.003 3.003 . 0 0 "[ ]" 1
1021 1 60 ILE H 1 60 ILE HG12 3.510 . 5.220 4.916 4.916 4.916 . 0 0 "[ ]" 1
1022 1 60 ILE H 1 60 ILE QG 3.360 . 4.920 4.012 4.012 4.012 . 0 0 "[ ]" 1
1023 1 60 ILE H 1 60 ILE HG13 3.510 . 5.220 4.253 4.253 4.253 . 0 0 "[ ]" 1
1024 1 60 ILE H 1 61 GLY H 2.970 . 4.140 4.237 4.237 4.237 0.097 1 0 "[ ]" 1
1025 1 60 ILE H 1 108 VAL QG 4.945 . 8.090 5.155 5.155 5.155 . 0 0 "[ ]" 1
1026 1 60 ILE H 1 109 ARG O 1.900 . 2.000 2.043 2.043 2.043 0.043 1 0 "[ ]" 1
1027 1 60 ILE H 1 110 MET HA 2.610 . 3.420 2.561 2.561 2.561 . 0 0 "[ ]" 1
1028 1 60 ILE H 1 110 MET QB 4.045 . 6.290 4.157 4.157 4.157 . 0 0 "[ ]" 1
1029 1 60 ILE H 1 110 MET HG2 3.650 . 5.500 3.125 3.125 3.125 . 0 0 "[ ]" 1
1030 1 60 ILE H 1 111 PHE H 3.215 . 4.630 4.722 4.722 4.722 0.092 1 0 "[ ]" 1
1031 1 60 ILE H 1 146 PHE HE1 2.985 . 4.170 3.764 3.764 3.764 . 0 0 "[ ]" 1
1032 1 60 ILE H 1 146 PHE HZ 3.260 . 4.720 4.751 4.751 4.751 0.031 1 0 "[ ]" 1
1033 1 60 ILE H 1 147 VAL HA 3.340 . 4.880 4.950 4.950 4.950 0.070 1 0 "[ ]" 1
1034 1 60 ILE HA 1 61 GLY H 2.365 . 2.930 2.216 2.216 2.216 . 0 0 "[ ]" 1
1035 1 60 ILE HA 1 146 PHE H 3.400 . 5.000 4.681 4.681 4.681 . 0 0 "[ ]" 1
1036 1 60 ILE HA 1 146 PHE HE1 3.200 . 4.600 3.226 3.226 3.226 . 0 0 "[ ]" 1
1037 1 60 ILE HA 1 147 VAL HA 2.330 . 2.860 2.234 2.234 2.234 . 0 0 "[ ]" 1
1038 1 60 ILE HA 1 148 ARG H 2.970 . 4.140 3.179 3.179 3.179 . 0 0 "[ ]" 1
1039 1 60 ILE HB 1 61 GLY H 3.540 . 5.280 4.363 4.363 4.363 . 0 0 "[ ]" 1
1040 1 60 ILE HB 1 111 PHE HE1 2.470 . 3.140 1.916 1.916 1.916 . 0 0 "[ ]" 1
1041 1 60 ILE HB 1 111 PHE HZ 2.815 . 3.830 3.455 3.455 3.455 . 0 0 "[ ]" 1
1042 1 60 ILE MD 1 88 LEU QD 4.655 . 7.510 3.561 3.561 3.561 . 0 0 "[ ]" 1
1043 1 60 ILE MD 1 111 PHE HE1 2.690 . 3.580 2.421 2.421 2.421 . 0 0 "[ ]" 1
1044 1 60 ILE MD 1 111 PHE HZ 3.635 . 5.470 4.128 4.128 4.128 . 0 0 "[ ]" 1
1045 1 60 ILE MD 1 147 VAL HA 4.165 . 6.530 3.212 3.212 3.212 . 0 0 "[ ]" 1
1046 1 60 ILE MD 1 149 PHE H 4.165 . 6.530 5.287 5.287 5.287 . 0 0 "[ ]" 1
1047 1 60 ILE QG 1 61 GLY H 4.090 . 6.380 3.705 3.705 3.705 . 0 0 "[ ]" 1
1048 1 60 ILE QG 1 111 PHE HE1 3.330 . 4.860 3.834 3.834 3.834 . 0 0 "[ ]" 1
1049 1 60 ILE QG 1 147 VAL HA 3.920 . 6.040 1.950 1.950 1.950 . 0 0 "[ ]" 1
1050 1 60 ILE MG 1 61 GLY H 3.220 . 4.640 2.512 2.512 2.512 . 0 0 "[ ]" 1
1051 1 60 ILE MG 1 62 ASN H 4.165 . 6.530 4.205 4.205 4.205 . 0 0 "[ ]" 1
1052 1 60 ILE MG 1 62 ASN HA 3.310 . 4.820 3.806 3.806 3.806 . 0 0 "[ ]" 1
1053 1 60 ILE MG 1 109 ARG H 4.165 . 6.530 4.165 4.165 4.165 . 0 0 "[ ]" 1
1054 1 60 ILE MG 1 111 PHE HE1 3.065 . 4.330 3.427 3.427 3.427 . 0 0 "[ ]" 1
1055 1 60 ILE MG 1 111 PHE HZ 3.185 . 4.570 3.665 3.665 3.665 . 0 0 "[ ]" 1
1056 1 60 ILE MG 1 132 CYS QB 4.510 . 7.220 5.131 5.131 5.131 . 0 0 "[ ]" 1
1057 1 60 ILE MG 1 144 LEU MD1 4.195 . 6.590 3.252 3.252 3.252 . 0 0 "[ ]" 1
1058 1 60 ILE MG 1 144 LEU QD 3.760 . 5.720 1.663 1.663 1.663 0.137 1 0 "[ ]" 1
1059 1 60 ILE MG 1 144 LEU MD2 4.195 . 6.590 1.668 1.668 1.668 0.132 1 0 "[ ]" 1
1060 1 60 ILE MG 1 146 PHE H 3.745 . 5.690 4.049 4.049 4.049 . 0 0 "[ ]" 1
1061 1 60 ILE MG 1 147 VAL HA 4.165 . 6.530 3.652 3.652 3.652 . 0 0 "[ ]" 1
1062 1 60 ILE MG 1 148 ARG H 4.165 . 6.530 4.865 4.865 4.865 . 0 0 "[ ]" 1
1063 1 60 ILE N 1 109 ARG O 2.850 2.700 3.000 2.983 2.983 2.983 . 0 0 "[ ]" 1
1064 1 60 ILE O 1 109 ARG H 1.900 . 2.000 2.055 2.055 2.055 0.055 1 0 "[ ]" 1
1065 1 60 ILE O 1 109 ARG N 2.850 2.700 3.000 2.943 2.943 2.943 . 0 0 "[ ]" 1
1066 1 61 GLY H 1 62 ASN H 3.030 . 4.260 4.460 4.460 4.460 0.200 1 0 "[ ]" 1
1067 1 61 GLY H 1 108 VAL QG 4.570 . 7.340 4.121 4.121 4.121 . 0 0 "[ ]" 1
1068 1 61 GLY H 1 144 LEU QD 4.160 . 6.520 3.571 3.571 3.571 . 0 0 "[ ]" 1
1069 1 61 GLY H 1 146 PHE H 2.875 . 3.950 2.941 2.941 2.941 . 0 0 "[ ]" 1
1070 1 61 GLY H 1 146 PHE HD1 3.650 . 5.500 3.545 3.545 3.545 . 0 0 "[ ]" 1
1071 1 61 GLY H 1 146 PHE HD2 3.650 . 5.500 4.441 4.441 4.441 . 0 0 "[ ]" 1
1072 1 61 GLY H 1 146 PHE QE 4.710 . 7.620 3.327 3.327 3.327 . 0 0 "[ ]" 1
1073 1 61 GLY H 1 146 PHE HZ 3.340 . 4.880 3.869 3.869 3.869 . 0 0 "[ ]" 1
1074 1 61 GLY H 1 146 PHE O 1.900 . 2.000 2.072 2.072 2.072 0.072 1 0 "[ ]" 1
1075 1 61 GLY H 1 147 VAL HA 2.720 . 3.640 3.491 3.491 3.491 . 0 0 "[ ]" 1
1076 1 61 GLY H 1 147 VAL HB 3.650 . 5.500 5.589 5.589 5.589 0.089 1 0 "[ ]" 1
1077 1 61 GLY QA 1 108 VAL HB 4.090 . 6.380 2.218 2.218 2.218 . 0 0 "[ ]" 1
1078 1 61 GLY QA 1 108 VAL QG 2.910 . 4.020 1.916 1.916 1.916 . 0 0 "[ ]" 1
1079 1 61 GLY QA 1 146 PHE HD2 3.475 . 5.150 3.519 3.519 3.519 . 0 0 "[ ]" 1
1080 1 61 GLY HA2 1 108 VAL HA 2.410 . 3.020 1.793 1.793 1.793 0.007 1 0 "[ ]" 1
1081 1 61 GLY HA2 1 108 VAL MG1 3.250 . 4.700 2.579 2.579 2.579 . 0 0 "[ ]" 1
1082 1 61 GLY HA2 1 108 VAL MG2 3.250 . 4.700 3.895 3.895 3.895 . 0 0 "[ ]" 1
1083 1 61 GLY HA2 1 146 PHE HD2 3.650 . 5.500 5.294 5.294 5.294 . 0 0 "[ ]" 1
1084 1 61 GLY HA2 1 146 PHE HE2 3.245 . 4.690 3.830 3.830 3.830 . 0 0 "[ ]" 1
1085 1 61 GLY HA2 1 146 PHE HZ 3.590 . 5.380 3.258 3.258 3.258 . 0 0 "[ ]" 1
1086 1 61 GLY HA3 1 108 VAL HA 2.410 . 3.020 3.047 3.047 3.047 0.027 1 0 "[ ]" 1
1087 1 61 GLY HA3 1 108 VAL MG1 3.250 . 4.700 1.985 1.985 1.985 . 0 0 "[ ]" 1
1088 1 61 GLY HA3 1 108 VAL MG2 3.250 . 4.700 4.208 4.208 4.208 . 0 0 "[ ]" 1
1089 1 61 GLY HA3 1 146 PHE HD2 3.650 . 5.500 3.572 3.572 3.572 . 0 0 "[ ]" 1
1090 1 61 GLY HA3 1 146 PHE HE2 3.245 . 4.690 2.514 2.514 2.514 . 0 0 "[ ]" 1
1091 1 61 GLY HA3 1 146 PHE HZ 3.590 . 5.380 2.902 2.902 2.902 . 0 0 "[ ]" 1
1092 1 61 GLY N 1 146 PHE O 2.850 2.700 3.000 3.034 3.034 3.034 0.034 1 0 "[ ]" 1
1093 1 61 GLY O 1 145 SER H 1.900 . 2.000 2.013 2.013 2.013 0.013 1 0 "[ ]" 1
1094 1 61 GLY O 1 145 SER N 2.850 2.700 3.000 2.953 2.953 2.953 . 0 0 "[ ]" 1
1095 1 62 ASN H 1 108 VAL HA 2.690 . 3.580 1.910 1.910 1.910 . 0 0 "[ ]" 1
1096 1 62 ASN H 1 108 VAL HB 3.325 . 4.850 3.919 3.919 3.919 . 0 0 "[ ]" 1
1097 1 62 ASN H 1 108 VAL MG1 3.715 . 5.630 3.050 3.050 3.050 . 0 0 "[ ]" 1
1098 1 62 ASN H 1 108 VAL QG 3.490 . 5.180 3.012 3.012 3.012 . 0 0 "[ ]" 1
1099 1 62 ASN H 1 108 VAL MG2 3.715 . 5.630 4.675 4.675 4.675 . 0 0 "[ ]" 1
1100 1 62 ASN H 1 146 PHE HE2 3.400 . 5.000 5.061 5.061 5.061 0.061 1 0 "[ ]" 1
1101 1 62 ASN H 1 146 PHE HZ 3.650 . 5.500 5.208 5.208 5.208 . 0 0 "[ ]" 1
1102 1 62 ASN HA 1 63 ASP H 2.315 . 2.830 2.214 2.214 2.214 . 0 0 "[ ]" 1
1103 1 62 ASN HA 1 93 PHE HD2 3.155 . 4.510 4.613 4.613 4.613 0.103 1 0 "[ ]" 1
1104 1 62 ASN HA 1 144 LEU QD 3.430 . 5.060 3.050 3.050 3.050 . 0 0 "[ ]" 1
1105 1 62 ASN QB 1 93 PHE HD2 3.190 . 4.580 3.552 3.552 3.552 . 0 0 "[ ]" 1
1106 1 62 ASN QB 1 107 ARG H 4.090 . 6.380 2.520 2.520 2.520 . 0 0 "[ ]" 1
1107 1 62 ASN QB 1 144 LEU QD 5.265 . 8.730 4.104 4.104 4.104 . 0 0 "[ ]" 1
1108 1 63 ASP H 1 64 GLY H 2.705 . 3.610 3.622 3.622 3.622 0.012 1 0 "[ ]" 1
1109 1 63 ASP H 1 64 GLY QA 3.580 . 5.360 4.709 4.709 4.709 . 0 0 "[ ]" 1
1110 1 63 ASP H 1 65 SER H 2.795 . 3.790 2.946 2.946 2.946 . 0 0 "[ ]" 1
1111 1 63 ASP H 1 106 ASN HD22 3.650 . 5.500 4.933 4.933 4.933 . 0 0 "[ ]" 1
1112 1 63 ASP H 1 142 PHE QD 4.710 . 7.620 4.958 4.958 4.958 . 0 0 "[ ]" 1
1113 1 63 ASP H 1 143 GLY H 3.540 . 5.280 4.418 4.418 4.418 . 0 0 "[ ]" 1
1114 1 63 ASP H 1 143 GLY O 1.900 . 2.000 2.093 2.093 2.093 0.093 1 0 "[ ]" 1
1115 1 63 ASP H 1 145 SER H 2.860 . 3.920 3.295 3.295 3.295 . 0 0 "[ ]" 1
1116 1 63 ASP HA 1 64 GLY H 2.640 . 3.480 2.397 2.397 2.397 . 0 0 "[ ]" 1
1117 1 63 ASP HA 1 106 ASN HD21 2.690 . 3.580 3.375 3.375 3.375 . 0 0 "[ ]" 1
1118 1 63 ASP HA 1 106 ASN HD22 2.875 . 3.950 2.236 2.236 2.236 . 0 0 "[ ]" 1
1119 1 63 ASP N 1 143 GLY O 2.850 2.700 3.000 2.889 2.889 2.889 . 0 0 "[ ]" 1
1120 1 64 GLY H 1 94 MET ME 3.560 . 5.320 3.301 3.301 3.301 . 0 0 "[ ]" 1
1121 1 64 GLY H 1 106 ASN HA 3.200 . 4.600 2.586 2.586 2.586 . 0 0 "[ ]" 1
1122 1 64 GLY H 1 106 ASN QB 4.090 . 6.380 4.295 4.295 4.295 . 0 0 "[ ]" 1
1123 1 64 GLY H 1 106 ASN HD22 3.200 . 4.600 2.768 2.768 2.768 . 0 0 "[ ]" 1
1124 1 64 GLY H 1 142 PHE QD 4.710 . 7.620 4.762 4.762 4.762 . 0 0 "[ ]" 1
1125 1 64 GLY QA 1 94 MET ME 2.975 . 4.150 2.165 2.165 2.165 . 0 0 "[ ]" 1
1126 1 64 GLY HA2 1 94 MET ME 3.265 . 4.730 2.179 2.179 2.179 . 0 0 "[ ]" 1
1127 1 64 GLY HA3 1 94 MET ME 3.265 . 4.730 3.746 3.746 3.746 . 0 0 "[ ]" 1
1128 1 65 SER H 1 65 SER QB 2.860 . 3.920 2.925 2.925 2.925 . 0 0 "[ ]" 1
1129 1 65 SER H 1 94 MET ME 4.165 . 6.530 3.742 3.742 3.742 . 0 0 "[ ]" 1
1130 1 65 SER H 1 106 ASN HD21 3.650 . 5.500 5.252 5.252 5.252 . 0 0 "[ ]" 1
1131 1 65 SER H 1 106 ASN HD22 3.650 . 5.500 4.915 4.915 4.915 . 0 0 "[ ]" 1
1132 1 65 SER H 1 142 PHE QD 4.650 . 7.500 5.389 5.389 5.389 . 0 0 "[ ]" 1
1133 1 65 SER H 1 143 GLY H 3.420 . 5.040 5.079 5.079 5.079 0.039 1 0 "[ ]" 1
1134 1 65 SER HA 1 66 ALA H 2.610 . 3.420 2.543 2.543 2.543 . 0 0 "[ ]" 1
1135 1 65 SER HA 1 66 ALA MB 3.840 . 5.880 3.756 3.756 3.756 . 0 0 "[ ]" 1
1136 1 65 SER HA 1 67 PHE H 3.090 . 4.380 4.531 4.531 4.531 0.151 1 0 "[ ]" 1
1137 1 65 SER HA 1 136 TYR HD2 2.830 . 3.860 3.736 3.736 3.736 . 0 0 "[ ]" 1
1138 1 65 SER QB 1 68 VAL QG 4.470 . 7.140 2.782 2.782 2.782 . 0 0 "[ ]" 1
1139 1 65 SER QB 1 132 CYS HA 3.325 . 4.850 4.410 4.410 4.410 . 0 0 "[ ]" 1
1140 1 65 SER HB2 1 68 VAL MG1 5.430 . 9.060 5.064 5.064 5.064 . 0 0 "[ ]" 1
1141 1 65 SER HB2 1 68 VAL MG2 5.430 . 9.060 2.876 2.876 2.876 . 0 0 "[ ]" 1
1142 1 65 SER HB2 1 132 CYS HA 3.650 . 5.500 4.726 4.726 4.726 . 0 0 "[ ]" 1
1143 1 65 SER HB3 1 68 VAL MG1 5.430 . 9.060 5.693 5.693 5.693 . 0 0 "[ ]" 1
1144 1 65 SER HB3 1 68 VAL MG2 5.430 . 9.060 3.862 3.862 3.862 . 0 0 "[ ]" 1
1145 1 65 SER HB3 1 132 CYS HA 3.650 . 5.500 5.278 5.278 5.278 . 0 0 "[ ]" 1
1146 1 66 ALA H 1 67 PHE H 2.550 . 3.300 2.095 2.095 2.095 . 0 0 "[ ]" 1
1147 1 66 ALA MB 1 67 PHE HA 4.165 . 6.530 3.929 3.929 3.929 . 0 0 "[ ]" 1
1148 1 66 ALA MB 1 93 PHE H 4.165 . 6.530 3.913 3.913 3.913 . 0 0 "[ ]" 1
1149 1 66 ALA MB 1 94 MET H 3.930 . 6.060 3.250 3.250 3.250 . 0 0 "[ ]" 1
1150 1 66 ALA MB 1 94 MET HB3 4.165 . 6.530 3.563 3.563 3.563 . 0 0 "[ ]" 1
1151 1 66 ALA MB 1 134 GLN HA 3.250 . 4.700 3.833 3.833 3.833 . 0 0 "[ ]" 1
1152 1 66 ALA MB 1 134 GLN HE21 4.165 . 6.530 1.866 1.866 1.866 . 0 0 "[ ]" 1
1153 1 66 ALA MB 1 134 GLN HE22 3.745 . 5.690 2.648 2.648 2.648 . 0 0 "[ ]" 1
1154 1 66 ALA O 1 93 PHE H 1.900 . 2.000 1.805 1.805 1.805 . 0 0 "[ ]" 1
1155 1 66 ALA O 1 93 PHE N 2.850 2.700 3.000 2.751 2.751 2.751 . 0 0 "[ ]" 1
1156 1 67 PHE H 1 67 PHE HB2 2.970 . 4.140 2.612 2.612 2.612 . 0 0 "[ ]" 1
1157 1 67 PHE H 1 67 PHE HD2 3.045 . 4.290 3.537 3.537 3.537 . 0 0 "[ ]" 1
1158 1 67 PHE H 1 67 PHE QE 4.585 . 7.370 4.818 4.818 4.818 . 0 0 "[ ]" 1
1159 1 67 PHE H 1 68 VAL H 3.260 . 4.720 4.486 4.486 4.486 . 0 0 "[ ]" 1
1160 1 67 PHE H 1 68 VAL QG 4.945 . 8.090 3.862 3.862 3.862 . 0 0 "[ ]" 1
1161 1 67 PHE H 1 132 CYS HA 3.385 . 4.970 4.715 4.715 4.715 . 0 0 "[ ]" 1
1162 1 67 PHE H 1 132 CYS QB 4.090 . 6.380 5.381 5.381 5.381 . 0 0 "[ ]" 1
1163 1 67 PHE H 1 133 SER H 2.765 . 3.730 2.912 2.912 2.912 . 0 0 "[ ]" 1
1164 1 67 PHE H 1 133 SER O 1.900 . 2.000 2.041 2.041 2.041 0.041 1 0 "[ ]" 1
1165 1 67 PHE HA 1 67 PHE HD1 2.625 . 3.450 2.132 2.132 2.132 . 0 0 "[ ]" 1
1166 1 67 PHE HA 1 68 VAL H 2.520 . 3.240 2.206 2.206 2.206 . 0 0 "[ ]" 1
1167 1 67 PHE HA 1 68 VAL QG 4.605 . 7.410 3.504 3.504 3.504 . 0 0 "[ ]" 1
1168 1 67 PHE HA 1 90 THR MG 3.405 . 5.010 3.350 3.350 3.350 . 0 0 "[ ]" 1
1169 1 67 PHE HA 1 91 SER H 3.295 . 4.790 3.860 3.860 3.860 . 0 0 "[ ]" 1
1170 1 67 PHE HA 1 92 SER H 3.605 . 5.410 4.375 4.375 4.375 . 0 0 "[ ]" 1
1171 1 67 PHE HA 1 92 SER HA 2.300 . 2.800 2.524 2.524 2.524 . 0 0 "[ ]" 1
1172 1 67 PHE HA 1 92 SER HB2 3.650 . 5.500 4.743 4.743 4.743 . 0 0 "[ ]" 1
1173 1 67 PHE HA 1 92 SER HB3 3.650 . 5.500 4.225 4.225 4.225 . 0 0 "[ ]" 1
1174 1 67 PHE HA 1 93 PHE H 2.860 . 3.920 3.650 3.650 3.650 . 0 0 "[ ]" 1
1175 1 67 PHE HA 1 94 MET H 3.650 . 5.500 5.212 5.212 5.212 . 0 0 "[ ]" 1
1176 1 67 PHE HB2 1 68 VAL H 3.465 . 5.130 4.152 4.152 4.152 . 0 0 "[ ]" 1
1177 1 67 PHE HB2 1 90 THR MG 3.110 . 4.420 3.544 3.544 3.544 . 0 0 "[ ]" 1
1178 1 67 PHE HB2 1 133 SER H 3.125 . 4.450 2.551 2.551 2.551 . 0 0 "[ ]" 1
1179 1 67 PHE HB2 1 133 SER HB2 2.660 . 3.520 2.519 2.519 2.519 . 0 0 "[ ]" 1
1180 1 67 PHE HB2 1 133 SER QB 2.555 . 3.310 2.076 2.076 2.076 . 0 0 "[ ]" 1
1181 1 67 PHE HB2 1 133 SER HB3 2.660 . 3.520 2.210 2.210 2.210 . 0 0 "[ ]" 1
1182 1 67 PHE HB3 1 68 VAL H 3.045 . 4.290 3.287 3.287 3.287 . 0 0 "[ ]" 1
1183 1 67 PHE HB3 1 90 THR HB 3.650 . 5.500 3.740 3.740 3.740 . 0 0 "[ ]" 1
1184 1 67 PHE HB3 1 90 THR MG 2.785 . 3.770 2.048 2.048 2.048 . 0 0 "[ ]" 1
1185 1 67 PHE HB3 1 92 SER HA 3.125 . 4.450 4.463 4.463 4.463 0.013 1 0 "[ ]" 1
1186 1 67 PHE HB3 1 133 SER HB2 2.550 . 3.300 3.362 3.362 3.362 0.062 1 0 "[ ]" 1
1187 1 67 PHE HB3 1 133 SER HB3 2.550 . 3.300 3.358 3.358 3.358 0.058 1 0 "[ ]" 1
1188 1 67 PHE QD 1 90 THR MG 4.265 . 6.730 2.834 2.834 2.834 . 0 0 "[ ]" 1
1189 1 67 PHE QD 1 91 SER HA 4.710 . 7.620 4.697 4.697 4.697 . 0 0 "[ ]" 1
1190 1 67 PHE QD 1 94 MET H 4.710 . 7.620 5.522 5.522 5.522 . 0 0 "[ ]" 1
1191 1 67 PHE QD 1 134 GLN HA 4.710 . 7.620 3.291 3.291 3.291 . 0 0 "[ ]" 1
1192 1 67 PHE HD1 1 68 VAL H 3.355 . 4.910 3.929 3.929 3.929 . 0 0 "[ ]" 1
1193 1 67 PHE HD1 1 91 SER H 3.650 . 5.500 4.905 4.905 4.905 . 0 0 "[ ]" 1
1194 1 67 PHE HD1 1 91 SER HA 3.450 . 5.100 4.718 4.718 4.718 . 0 0 "[ ]" 1
1195 1 67 PHE HD1 1 92 SER H 3.650 . 5.500 3.659 3.659 3.659 . 0 0 "[ ]" 1
1196 1 67 PHE HD1 1 92 SER HA 2.455 . 3.110 2.056 2.056 2.056 . 0 0 "[ ]" 1
1197 1 67 PHE HD1 1 92 SER HB2 3.060 . 4.320 3.268 3.268 3.268 . 0 0 "[ ]" 1
1198 1 67 PHE HD1 1 92 SER QB 2.935 . 4.070 2.344 2.344 2.344 . 0 0 "[ ]" 1
1199 1 67 PHE HD1 1 92 SER HB3 3.060 . 4.320 2.402 2.402 2.402 . 0 0 "[ ]" 1
1200 1 67 PHE HD1 1 93 PHE H 3.540 . 5.280 4.080 4.080 4.080 . 0 0 "[ ]" 1
1201 1 67 PHE HD2 1 133 SER H 3.650 . 5.500 4.267 4.267 4.267 . 0 0 "[ ]" 1
1202 1 67 PHE HD2 1 133 SER HB2 2.815 . 3.830 3.729 3.729 3.729 . 0 0 "[ ]" 1
1203 1 67 PHE HD2 1 133 SER QB 2.710 . 3.620 2.167 2.167 2.167 . 0 0 "[ ]" 1
1204 1 67 PHE HD2 1 133 SER HB3 2.815 . 3.830 2.181 2.181 2.181 . 0 0 "[ ]" 1
1205 1 67 PHE HD2 1 134 GLN H 3.650 . 5.500 4.011 4.011 4.011 . 0 0 "[ ]" 1
1206 1 67 PHE QE 1 68 VAL H 4.340 . 6.880 6.139 6.139 6.139 . 0 0 "[ ]" 1
1207 1 67 PHE QE 1 134 GLN HA 4.710 . 7.620 3.510 3.510 3.510 . 0 0 "[ ]" 1
1208 1 67 PHE HE1 1 92 SER H 3.555 . 5.310 4.645 4.645 4.645 . 0 0 "[ ]" 1
1209 1 67 PHE HE1 1 92 SER HA 2.660 . 3.520 3.251 3.251 3.251 . 0 0 "[ ]" 1
1210 1 67 PHE HE1 1 92 SER HB2 2.720 . 3.640 2.272 2.272 2.272 . 0 0 "[ ]" 1
1211 1 67 PHE HE1 1 92 SER HB3 2.720 . 3.640 2.008 2.008 2.008 . 0 0 "[ ]" 1
1212 1 67 PHE HE2 1 133 SER QB 3.780 . 5.760 4.359 4.359 4.359 . 0 0 "[ ]" 1
1213 1 67 PHE HE2 1 134 GLN H 3.650 . 5.500 5.475 5.475 5.475 . 0 0 "[ ]" 1
1214 1 67 PHE HE2 1 134 GLN HA 3.650 . 5.500 3.517 3.517 3.517 . 0 0 "[ ]" 1
1215 1 67 PHE N 1 133 SER O 2.850 2.700 3.000 2.842 2.842 2.842 . 0 0 "[ ]" 1
1216 1 67 PHE O 1 133 SER H 1.900 . 2.000 1.778 1.778 1.778 0.022 1 0 "[ ]" 1
1217 1 67 PHE O 1 133 SER N 2.850 2.700 3.000 2.692 2.692 2.692 0.008 1 0 "[ ]" 1
1218 1 68 VAL H 1 90 THR HA 2.660 . 3.520 3.445 3.445 3.445 . 0 0 "[ ]" 1
1219 1 68 VAL H 1 90 THR MG 3.420 . 5.040 3.640 3.640 3.640 . 0 0 "[ ]" 1
1220 1 68 VAL H 1 91 SER H 2.705 . 3.610 2.040 2.040 2.040 . 0 0 "[ ]" 1
1221 1 68 VAL H 1 91 SER O 1.900 . 2.000 2.080 2.080 2.080 0.080 1 0 "[ ]" 1
1222 1 68 VAL H 1 92 SER HA 3.060 . 4.320 4.030 4.030 4.030 . 0 0 "[ ]" 1
1223 1 68 VAL HA 1 69 GLU H 2.160 . 2.520 2.158 2.158 2.158 . 0 0 "[ ]" 1
1224 1 68 VAL HA 1 69 GLU QB 3.780 . 5.760 4.151 4.151 4.151 . 0 0 "[ ]" 1
1225 1 68 VAL HA 1 132 CYS HA 2.285 . 2.770 2.288 2.288 2.288 . 0 0 "[ ]" 1
1226 1 68 VAL HA 1 133 SER H 2.815 . 3.830 3.645 3.645 3.645 . 0 0 "[ ]" 1
1227 1 68 VAL HB 1 69 GLU H 3.325 . 4.850 4.344 4.344 4.344 . 0 0 "[ ]" 1
1228 1 68 VAL HB 1 91 SER HB2 3.450 . 5.100 4.364 4.364 4.364 . 0 0 "[ ]" 1
1229 1 68 VAL HB 1 111 PHE QE 4.275 . 6.750 4.001 4.001 4.001 . 0 0 "[ ]" 1
1230 1 68 VAL HB 1 111 PHE HZ 2.660 . 3.520 2.898 2.898 2.898 . 0 0 "[ ]" 1
1231 1 68 VAL QG 1 69 GLU H 3.075 . 4.350 2.876 2.876 2.876 . 0 0 "[ ]" 1
1232 1 68 VAL QG 1 69 GLU HA 4.895 . 7.990 3.974 3.974 3.974 . 0 0 "[ ]" 1
1233 1 68 VAL QG 1 70 VAL QG 5.385 . 8.970 2.618 2.618 2.618 . 0 0 "[ ]" 1
1234 1 68 VAL QG 1 91 SER H 4.945 . 8.090 3.688 3.688 3.688 . 0 0 "[ ]" 1
1235 1 68 VAL QG 1 91 SER HB2 4.415 . 7.030 4.661 4.661 4.661 . 0 0 "[ ]" 1
1236 1 68 VAL QG 1 91 SER HB3 4.370 . 6.940 4.837 4.837 4.837 . 0 0 "[ ]" 1
1237 1 68 VAL QG 1 111 PHE QE 5.125 . 8.450 3.623 3.623 3.623 . 0 0 "[ ]" 1
1238 1 68 VAL QG 1 111 PHE HZ 3.475 . 5.150 2.902 2.902 2.902 . 0 0 "[ ]" 1
1239 1 68 VAL QG 1 131 VAL H 4.945 . 8.090 3.764 3.764 3.764 . 0 0 "[ ]" 1
1240 1 68 VAL QG 1 132 CYS HA 2.900 . 4.000 2.837 2.837 2.837 . 0 0 "[ ]" 1
1241 1 68 VAL QG 1 133 SER H 4.555 . 7.310 3.722 3.722 3.722 . 0 0 "[ ]" 1
1242 1 68 VAL MG1 1 69 GLU H 3.360 . 4.920 2.936 2.936 2.936 . 0 0 "[ ]" 1
1243 1 68 VAL MG1 1 111 PHE QE 5.225 . 8.650 3.748 3.748 3.748 . 0 0 "[ ]" 1
1244 1 68 VAL MG1 1 111 PHE HZ 3.685 . 5.570 2.969 2.969 2.969 . 0 0 "[ ]" 1
1245 1 68 VAL MG1 1 132 CYS HA 3.205 . 4.610 3.555 3.555 3.555 . 0 0 "[ ]" 1
1246 1 68 VAL MG2 1 69 GLU H 3.360 . 4.920 4.124 4.124 4.124 . 0 0 "[ ]" 1
1247 1 68 VAL MG2 1 111 PHE QE 5.225 . 8.650 4.809 4.809 4.809 . 0 0 "[ ]" 1
1248 1 68 VAL MG2 1 111 PHE HZ 3.685 . 5.570 4.087 4.087 4.087 . 0 0 "[ ]" 1
1249 1 68 VAL MG2 1 132 CYS HA 3.205 . 4.610 2.982 2.982 2.982 . 0 0 "[ ]" 1
1250 1 68 VAL N 1 91 SER O 2.850 2.700 3.000 2.921 2.921 2.921 . 0 0 "[ ]" 1
1251 1 68 VAL O 1 91 SER H 1.900 . 2.000 1.800 1.800 1.800 0.000 1 0 "[ ]" 1
1252 1 68 VAL O 1 91 SER N 2.850 2.700 3.000 2.687 2.687 2.687 0.013 1 0 "[ ]" 1
1253 1 69 GLU H 1 69 GLU HG2 3.650 . 5.500 4.489 4.489 4.489 . 0 0 "[ ]" 1
1254 1 69 GLU H 1 69 GLU QG 3.425 . 5.050 4.006 4.006 4.006 . 0 0 "[ ]" 1
1255 1 69 GLU H 1 69 GLU HG3 3.650 . 5.500 4.506 4.506 4.506 . 0 0 "[ ]" 1
1256 1 69 GLU H 1 70 VAL H 3.355 . 4.910 4.576 4.576 4.576 . 0 0 "[ ]" 1
1257 1 69 GLU H 1 70 VAL QG 4.680 . 7.560 4.051 4.051 4.051 . 0 0 "[ ]" 1
1258 1 69 GLU H 1 90 THR HA 3.060 . 4.320 3.338 3.338 3.338 . 0 0 "[ ]" 1
1259 1 69 GLU H 1 131 VAL O 1.900 . 2.000 1.986 1.986 1.986 . 0 0 "[ ]" 1
1260 1 69 GLU H 1 132 CYS HA 2.920 . 4.040 3.354 3.354 3.354 . 0 0 "[ ]" 1
1261 1 69 GLU HA 1 69 GLU QG 2.815 . 3.830 2.385 2.385 2.385 . 0 0 "[ ]" 1
1262 1 69 GLU HA 1 70 VAL H 2.535 . 3.270 2.301 2.301 2.301 . 0 0 "[ ]" 1
1263 1 69 GLU HA 1 71 LEU QD 4.730 . 7.660 4.851 4.851 4.851 . 0 0 "[ ]" 1
1264 1 69 GLU HA 1 90 THR HA 2.330 . 2.860 1.966 1.966 1.966 . 0 0 "[ ]" 1
1265 1 69 GLU QB 1 90 THR HA 2.815 . 3.830 2.354 2.354 2.354 . 0 0 "[ ]" 1
1266 1 69 GLU QB 1 91 SER H 3.730 . 5.660 4.293 4.293 4.293 . 0 0 "[ ]" 1
1267 1 69 GLU QG 1 70 VAL H 3.425 . 5.050 1.996 1.996 1.996 . 0 0 "[ ]" 1
1268 1 69 GLU QG 1 71 LEU QD 3.565 . 5.330 2.349 2.349 2.349 . 0 0 "[ ]" 1
1269 1 69 GLU QG 1 89 VAL HA 3.515 . 5.230 2.812 2.812 2.812 . 0 0 "[ ]" 1
1270 1 69 GLU QG 1 89 VAL QG 4.190 . 6.580 4.114 4.114 4.114 . 0 0 "[ ]" 1
1271 1 69 GLU QG 1 90 THR H 4.090 . 6.380 3.637 3.637 3.637 . 0 0 "[ ]" 1
1272 1 69 GLU QG 1 90 THR HA 3.300 . 4.800 3.627 3.627 3.627 . 0 0 "[ ]" 1
1273 1 69 GLU QG 1 90 THR HB 4.090 . 6.380 4.111 4.111 4.111 . 0 0 "[ ]" 1
1274 1 69 GLU QG 1 91 SER H 4.090 . 6.380 5.409 5.409 5.409 . 0 0 "[ ]" 1
1275 1 69 GLU HG2 1 71 LEU MD1 4.185 . 6.570 2.462 2.462 2.462 . 0 0 "[ ]" 1
1276 1 69 GLU HG2 1 71 LEU MD2 4.185 . 6.570 4.602 4.602 4.602 . 0 0 "[ ]" 1
1277 1 69 GLU HG3 1 71 LEU MD1 4.185 . 6.570 3.021 3.021 3.021 . 0 0 "[ ]" 1
1278 1 69 GLU HG3 1 71 LEU MD2 4.185 . 6.570 5.486 5.486 5.486 . 0 0 "[ ]" 1
1279 1 69 GLU N 1 131 VAL O 2.850 2.700 3.000 2.961 2.961 2.961 . 0 0 "[ ]" 1
1280 1 69 GLU O 1 131 VAL H 1.900 . 2.000 2.009 2.009 2.009 0.009 1 0 "[ ]" 1
1281 1 69 GLU O 1 131 VAL N 2.850 2.700 3.000 2.958 2.958 2.958 . 0 0 "[ ]" 1
1282 1 70 VAL H 1 70 VAL HB 2.505 . 3.210 2.870 2.870 2.870 . 0 0 "[ ]" 1
1283 1 70 VAL H 1 70 VAL QG 3.070 . 4.340 2.778 2.778 2.778 . 0 0 "[ ]" 1
1284 1 70 VAL H 1 88 LEU H 2.845 . 3.890 3.483 3.483 3.483 . 0 0 "[ ]" 1
1285 1 70 VAL H 1 88 LEU QB 3.550 . 5.300 4.455 4.455 4.455 . 0 0 "[ ]" 1
1286 1 70 VAL H 1 88 LEU MD1 4.165 . 6.530 2.655 2.655 2.655 . 0 0 "[ ]" 1
1287 1 70 VAL H 1 88 LEU QD 4.020 . 6.240 2.617 2.617 2.617 . 0 0 "[ ]" 1
1288 1 70 VAL H 1 88 LEU MD2 4.165 . 6.530 3.959 3.959 3.959 . 0 0 "[ ]" 1
1289 1 70 VAL H 1 88 LEU HG 3.280 . 4.760 2.553 2.553 2.553 . 0 0 "[ ]" 1
1290 1 70 VAL H 1 88 LEU O 1.900 . 2.000 2.043 2.043 2.043 0.043 1 0 "[ ]" 1
1291 1 70 VAL H 1 90 THR HA 3.185 . 4.570 4.187 4.187 4.187 . 0 0 "[ ]" 1
1292 1 70 VAL HA 1 71 LEU H 2.315 . 2.830 2.165 2.165 2.165 . 0 0 "[ ]" 1
1293 1 70 VAL HA 1 71 LEU QD 3.925 . 6.050 3.905 3.905 3.905 . 0 0 "[ ]" 1
1294 1 70 VAL HA 1 130 ILE HA 2.395 . 2.990 2.575 2.575 2.575 . 0 0 "[ ]" 1
1295 1 70 VAL HA 1 131 VAL H 2.875 . 3.950 3.629 3.629 3.629 . 0 0 "[ ]" 1
1296 1 70 VAL HB 1 71 LEU H 3.650 . 5.500 4.133 4.133 4.133 . 0 0 "[ ]" 1
1297 1 70 VAL HB 1 87 LEU H 3.650 . 5.500 5.133 5.133 5.133 . 0 0 "[ ]" 1
1298 1 70 VAL HB 1 88 LEU H 3.140 . 4.480 3.374 3.374 3.374 . 0 0 "[ ]" 1
1299 1 70 VAL HB 1 88 LEU HB2 3.310 . 4.820 4.666 4.666 4.666 . 0 0 "[ ]" 1
1300 1 70 VAL HB 1 88 LEU QB 3.075 . 4.350 3.946 3.946 3.946 . 0 0 "[ ]" 1
1301 1 70 VAL HB 1 88 LEU HB3 3.310 . 4.820 4.258 4.258 4.258 . 0 0 "[ ]" 1
1302 1 70 VAL HB 1 88 LEU MD1 2.970 . 4.140 2.786 2.786 2.786 . 0 0 "[ ]" 1
1303 1 70 VAL HB 1 88 LEU MD2 2.970 . 4.140 2.047 2.047 2.047 . 0 0 "[ ]" 1
1304 1 70 VAL HB 1 88 LEU HG 2.780 . 3.760 1.948 1.948 1.948 . 0 0 "[ ]" 1
1305 1 70 VAL QG 1 71 LEU H 3.910 . 6.020 2.565 2.565 2.565 . 0 0 "[ ]" 1
1306 1 70 VAL QG 1 88 LEU QB 4.515 . 7.230 4.032 4.032 4.032 . 0 0 "[ ]" 1
1307 1 70 VAL QG 1 130 ILE HA 4.105 . 6.410 2.704 2.704 2.704 . 0 0 "[ ]" 1
1308 1 70 VAL QG 1 149 PHE HE1 3.675 . 5.550 2.295 2.295 2.295 . 0 0 "[ ]" 1
1309 1 70 VAL MG1 1 71 LEU H 4.070 . 6.340 2.590 2.590 2.590 . 0 0 "[ ]" 1
1310 1 70 VAL MG1 1 88 LEU HB2 5.645 . 9.490 5.852 5.852 5.852 . 0 0 "[ ]" 1
1311 1 70 VAL MG1 1 88 LEU HB3 5.645 . 9.490 5.227 5.227 5.227 . 0 0 "[ ]" 1
1312 1 70 VAL MG2 1 71 LEU H 4.070 . 6.340 4.136 4.136 4.136 . 0 0 "[ ]" 1
1313 1 70 VAL MG2 1 88 LEU HB2 5.645 . 9.490 4.740 4.740 4.740 . 0 0 "[ ]" 1
1314 1 70 VAL MG2 1 88 LEU HB3 5.645 . 9.490 4.919 4.919 4.919 . 0 0 "[ ]" 1
1315 1 70 VAL N 1 88 LEU O 2.850 2.700 3.000 3.019 3.019 3.019 0.019 1 0 "[ ]" 1
1316 1 70 VAL O 1 88 LEU H 1.900 . 2.000 2.068 2.068 2.068 0.068 1 0 "[ ]" 1
1317 1 70 VAL O 1 88 LEU N 2.850 2.700 3.000 3.050 3.050 3.050 0.050 1 0 "[ ]" 1
1318 1 71 LEU H 1 71 LEU MD1 3.590 . 5.380 3.212 3.212 3.212 . 0 0 "[ ]" 1
1319 1 71 LEU H 1 71 LEU QD 3.435 . 5.070 3.137 3.137 3.137 . 0 0 "[ ]" 1
1320 1 71 LEU H 1 71 LEU MD2 3.590 . 5.380 4.391 4.391 4.391 . 0 0 "[ ]" 1
1321 1 71 LEU H 1 71 LEU HG 3.605 . 5.410 4.470 4.470 4.470 . 0 0 "[ ]" 1
1322 1 71 LEU H 1 72 VAL MG2 4.165 . 6.530 5.409 5.409 5.409 . 0 0 "[ ]" 1
1323 1 71 LEU H 1 128 VAL MG1 4.055 . 6.310 5.040 5.040 5.040 . 0 0 "[ ]" 1
1324 1 71 LEU H 1 129 LYS H 3.245 . 4.690 2.580 2.580 2.580 . 0 0 "[ ]" 1
1325 1 71 LEU H 1 129 LYS O 1.900 . 2.000 2.005 2.005 2.005 0.005 1 0 "[ ]" 1
1326 1 71 LEU H 1 130 ILE HA 2.860 . 3.920 3.914 3.914 3.914 . 0 0 "[ ]" 1
1327 1 71 LEU HA 1 71 LEU HG 2.410 . 3.020 2.249 2.249 2.249 . 0 0 "[ ]" 1
1328 1 71 LEU HA 1 72 VAL H 2.425 . 3.050 2.398 2.398 2.398 . 0 0 "[ ]" 1
1329 1 71 LEU HA 1 72 VAL MG2 3.605 . 5.410 3.332 3.332 3.332 . 0 0 "[ ]" 1
1330 1 71 LEU HA 1 85 GLU H 3.260 . 4.720 4.470 4.470 4.470 . 0 0 "[ ]" 1
1331 1 71 LEU HA 1 86 VAL HA 2.285 . 2.770 2.663 2.663 2.663 . 0 0 "[ ]" 1
1332 1 71 LEU HA 1 87 LEU H 3.200 . 4.600 1.962 1.962 1.962 . 0 0 "[ ]" 1
1333 1 71 LEU HA 1 88 LEU H 3.245 . 4.690 3.603 3.603 3.603 . 0 0 "[ ]" 1
1334 1 71 LEU QB 1 72 VAL H 3.335 . 4.870 2.778 2.778 2.778 . 0 0 "[ ]" 1
1335 1 71 LEU QB 1 72 VAL MG2 3.875 . 5.950 4.153 4.153 4.153 . 0 0 "[ ]" 1
1336 1 71 LEU QB 1 84 TYR H 4.090 . 6.380 5.077 5.077 5.077 . 0 0 "[ ]" 1
1337 1 71 LEU QB 1 84 TYR HA 3.735 . 5.670 4.653 4.653 4.653 . 0 0 "[ ]" 1
1338 1 71 LEU QB 1 84 TYR QB 3.220 . 4.640 2.113 2.113 2.113 . 0 0 "[ ]" 1
1339 1 71 LEU QB 1 84 TYR HD2 4.090 . 6.380 2.586 2.586 2.586 . 0 0 "[ ]" 1
1340 1 71 LEU QB 1 86 VAL HA 3.810 . 5.820 3.890 3.890 3.890 . 0 0 "[ ]" 1
1341 1 71 LEU HB2 1 72 VAL H 3.650 . 5.500 4.093 4.093 4.093 . 0 0 "[ ]" 1
1342 1 71 LEU HB2 1 84 TYR HB2 3.860 . 5.920 4.224 4.224 4.224 . 0 0 "[ ]" 1
1343 1 71 LEU HB2 1 84 TYR HB3 3.860 . 5.920 3.902 3.902 3.902 . 0 0 "[ ]" 1
1344 1 71 LEU HB3 1 72 VAL H 3.650 . 5.500 2.826 2.826 2.826 . 0 0 "[ ]" 1
1345 1 71 LEU HB3 1 84 TYR HB2 3.860 . 5.920 2.931 2.931 2.931 . 0 0 "[ ]" 1
1346 1 71 LEU HB3 1 84 TYR HB3 3.860 . 5.920 2.185 2.185 2.185 . 0 0 "[ ]" 1
1347 1 71 LEU QD 1 84 TYR H 4.545 . 7.290 3.563 3.563 3.563 . 0 0 "[ ]" 1
1348 1 71 LEU QD 1 84 TYR HA 4.125 . 6.450 4.218 4.218 4.218 . 0 0 "[ ]" 1
1349 1 71 LEU QD 1 84 TYR QB 3.395 . 4.990 2.064 2.064 2.064 . 0 0 "[ ]" 1
1350 1 71 LEU QD 1 86 VAL HA 3.250 . 4.700 1.982 1.982 1.982 . 0 0 "[ ]" 1
1351 1 71 LEU QD 1 86 VAL MG2 4.300 . 6.800 1.986 1.986 1.986 . 0 0 "[ ]" 1
1352 1 71 LEU QD 1 87 LEU H 4.455 . 7.110 3.091 3.091 3.091 . 0 0 "[ ]" 1
1353 1 71 LEU MD1 1 84 TYR HB2 3.745 . 5.690 4.731 4.731 4.731 . 0 0 "[ ]" 1
1354 1 71 LEU MD1 1 84 TYR HB3 3.745 . 5.690 4.540 4.540 4.540 . 0 0 "[ ]" 1
1355 1 71 LEU MD1 1 86 VAL HA 3.825 . 5.850 1.996 1.996 1.996 . 0 0 "[ ]" 1
1356 1 71 LEU MD2 1 84 TYR HB2 3.745 . 5.690 2.182 2.182 2.182 . 0 0 "[ ]" 1
1357 1 71 LEU MD2 1 84 TYR HB3 3.745 . 5.690 2.571 2.571 2.571 . 0 0 "[ ]" 1
1358 1 71 LEU MD2 1 86 VAL HA 3.825 . 5.850 3.370 3.370 3.370 . 0 0 "[ ]" 1
1359 1 71 LEU HG 1 72 VAL H 2.705 . 3.610 2.966 2.966 2.966 . 0 0 "[ ]" 1
1360 1 71 LEU HG 1 86 VAL HA 2.270 . 2.740 1.963 1.963 1.963 . 0 0 "[ ]" 1
1361 1 71 LEU HG 1 86 VAL MG2 2.800 . 3.800 2.965 2.965 2.965 . 0 0 "[ ]" 1
1362 1 71 LEU N 1 129 LYS O 2.850 2.700 3.000 2.918 2.918 2.918 . 0 0 "[ ]" 1
1363 1 71 LEU O 1 129 LYS H 1.900 . 2.000 2.029 2.029 2.029 0.029 1 0 "[ ]" 1
1364 1 71 LEU O 1 129 LYS N 2.850 2.700 3.000 2.979 2.979 2.979 . 0 0 "[ ]" 1
1365 1 72 VAL H 1 72 VAL HB 2.705 . 3.610 3.680 3.680 3.680 0.070 1 0 "[ ]" 1
1366 1 72 VAL H 1 72 VAL MG2 2.955 . 4.110 1.916 1.916 1.916 . 0 0 "[ ]" 1
1367 1 72 VAL H 1 84 TYR QB 3.595 . 5.390 2.863 2.863 2.863 . 0 0 "[ ]" 1
1368 1 72 VAL H 1 84 TYR HD2 3.650 . 5.500 3.316 3.316 3.316 . 0 0 "[ ]" 1
1369 1 72 VAL H 1 85 GLU H 2.720 . 3.640 2.545 2.545 2.545 . 0 0 "[ ]" 1
1370 1 72 VAL H 1 85 GLU QB 4.090 . 6.380 4.462 4.462 4.462 . 0 0 "[ ]" 1
1371 1 72 VAL H 1 85 GLU O 1.900 . 2.000 2.017 2.017 2.017 0.017 1 0 "[ ]" 1
1372 1 72 VAL H 1 86 VAL HA 2.875 . 3.950 3.981 3.981 3.981 0.031 1 0 "[ ]" 1
1373 1 72 VAL H 1 87 LEU H 3.310 . 4.820 2.876 2.876 2.876 . 0 0 "[ ]" 1
1374 1 72 VAL HA 1 72 VAL HB 2.100 . 2.400 2.547 2.547 2.547 0.147 1 0 "[ ]" 1
1375 1 72 VAL HA 1 72 VAL MG1 2.675 . 3.550 2.279 2.279 2.279 . 0 0 "[ ]" 1
1376 1 72 VAL HA 1 73 GLY H 2.300 . 2.800 2.372 2.372 2.372 . 0 0 "[ ]" 1
1377 1 72 VAL HB 1 73 GLY H 2.595 . 3.390 2.587 2.587 2.587 . 0 0 "[ ]" 1
1378 1 72 VAL HB 1 85 GLU H 3.170 . 4.540 4.581 4.581 4.581 0.041 1 0 "[ ]" 1
1379 1 72 VAL HB 1 87 LEU H 3.650 . 5.500 5.564 5.564 5.564 0.064 1 0 "[ ]" 1
1380 1 72 VAL HB 1 125 TRP HB2 2.535 . 3.270 3.283 3.283 3.283 0.013 1 0 "[ ]" 1
1381 1 72 VAL HB 1 125 TRP HB3 3.000 . 4.200 3.094 3.094 3.094 . 0 0 "[ ]" 1
1382 1 72 VAL HB 1 125 TRP HD1 3.260 . 4.720 3.116 3.116 3.116 . 0 0 "[ ]" 1
1383 1 72 VAL MG1 1 73 GLY H 3.170 . 4.540 3.513 3.513 3.513 . 0 0 "[ ]" 1
1384 1 72 VAL MG1 1 85 GLU H 4.165 . 6.530 4.831 4.831 4.831 . 0 0 "[ ]" 1
1385 1 72 VAL MG1 1 125 TRP HB2 3.870 . 5.940 3.433 3.433 3.433 . 0 0 "[ ]" 1
1386 1 72 VAL MG1 1 125 TRP HB3 4.165 . 6.530 3.907 3.907 3.907 . 0 0 "[ ]" 1
1387 1 72 VAL MG1 1 125 TRP HD1 3.560 . 5.320 3.159 3.159 3.159 . 0 0 "[ ]" 1
1388 1 72 VAL MG1 1 125 TRP HE1 4.115 . 6.430 4.042 4.042 4.042 . 0 0 "[ ]" 1
1389 1 72 VAL MG2 1 73 GLY H 3.575 . 5.350 3.787 3.787 3.787 . 0 0 "[ ]" 1
1390 1 72 VAL MG2 1 85 GLU H 3.450 . 5.100 2.528 2.528 2.528 . 0 0 "[ ]" 1
1391 1 72 VAL MG2 1 85 GLU HA 3.465 . 5.130 4.235 4.235 4.235 . 0 0 "[ ]" 1
1392 1 72 VAL MG2 1 85 GLU HB2 3.375 . 4.950 3.282 3.282 3.282 . 0 0 "[ ]" 1
1393 1 72 VAL MG2 1 85 GLU QB 3.200 . 4.600 3.148 3.148 3.148 . 0 0 "[ ]" 1
1394 1 72 VAL MG2 1 85 GLU HB3 3.375 . 4.950 4.047 4.047 4.047 . 0 0 "[ ]" 1
1395 1 72 VAL MG2 1 85 GLU QG 4.590 . 7.380 1.767 1.767 1.767 0.033 1 0 "[ ]" 1
1396 1 72 VAL MG2 1 86 VAL H 4.165 . 6.530 4.620 4.620 4.620 . 0 0 "[ ]" 1
1397 1 72 VAL MG2 1 87 LEU H 4.165 . 6.530 2.648 2.648 2.648 . 0 0 "[ ]" 1
1398 1 72 VAL MG2 1 87 LEU MD1 4.680 . 7.560 1.972 1.972 1.972 . 0 0 "[ ]" 1
1399 1 72 VAL MG2 1 87 LEU QD 4.480 . 7.160 1.960 1.960 1.960 . 0 0 "[ ]" 1
1400 1 72 VAL MG2 1 87 LEU MD2 4.680 . 7.560 3.434 3.434 3.434 . 0 0 "[ ]" 1
1401 1 72 VAL MG2 1 88 LEU H 4.165 . 6.530 4.711 4.711 4.711 . 0 0 "[ ]" 1
1402 1 72 VAL MG2 1 120 ALA HA 3.545 . 5.290 4.314 4.314 4.314 . 0 0 "[ ]" 1
1403 1 72 VAL MG2 1 120 ALA MB 3.360 . 4.920 2.376 2.376 2.376 . 0 0 "[ ]" 1
1404 1 72 VAL MG2 1 125 TRP HB2 4.165 . 6.530 4.689 4.689 4.689 . 0 0 "[ ]" 1
1405 1 72 VAL MG2 1 125 TRP HB3 4.165 . 6.530 4.555 4.555 4.555 . 0 0 "[ ]" 1
1406 1 72 VAL MG2 1 125 TRP HD1 3.700 . 5.600 3.655 3.655 3.655 . 0 0 "[ ]" 1
1407 1 72 VAL MG2 1 125 TRP HE1 3.375 . 4.950 3.031 3.031 3.031 . 0 0 "[ ]" 1
1408 1 72 VAL MG2 1 125 TRP HZ2 3.700 . 5.600 3.829 3.829 3.829 . 0 0 "[ ]" 1
1409 1 72 VAL N 1 85 GLU O 2.850 2.700 3.000 2.972 2.972 2.972 . 0 0 "[ ]" 1
1410 1 72 VAL O 1 85 GLU H 1.900 . 2.000 2.010 2.010 2.010 0.010 1 0 "[ ]" 1
1411 1 72 VAL O 1 85 GLU N 2.850 2.700 3.000 2.913 2.913 2.913 . 0 0 "[ ]" 1
1412 1 73 GLY H 1 74 SER H 2.970 . 4.140 4.310 4.310 4.310 0.170 1 0 "[ ]" 1
1413 1 73 GLY H 1 84 TYR QD 4.720 . 7.640 3.566 3.566 3.566 . 0 0 "[ ]" 1
1414 1 73 GLY H 1 84 TYR QE 4.715 . 7.630 3.589 3.589 3.589 . 0 0 "[ ]" 1
1415 1 73 GLY H 1 125 TRP HB2 3.650 . 5.500 3.519 3.519 3.519 . 0 0 "[ ]" 1
1416 1 73 GLY H 1 125 TRP HB3 3.280 . 4.760 2.216 2.216 2.216 . 0 0 "[ ]" 1
1417 1 73 GLY H 1 125 TRP HE3 3.420 . 5.040 3.583 3.583 3.583 . 0 0 "[ ]" 1
1418 1 73 GLY H 1 125 TRP HZ3 3.650 . 5.500 5.378 5.378 5.378 . 0 0 "[ ]" 1
1419 1 73 GLY H 1 127 ARG QB 3.765 . 5.730 3.580 3.580 3.580 . 0 0 "[ ]" 1
1420 1 73 GLY QA 1 74 SER HA 3.020 . 4.240 3.967 3.967 3.967 . 0 0 "[ ]" 1
1421 1 73 GLY QA 1 84 TYR HA 2.480 . 3.160 2.834 2.834 2.834 . 0 0 "[ ]" 1
1422 1 73 GLY QA 1 84 TYR QD 5.160 . 8.520 3.034 3.034 3.034 . 0 0 "[ ]" 1
1423 1 73 GLY QA 1 84 TYR HD2 3.875 . 5.950 3.185 3.185 3.185 . 0 0 "[ ]" 1
1424 1 73 GLY QA 1 84 TYR QE 5.155 . 8.510 3.137 3.137 3.137 . 0 0 "[ ]" 1
1425 1 73 GLY QA 1 125 TRP HE3 2.770 . 3.740 2.348 2.348 2.348 . 0 0 "[ ]" 1
1426 1 73 GLY QA 1 125 TRP HZ3 2.870 . 3.940 2.887 2.887 2.887 . 0 0 "[ ]" 1
1427 1 73 GLY HA2 1 74 SER H 2.315 . 2.830 2.442 2.442 2.442 . 0 0 "[ ]" 1
1428 1 73 GLY HA2 1 84 TYR HA 2.610 . 3.420 3.297 3.297 3.297 . 0 0 "[ ]" 1
1429 1 73 GLY HA2 1 125 TRP HE3 3.000 . 4.200 2.372 2.372 2.372 . 0 0 "[ ]" 1
1430 1 73 GLY HA2 1 125 TRP HZ3 3.090 . 4.380 2.925 2.925 2.925 . 0 0 "[ ]" 1
1431 1 73 GLY HA3 1 74 SER H 2.315 . 2.830 2.655 2.655 2.655 . 0 0 "[ ]" 1
1432 1 73 GLY HA3 1 84 TYR HA 2.610 . 3.420 3.090 3.090 3.090 . 0 0 "[ ]" 1
1433 1 73 GLY HA3 1 125 TRP HE3 3.000 . 4.200 3.764 3.764 3.764 . 0 0 "[ ]" 1
1434 1 73 GLY HA3 1 125 TRP HZ3 3.090 . 4.380 4.449 4.449 4.449 0.069 1 0 "[ ]" 1
1435 1 73 GLY O 1 126 ASP H 1.900 . 2.000 2.114 2.114 2.114 0.114 1 0 "[ ]" 1
1436 1 73 GLY O 1 126 ASP N 2.850 2.700 3.000 2.980 2.980 2.980 . 0 0 "[ ]" 1
1437 1 74 SER H 1 74 SER HB2 2.455 . 3.110 3.133 3.133 3.133 0.023 1 0 "[ ]" 1
1438 1 74 SER H 1 74 SER HB3 2.470 . 3.140 2.474 2.474 2.474 . 0 0 "[ ]" 1
1439 1 74 SER H 1 75 SER H 3.090 . 4.380 4.478 4.478 4.478 0.098 1 0 "[ ]" 1
1440 1 74 SER H 1 76 ALA H 3.110 . 4.420 4.325 4.325 4.325 . 0 0 "[ ]" 1
1441 1 74 SER H 1 84 TYR HD1 3.650 . 5.500 5.528 5.528 5.528 0.028 1 0 "[ ]" 1
1442 1 74 SER H 1 84 TYR HE1 3.650 . 5.500 5.045 5.045 5.045 . 0 0 "[ ]" 1
1443 1 74 SER H 1 125 TRP HA 3.200 . 4.600 4.654 4.654 4.654 0.054 1 0 "[ ]" 1
1444 1 74 SER H 1 125 TRP HE3 2.985 . 4.170 2.737 2.737 2.737 . 0 0 "[ ]" 1
1445 1 74 SER H 1 125 TRP HZ3 2.955 . 4.110 3.191 3.191 3.191 . 0 0 "[ ]" 1
1446 1 74 SER H 1 126 ASP H 3.215 . 4.630 4.410 4.410 4.410 . 0 0 "[ ]" 1
1447 1 74 SER H 1 127 ARG QG 3.950 . 6.100 4.471 4.471 4.471 . 0 0 "[ ]" 1
1448 1 74 SER HA 1 74 SER HB2 2.100 . 2.400 2.397 2.397 2.397 . 0 0 "[ ]" 1
1449 1 74 SER HA 1 74 SER HB3 2.395 . 2.990 3.017 3.017 3.017 0.027 1 0 "[ ]" 1
1450 1 74 SER HA 1 75 SER H 2.365 . 2.930 2.360 2.360 2.360 . 0 0 "[ ]" 1
1451 1 74 SER HA 1 76 ALA H 2.750 . 3.700 3.857 3.857 3.857 0.157 1 0 "[ ]" 1
1452 1 74 SER HA 1 125 TRP HA 2.565 . 3.330 3.362 3.362 3.362 0.032 1 0 "[ ]" 1
1453 1 74 SER HA 1 125 TRP HE3 2.970 . 4.140 3.442 3.442 3.442 . 0 0 "[ ]" 1
1454 1 74 SER HA 1 126 ASP H 2.690 . 3.580 2.056 2.056 2.056 . 0 0 "[ ]" 1
1455 1 74 SER HA 1 127 ARG H 2.565 . 3.330 3.312 3.312 3.312 . 0 0 "[ ]" 1
1456 1 74 SER HA 1 127 ARG QB 3.175 . 4.550 3.421 3.421 3.421 . 0 0 "[ ]" 1
1457 1 74 SER HA 1 127 ARG QG 3.255 . 4.710 2.944 2.944 2.944 . 0 0 "[ ]" 1
1458 1 74 SER HB2 1 76 ALA H 2.780 . 3.760 3.860 3.860 3.860 0.100 1 0 "[ ]" 1
1459 1 74 SER HB2 1 76 ALA MB 3.575 . 5.350 3.994 3.994 3.994 . 0 0 "[ ]" 1
1460 1 74 SER HB2 1 125 TRP HA 3.540 . 5.280 2.793 2.793 2.793 . 0 0 "[ ]" 1
1461 1 74 SER HB2 1 125 TRP HE3 3.125 . 4.450 2.643 2.643 2.643 . 0 0 "[ ]" 1
1462 1 74 SER HB2 1 125 TRP HZ3 3.385 . 4.970 3.854 3.854 3.854 . 0 0 "[ ]" 1
1463 1 74 SER HB3 1 75 SER H 3.540 . 5.280 3.702 3.702 3.702 . 0 0 "[ ]" 1
1464 1 74 SER HB3 1 76 ALA H 3.650 . 5.500 2.816 2.816 2.816 . 0 0 "[ ]" 1
1465 1 74 SER HB3 1 76 ALA MB 3.560 . 5.320 2.700 2.700 2.700 . 0 0 "[ ]" 1
1466 1 74 SER HB3 1 125 TRP HA 3.650 . 5.500 4.442 4.442 4.442 . 0 0 "[ ]" 1
1467 1 74 SER HB3 1 125 TRP HE3 3.280 . 4.760 3.384 3.384 3.384 . 0 0 "[ ]" 1
1468 1 74 SER HB3 1 125 TRP HZ3 3.435 . 5.070 3.607 3.607 3.607 . 0 0 "[ ]" 1
1469 1 75 SER H 1 76 ALA H 2.485 . 3.170 2.586 2.586 2.586 . 0 0 "[ ]" 1
1470 1 75 SER H 1 76 ALA MB 3.760 . 5.720 4.276 4.276 4.276 . 0 0 "[ ]" 1
1471 1 75 SER H 1 126 ASP H 3.355 . 4.910 3.902 3.902 3.902 . 0 0 "[ ]" 1
1472 1 75 SER H 1 126 ASP HA 3.650 . 5.500 5.585 5.585 5.585 0.085 1 0 "[ ]" 1
1473 1 75 SER H 1 127 ARG HD2 3.650 . 5.500 5.230 5.230 5.230 . 0 0 "[ ]" 1
1474 1 75 SER H 1 127 ARG HD3 3.650 . 5.500 5.611 5.611 5.611 0.111 1 0 "[ ]" 1
1475 1 75 SER H 1 127 ARG QG 4.060 . 6.320 2.863 2.863 2.863 . 0 0 "[ ]" 1
1476 1 75 SER HA 1 76 ALA H 2.470 . 3.140 3.367 3.367 3.367 0.227 1 0 "[ ]" 1
1477 1 75 SER HA 1 127 ARG HD2 3.155 . 4.510 3.592 3.592 3.592 . 0 0 "[ ]" 1
1478 1 75 SER HA 1 127 ARG QD 2.775 . 3.750 3.416 3.416 3.416 . 0 0 "[ ]" 1
1479 1 75 SER HA 1 127 ARG HD3 3.155 . 4.510 4.277 4.277 4.277 . 0 0 "[ ]" 1
1480 1 76 ALA H 1 76 ALA HA 2.255 . 2.710 2.799 2.799 2.799 0.089 1 0 "[ ]" 1
1481 1 76 ALA H 1 76 ALA MB 2.615 . 3.430 2.214 2.214 2.214 . 0 0 "[ ]" 1
1482 1 76 ALA H 1 77 GLY H 3.280 . 4.760 4.640 4.640 4.640 . 0 0 "[ ]" 1
1483 1 76 ALA HA 1 78 GLY H 3.650 . 5.500 5.150 5.150 5.150 . 0 0 "[ ]" 1
1484 1 76 ALA MB 1 77 GLY QA 4.605 . 7.410 3.664 3.664 3.664 . 0 0 "[ ]" 1
1485 1 76 ALA MB 1 78 GLY H 4.165 . 6.530 4.502 4.502 4.502 . 0 0 "[ ]" 1
1486 1 77 GLY H 1 78 GLY H 3.650 . 5.500 4.188 4.188 4.188 . 0 0 "[ ]" 1
1487 1 78 GLY QA 1 80 GLY H 3.375 . 4.950 4.038 4.038 4.038 . 0 0 "[ ]" 1
1488 1 79 ALA H 1 80 GLY H 3.060 . 4.320 2.462 2.462 2.462 . 0 0 "[ ]" 1
1489 1 79 ALA HA 1 80 GLY H 2.705 . 3.610 3.581 3.581 3.581 . 0 0 "[ ]" 1
1490 1 79 ALA MB 1 80 GLY HA2 4.165 . 6.530 4.144 4.144 4.144 . 0 0 "[ ]" 1
1491 1 79 ALA MB 1 80 GLY HA3 4.165 . 6.530 3.765 3.765 3.765 . 0 0 "[ ]" 1
1492 1 80 GLY H 1 83 ASP QB 4.090 . 6.380 3.641 3.641 3.641 . 0 0 "[ ]" 1
1493 1 80 GLY QA 1 81 GLU QG 4.060 . 6.320 3.303 3.303 3.303 . 0 0 "[ ]" 1
1494 1 80 GLY QA 1 83 ASP H 3.500 . 5.200 4.600 4.600 4.600 . 0 0 "[ ]" 1
1495 1 80 GLY HA2 1 81 GLU HG2 4.525 . 7.250 5.181 5.181 5.181 . 0 0 "[ ]" 1
1496 1 80 GLY HA2 1 81 GLU HG3 4.525 . 7.250 3.466 3.466 3.466 . 0 0 "[ ]" 1
1497 1 80 GLY HA3 1 81 GLU HG2 4.525 . 7.250 6.104 6.104 6.104 . 0 0 "[ ]" 1
1498 1 80 GLY HA3 1 81 GLU HG3 4.525 . 7.250 4.488 4.488 4.488 . 0 0 "[ ]" 1
1499 1 81 GLU H 1 81 GLU HG2 3.215 . 4.630 3.929 3.929 3.929 . 0 0 "[ ]" 1
1500 1 81 GLU H 1 81 GLU QG 2.885 . 3.970 2.455 2.455 2.455 . 0 0 "[ ]" 1
1501 1 81 GLU H 1 81 GLU HG3 3.215 . 4.630 2.480 2.480 2.480 . 0 0 "[ ]" 1
1502 1 81 GLU HA 1 84 TYR QB 4.090 . 6.380 5.413 5.413 5.413 . 0 0 "[ ]" 1
1503 1 81 GLU HA 1 84 TYR HD1 3.185 . 4.570 3.959 3.959 3.959 . 0 0 "[ ]" 1
1504 1 81 GLU HA 1 84 TYR HE1 3.280 . 4.760 3.488 3.488 3.488 . 0 0 "[ ]" 1
1505 1 82 GLN H 1 82 GLN QG 4.090 . 6.380 2.819 2.819 2.819 . 0 0 "[ ]" 1
1506 1 82 GLN H 1 83 ASP H 2.720 . 3.640 2.274 2.274 2.274 . 0 0 "[ ]" 1
1507 1 82 GLN H 1 84 TYR H 3.650 . 5.500 4.704 4.704 4.704 . 0 0 "[ ]" 1
1508 1 82 GLN HA 1 83 ASP H 2.675 . 3.550 3.224 3.224 3.224 . 0 0 "[ ]" 1
1509 1 82 GLN HA 1 84 TYR H 3.280 . 4.760 3.337 3.337 3.337 . 0 0 "[ ]" 1
1510 1 82 GLN QB 1 84 TYR H 4.090 . 6.380 4.400 4.400 4.400 . 0 0 "[ ]" 1
1511 1 82 GLN HB2 1 83 ASP H 3.650 . 5.500 3.773 3.773 3.773 . 0 0 "[ ]" 1
1512 1 82 GLN HB3 1 83 ASP H 3.650 . 5.500 4.383 4.383 4.383 . 0 0 "[ ]" 1
1513 1 82 GLN QG 1 83 ASP H 4.090 . 6.380 4.416 4.416 4.416 . 0 0 "[ ]" 1
1514 1 82 GLN QG 1 84 TYR H 4.090 . 6.380 5.272 5.272 5.272 . 0 0 "[ ]" 1
1515 1 83 ASP H 1 83 ASP HB2 2.425 . 3.050 2.491 2.491 2.491 . 0 0 "[ ]" 1
1516 1 83 ASP H 1 83 ASP QB 2.295 . 2.790 2.345 2.345 2.345 . 0 0 "[ ]" 1
1517 1 83 ASP H 1 83 ASP HB3 2.425 . 3.050 2.858 2.858 2.858 . 0 0 "[ ]" 1
1518 1 83 ASP H 1 84 TYR H 2.425 . 3.050 2.940 2.940 2.940 . 0 0 "[ ]" 1
1519 1 83 ASP H 1 84 TYR HD1 3.355 . 4.910 2.610 2.610 2.610 . 0 0 "[ ]" 1
1520 1 83 ASP HB2 1 84 TYR HD1 3.650 . 5.500 4.168 4.168 4.168 . 0 0 "[ ]" 1
1521 1 83 ASP HB3 1 84 TYR HD1 3.650 . 5.500 3.213 3.213 3.213 . 0 0 "[ ]" 1
1522 1 84 TYR H 1 84 TYR HB2 2.890 . 3.980 2.413 2.413 2.413 . 0 0 "[ ]" 1
1523 1 84 TYR H 1 84 TYR QB 2.765 . 3.730 2.380 2.380 2.380 . 0 0 "[ ]" 1
1524 1 84 TYR H 1 84 TYR HB3 2.890 . 3.980 3.641 3.641 3.641 . 0 0 "[ ]" 1
1525 1 84 TYR H 1 84 TYR HD1 2.660 . 3.520 2.563 2.563 2.563 . 0 0 "[ ]" 1
1526 1 84 TYR H 1 84 TYR HE1 3.510 . 5.220 5.016 5.016 5.016 . 0 0 "[ ]" 1
1527 1 84 TYR H 1 85 GLU H 3.015 . 4.230 4.437 4.437 4.437 0.207 1 0 "[ ]" 1
1528 1 84 TYR HA 1 84 TYR HD1 2.505 . 3.210 3.025 3.025 3.025 . 0 0 "[ ]" 1
1529 1 84 TYR HA 1 84 TYR HE1 3.525 . 5.250 4.846 4.846 4.846 . 0 0 "[ ]" 1
1530 1 84 TYR HA 1 85 GLU H 2.380 . 2.960 2.539 2.539 2.539 . 0 0 "[ ]" 1
1531 1 84 TYR QB 1 85 GLU H 2.960 . 4.120 2.131 2.131 2.131 . 0 0 "[ ]" 1
1532 1 84 TYR QB 1 87 LEU QB 4.530 . 7.260 5.542 5.542 5.542 . 0 0 "[ ]" 1
1533 1 84 TYR HD2 1 85 GLU H 3.260 . 4.720 3.802 3.802 3.802 . 0 0 "[ ]" 1
1534 1 84 TYR QE 1 127 ARG QD 5.155 . 8.510 3.706 3.706 3.706 . 0 0 "[ ]" 1
1535 1 84 TYR HE2 1 127 ARG HB2 3.650 . 5.500 2.697 2.697 2.697 . 0 0 "[ ]" 1
1536 1 84 TYR HE2 1 127 ARG HB3 3.650 . 5.500 2.600 2.600 2.600 . 0 0 "[ ]" 1
1537 1 84 TYR HE2 1 127 ARG QD 4.090 . 6.380 4.092 4.092 4.092 . 0 0 "[ ]" 1
1538 1 85 GLU H 1 85 GLU HB2 2.905 . 4.010 3.707 3.707 3.707 . 0 0 "[ ]" 1
1539 1 85 GLU H 1 85 GLU QB 2.695 . 3.590 3.280 3.280 3.280 . 0 0 "[ ]" 1
1540 1 85 GLU H 1 85 GLU HB3 2.905 . 4.010 3.657 3.657 3.657 . 0 0 "[ ]" 1
1541 1 85 GLU H 1 85 GLU HG2 3.650 . 5.500 1.985 1.985 1.985 . 0 0 "[ ]" 1
1542 1 85 GLU H 1 85 GLU QG 3.385 . 4.970 1.967 1.967 1.967 . 0 0 "[ ]" 1
1543 1 85 GLU H 1 85 GLU HG3 3.650 . 5.500 3.231 3.231 3.231 . 0 0 "[ ]" 1
1544 1 85 GLU H 1 86 VAL H 3.245 . 4.690 4.347 4.347 4.347 . 0 0 "[ ]" 1
1545 1 85 GLU HA 1 86 VAL H 2.225 . 2.650 2.172 2.172 2.172 . 0 0 "[ ]" 1
1546 1 85 GLU QB 1 86 VAL H 2.975 . 4.150 3.038 3.038 3.038 . 0 0 "[ ]" 1
1547 1 86 VAL H 1 86 VAL HB 2.905 . 4.010 2.594 2.594 2.594 . 0 0 "[ ]" 1
1548 1 86 VAL H 1 86 VAL MG2 2.740 . 3.680 1.952 1.952 1.952 . 0 0 "[ ]" 1
1549 1 86 VAL H 1 87 LEU H 3.075 . 4.350 4.185 4.185 4.185 . 0 0 "[ ]" 1
1550 1 86 VAL MG1 1 87 LEU H 3.980 . 6.160 3.475 3.475 3.475 . 0 0 "[ ]" 1
1551 1 87 LEU H 1 87 LEU MD1 4.165 . 6.530 3.865 3.865 3.865 . 0 0 "[ ]" 1
1552 1 87 LEU H 1 87 LEU QD 3.865 . 5.930 3.594 3.594 3.594 . 0 0 "[ ]" 1
1553 1 87 LEU H 1 87 LEU MD2 4.165 . 6.530 4.273 4.273 4.273 . 0 0 "[ ]" 1
1554 1 87 LEU H 1 87 LEU HG 3.650 . 5.500 4.483 4.483 4.483 . 0 0 "[ ]" 1
1555 1 87 LEU H 1 88 LEU H 2.970 . 4.140 2.765 2.765 2.765 . 0 0 "[ ]" 1
1556 1 87 LEU HA 1 87 LEU MD1 3.685 . 5.570 2.247 2.247 2.247 . 0 0 "[ ]" 1
1557 1 87 LEU HA 1 87 LEU MD2 3.685 . 5.570 3.825 3.825 3.825 . 0 0 "[ ]" 1
1558 1 87 LEU HA 1 116 LEU QD 4.640 . 7.480 4.999 4.999 4.999 . 0 0 "[ ]" 1
1559 1 87 LEU HA 1 117 VAL H 2.240 . 2.680 2.794 2.794 2.794 0.114 1 0 "[ ]" 1
1560 1 87 LEU HA 1 117 VAL HB 2.675 . 3.550 3.577 3.577 3.577 0.027 1 0 "[ ]" 1
1561 1 87 LEU QD 1 116 LEU QB 4.055 . 6.310 2.258 2.258 2.258 . 0 0 "[ ]" 1
1562 1 87 LEU QD 1 121 ALA HA 3.555 . 5.310 1.906 1.906 1.906 . 0 0 "[ ]" 1
1563 1 87 LEU QD 1 121 ALA MB 4.205 . 6.610 2.118 2.118 2.118 . 0 0 "[ ]" 1
1564 1 87 LEU QD 1 122 GLU HA 4.795 . 7.790 5.626 5.626 5.626 . 0 0 "[ ]" 1
1565 1 87 LEU QD 1 125 TRP H 4.950 . 8.100 5.805 5.805 5.805 . 0 0 "[ ]" 1
1566 1 87 LEU QD 1 125 TRP HE1 4.250 . 6.700 3.580 3.580 3.580 . 0 0 "[ ]" 1
1567 1 87 LEU QD 1 128 VAL MG2 4.050 . 6.300 3.351 3.351 3.351 . 0 0 "[ ]" 1
1568 1 87 LEU MD1 1 116 LEU HB2 4.945 . 8.090 2.449 2.449 2.449 . 0 0 "[ ]" 1
1569 1 87 LEU MD1 1 116 LEU HB3 4.945 . 8.090 3.464 3.464 3.464 . 0 0 "[ ]" 1
1570 1 87 LEU MD2 1 116 LEU HB2 4.945 . 8.090 3.274 3.274 3.274 . 0 0 "[ ]" 1
1571 1 87 LEU MD2 1 116 LEU HB3 4.945 . 8.090 2.949 2.949 2.949 . 0 0 "[ ]" 1
1572 1 87 LEU O 1 117 VAL H 1.900 . 2.000 2.036 2.036 2.036 0.036 1 0 "[ ]" 1
1573 1 87 LEU O 1 117 VAL N 2.850 2.700 3.000 2.921 2.921 2.921 . 0 0 "[ ]" 1
1574 1 88 LEU H 1 88 LEU HB2 2.935 . 4.070 3.942 3.942 3.942 . 0 0 "[ ]" 1
1575 1 88 LEU H 1 88 LEU HB3 2.935 . 4.070 3.288 3.288 3.288 . 0 0 "[ ]" 1
1576 1 88 LEU H 1 88 LEU MD1 4.165 . 6.530 3.834 3.834 3.834 . 0 0 "[ ]" 1
1577 1 88 LEU H 1 88 LEU MD2 4.165 . 6.530 3.179 3.179 3.179 . 0 0 "[ ]" 1
1578 1 88 LEU H 1 88 LEU HG 3.555 . 5.310 2.256 2.256 2.256 . 0 0 "[ ]" 1
1579 1 88 LEU HA 1 88 LEU HB2 2.210 . 2.620 2.425 2.425 2.425 . 0 0 "[ ]" 1
1580 1 88 LEU HA 1 88 LEU QB 2.075 . 2.350 2.177 2.177 2.177 . 0 0 "[ ]" 1
1581 1 88 LEU HA 1 88 LEU HB3 2.210 . 2.620 2.463 2.463 2.463 . 0 0 "[ ]" 1
1582 1 88 LEU HA 1 88 LEU MD1 3.545 . 5.290 3.755 3.755 3.755 . 0 0 "[ ]" 1
1583 1 88 LEU HA 1 88 LEU QD 2.985 . 4.170 3.426 3.426 3.426 . 0 0 "[ ]" 1
1584 1 88 LEU HA 1 88 LEU MD2 3.545 . 5.290 3.954 3.954 3.954 . 0 0 "[ ]" 1
1585 1 88 LEU HA 1 88 LEU HG 2.890 . 3.980 3.533 3.533 3.533 . 0 0 "[ ]" 1
1586 1 88 LEU HA 1 89 VAL H 2.455 . 3.110 2.165 2.165 2.165 . 0 0 "[ ]" 1
1587 1 88 LEU QB 1 89 VAL H 3.500 . 5.200 3.400 3.400 3.400 . 0 0 "[ ]" 1
1588 1 88 LEU QB 1 111 PHE QB 3.425 . 5.050 3.627 3.627 3.627 . 0 0 "[ ]" 1
1589 1 88 LEU QD 1 89 VAL H 3.710 . 5.620 3.980 3.980 3.980 . 0 0 "[ ]" 1
1590 1 88 LEU QD 1 91 SER HB2 4.300 . 6.800 4.542 4.542 4.542 . 0 0 "[ ]" 1
1591 1 88 LEU QD 1 91 SER HB3 4.360 . 6.920 3.295 3.295 3.295 . 0 0 "[ ]" 1
1592 1 88 LEU QD 1 111 PHE H 4.950 . 8.100 4.991 4.991 4.991 . 0 0 "[ ]" 1
1593 1 88 LEU QD 1 111 PHE QB 4.175 . 6.550 2.701 2.701 2.701 . 0 0 "[ ]" 1
1594 1 88 LEU QD 1 111 PHE QD 4.230 . 6.660 2.263 2.263 2.263 . 0 0 "[ ]" 1
1595 1 88 LEU QD 1 112 GLY H 4.950 . 8.100 4.984 4.984 4.984 . 0 0 "[ ]" 1
1596 1 88 LEU QD 1 115 LYS QB 5.390 . 8.980 3.146 3.146 3.146 . 0 0 "[ ]" 1
1597 1 88 LEU QD 1 116 LEU H 4.950 . 8.100 5.153 5.153 5.153 . 0 0 "[ ]" 1
1598 1 88 LEU QD 1 116 LEU QD 4.980 . 8.160 3.910 3.910 3.910 . 0 0 "[ ]" 1
1599 1 88 LEU QD 1 117 VAL H 4.950 . 8.100 5.107 5.107 5.107 . 0 0 "[ ]" 1
1600 1 88 LEU QD 1 130 ILE MD 4.315 . 6.830 3.743 3.743 3.743 . 0 0 "[ ]" 1
1601 1 88 LEU MD1 1 89 VAL H 4.165 . 6.530 4.111 4.111 4.111 . 0 0 "[ ]" 1
1602 1 88 LEU MD1 1 111 PHE HA 4.165 . 6.530 5.316 5.316 5.316 . 0 0 "[ ]" 1
1603 1 88 LEU MD1 1 111 PHE HB2 5.040 . 8.280 4.268 4.268 4.268 . 0 0 "[ ]" 1
1604 1 88 LEU MD1 1 111 PHE HB3 5.040 . 8.280 3.836 3.836 3.836 . 0 0 "[ ]" 1
1605 1 88 LEU MD1 1 111 PHE QD 4.405 . 7.010 2.314 2.314 2.314 . 0 0 "[ ]" 1
1606 1 88 LEU MD1 1 116 LEU MD1 6.250 . 10.700 7.113 7.113 7.113 . 0 0 "[ ]" 1
1607 1 88 LEU MD1 1 116 LEU MD2 6.250 . 10.700 5.952 5.952 5.952 . 0 0 "[ ]" 1
1608 1 88 LEU MD2 1 89 VAL H 4.165 . 6.530 5.315 5.315 5.315 . 0 0 "[ ]" 1
1609 1 88 LEU MD2 1 111 PHE HA 4.165 . 6.530 5.155 5.155 5.155 . 0 0 "[ ]" 1
1610 1 88 LEU MD2 1 111 PHE HB2 5.040 . 8.280 3.094 3.094 3.094 . 0 0 "[ ]" 1
1611 1 88 LEU MD2 1 111 PHE HB3 5.040 . 8.280 3.185 3.185 3.185 . 0 0 "[ ]" 1
1612 1 88 LEU MD2 1 111 PHE QD 4.405 . 7.010 3.197 3.197 3.197 . 0 0 "[ ]" 1
1613 1 88 LEU MD2 1 116 LEU MD1 6.250 . 10.700 5.510 5.510 5.510 . 0 0 "[ ]" 1
1614 1 88 LEU MD2 1 116 LEU MD2 6.250 . 10.700 4.090 4.090 4.090 . 0 0 "[ ]" 1
1615 1 88 LEU HG 1 89 VAL H 3.650 . 5.500 4.549 4.549 4.549 . 0 0 "[ ]" 1
1616 1 89 VAL H 1 89 VAL HB 2.830 . 3.860 3.619 3.619 3.619 . 0 0 "[ ]" 1
1617 1 89 VAL H 1 89 VAL QG 3.015 . 4.230 1.927 1.927 1.927 . 0 0 "[ ]" 1
1618 1 89 VAL HA 1 90 THR H 2.350 . 2.900 2.602 2.602 2.602 . 0 0 "[ ]" 1
1619 1 89 VAL HB 1 90 THR H 2.470 . 3.140 2.148 2.148 2.148 . 0 0 "[ ]" 1
1620 1 90 THR H 1 90 THR HB 2.610 . 3.420 2.283 2.283 2.283 . 0 0 "[ ]" 1
1621 1 90 THR H 1 90 THR MG 3.265 . 4.730 2.709 2.709 2.709 . 0 0 "[ ]" 1
1622 1 90 THR H 1 91 SER H 3.170 . 4.540 4.596 4.596 4.596 0.056 1 0 "[ ]" 1
1623 1 90 THR MG 1 91 SER H 3.080 . 4.360 3.566 3.566 3.566 . 0 0 "[ ]" 1
1624 1 90 THR MG 1 91 SER HA 3.450 . 5.100 3.854 3.854 3.854 . 0 0 "[ ]" 1
1625 1 90 THR MG 1 92 SER H 4.165 . 6.530 4.196 4.196 4.196 . 0 0 "[ ]" 1
1626 1 91 SER H 1 91 SER HB3 2.795 . 3.790 3.104 3.104 3.104 . 0 0 "[ ]" 1
1627 1 91 SER H 1 92 SER H 3.030 . 4.260 4.414 4.414 4.414 0.154 1 0 "[ ]" 1
1628 1 91 SER HA 1 92 SER H 2.425 . 3.050 2.149 2.149 2.149 . 0 0 "[ ]" 1
1629 1 91 SER HA 1 93 PHE QD 4.710 . 7.620 5.601 5.601 5.601 . 0 0 "[ ]" 1
1630 1 91 SER HB2 1 111 PHE HE2 2.455 . 3.110 3.114 3.114 3.114 0.004 1 0 "[ ]" 1
1631 1 91 SER HB2 1 111 PHE HZ 2.920 . 4.040 4.051 4.051 4.051 0.011 1 0 "[ ]" 1
1632 1 91 SER HB3 1 111 PHE HE2 2.535 . 3.270 2.003 2.003 2.003 . 0 0 "[ ]" 1
1633 1 91 SER HB3 1 111 PHE HZ 2.890 . 3.980 3.880 3.880 3.880 . 0 0 "[ ]" 1
1634 1 92 SER HA 1 92 SER HB2 2.300 . 2.800 2.454 2.454 2.454 . 0 0 "[ ]" 1
1635 1 92 SER HA 1 92 SER HB3 2.300 . 2.800 2.480 2.480 2.480 . 0 0 "[ ]" 1
1636 1 92 SER HA 1 93 PHE H 2.485 . 3.170 2.199 2.199 2.199 . 0 0 "[ ]" 1
1637 1 92 SER HA 1 94 MET H 2.905 . 4.010 4.058 4.058 4.058 0.048 1 0 "[ ]" 1
1638 1 93 PHE H 1 94 MET H 2.455 . 3.110 2.168 2.168 2.168 . 0 0 "[ ]" 1
1639 1 93 PHE H 1 94 MET HA 3.555 . 5.310 4.804 4.804 4.804 . 0 0 "[ ]" 1
1640 1 93 PHE HA 1 93 PHE HB2 2.350 . 2.900 3.019 3.019 3.019 0.119 1 0 "[ ]" 1
1641 1 93 PHE HA 1 93 PHE QB 2.250 . 2.700 2.353 2.353 2.353 . 0 0 "[ ]" 1
1642 1 93 PHE HA 1 93 PHE HB3 2.350 . 2.900 2.455 2.455 2.455 . 0 0 "[ ]" 1
1643 1 93 PHE HA 1 109 ARG QD 3.255 . 4.710 3.847 3.847 3.847 . 0 0 "[ ]" 1
1644 1 93 PHE HD1 1 109 ARG HB2 3.060 . 4.320 3.727 3.727 3.727 . 0 0 "[ ]" 1
1645 1 93 PHE HD1 1 109 ARG HB3 3.060 . 4.320 4.015 4.015 4.015 . 0 0 "[ ]" 1
1646 1 93 PHE HD1 1 109 ARG QD 3.035 . 4.270 2.917 2.917 2.917 . 0 0 "[ ]" 1
1647 1 93 PHE HD1 1 109 ARG HG2 3.045 . 4.290 2.713 2.713 2.713 . 0 0 "[ ]" 1
1648 1 93 PHE HD1 1 109 ARG HG3 3.045 . 4.290 4.299 4.299 4.299 0.009 1 0 "[ ]" 1
1649 1 93 PHE HD2 1 94 MET H 3.385 . 4.970 4.322 4.322 4.322 . 0 0 "[ ]" 1
1650 1 93 PHE HE2 1 109 ARG QD 3.485 . 5.170 5.261 5.261 5.261 0.091 1 0 "[ ]" 1
1651 1 93 PHE HE2 1 109 ARG QG 4.060 . 6.320 5.171 5.171 5.171 . 0 0 "[ ]" 1
1652 1 94 MET H 1 94 MET ME 4.165 . 6.530 4.999 4.999 4.999 . 0 0 "[ ]" 1
1653 1 94 MET H 1 94 MET HG2 3.525 . 5.250 4.681 4.681 4.681 . 0 0 "[ ]" 1
1654 1 94 MET H 1 94 MET QG 3.335 . 4.870 3.664 3.664 3.664 . 0 0 "[ ]" 1
1655 1 94 MET H 1 94 MET HG3 3.525 . 5.250 3.827 3.827 3.827 . 0 0 "[ ]" 1
1656 1 94 MET H 1 95 SER H 3.155 . 4.510 4.400 4.400 4.400 . 0 0 "[ ]" 1
1657 1 94 MET HB2 1 95 SER H 3.465 . 5.130 3.558 3.558 3.558 . 0 0 "[ ]" 1
1658 1 94 MET ME 1 94 MET QG 2.720 . 3.640 2.140 2.140 2.140 . 0 0 "[ ]" 1
1659 1 94 MET ME 1 95 SER H 3.945 . 6.090 3.208 3.208 3.208 . 0 0 "[ ]" 1
1660 1 94 MET ME 1 97 SER H 4.165 . 6.530 5.087 5.087 5.087 . 0 0 "[ ]" 1
1661 1 94 MET ME 1 98 GLU H 3.700 . 5.600 4.498 4.498 4.498 . 0 0 "[ ]" 1
1662 1 94 MET ME 1 98 GLU QB 3.935 . 6.070 3.480 3.480 3.480 . 0 0 "[ ]" 1
1663 1 94 MET ME 1 104 ASN H 4.165 . 6.530 5.065 5.065 5.065 . 0 0 "[ ]" 1
1664 1 94 MET ME 1 104 ASN QB 4.355 . 6.910 3.956 3.956 3.956 . 0 0 "[ ]" 1
1665 1 94 MET ME 1 105 PRO HA 2.830 . 3.860 2.098 2.098 2.098 . 0 0 "[ ]" 1
1666 1 94 MET ME 1 105 PRO QD 3.935 . 6.070 4.374 4.374 4.374 . 0 0 "[ ]" 1
1667 1 94 MET ME 1 106 ASN HA 4.025 . 6.250 3.359 3.359 3.359 . 0 0 "[ ]" 1
1668 1 94 MET QG 1 95 SER H 3.190 . 4.580 2.820 2.820 2.820 . 0 0 "[ ]" 1
1669 1 95 SER H 1 95 SER HB3 2.595 . 3.390 2.876 2.876 2.876 . 0 0 "[ ]" 1
1670 1 95 SER H 1 98 GLU H 2.955 . 4.110 3.897 3.897 3.897 . 0 0 "[ ]" 1
1671 1 95 SER H 1 98 GLU QB 3.175 . 4.550 4.168 4.168 4.168 . 0 0 "[ ]" 1
1672 1 95 SER H 1 99 SER H 3.340 . 4.880 3.939 3.939 3.939 . 0 0 "[ ]" 1
1673 1 95 SER HB2 1 97 SER H 3.650 . 5.500 3.521 3.521 3.521 . 0 0 "[ ]" 1
1674 1 96 PRO HA 1 98 GLU H 3.650 . 5.500 5.081 5.081 5.081 . 0 0 "[ ]" 1
1675 1 96 PRO HA 1 99 SER H 3.015 . 4.230 4.169 4.169 4.169 . 0 0 "[ ]" 1
1676 1 96 PRO HA 1 136 TYR HD2 2.735 . 3.670 3.706 3.706 3.706 0.036 1 0 "[ ]" 1
1677 1 96 PRO HA 1 136 TYR QE 4.715 . 7.630 5.901 5.901 5.901 . 0 0 "[ ]" 1
1678 1 96 PRO HB2 1 136 TYR HD2 3.650 . 5.500 5.503 5.503 5.503 0.003 1 0 "[ ]" 1
1679 1 96 PRO HB3 1 136 TYR HD2 3.650 . 5.500 4.107 4.107 4.107 . 0 0 "[ ]" 1
1680 1 96 PRO HG2 1 97 SER H 3.650 . 5.500 4.088 4.088 4.088 . 0 0 "[ ]" 1
1681 1 96 PRO HG3 1 97 SER H 3.650 . 5.500 4.918 4.918 4.918 . 0 0 "[ ]" 1
1682 1 97 SER HA 1 100 ARG H 3.000 . 4.200 3.871 3.871 3.871 . 0 0 "[ ]" 1
1683 1 98 GLU H 1 98 GLU QG 3.130 . 4.460 1.962 1.962 1.962 . 0 0 "[ ]" 1
1684 1 98 GLU H 1 99 SER H 2.845 . 3.890 2.635 2.635 2.635 . 0 0 "[ ]" 1
1685 1 98 GLU H 1 103 SER HB2 3.650 . 5.500 4.306 4.306 4.306 . 0 0 "[ ]" 1
1686 1 98 GLU H 1 104 ASN HD22 3.650 . 5.500 5.539 5.539 5.539 0.039 1 0 "[ ]" 1
1687 1 98 GLU HA 1 102 GLY H 2.565 . 3.330 2.514 2.514 2.514 . 0 0 "[ ]" 1
1688 1 98 GLU QB 1 104 ASN HD21 3.720 . 5.640 2.893 2.893 2.893 . 0 0 "[ ]" 1
1689 1 98 GLU QB 1 104 ASN HD22 3.685 . 5.570 3.103 3.103 3.103 . 0 0 "[ ]" 1
1690 1 98 GLU HB2 1 99 SER H 3.650 . 5.500 3.964 3.964 3.964 . 0 0 "[ ]" 1
1691 1 98 GLU HB3 1 99 SER H 3.650 . 5.500 4.155 4.155 4.155 . 0 0 "[ ]" 1
1692 1 98 GLU QG 1 104 ASN HD22 4.090 . 6.380 2.642 2.642 2.642 . 0 0 "[ ]" 1
1693 1 98 GLU QG 1 105 PRO HA 3.235 . 4.670 4.057 4.057 4.057 . 0 0 "[ ]" 1
1694 1 99 SER H 1 100 ARG H 2.780 . 3.760 2.693 2.693 2.693 . 0 0 "[ ]" 1
1695 1 99 SER H 1 136 TYR QD 4.720 . 7.640 6.171 6.171 6.171 . 0 0 "[ ]" 1
1696 1 100 ARG H 1 100 ARG HD2 3.260 . 4.720 4.132 4.132 4.132 . 0 0 "[ ]" 1
1697 1 100 ARG H 1 100 ARG QD 3.060 . 4.320 3.793 3.793 3.793 . 0 0 "[ ]" 1
1698 1 100 ARG H 1 100 ARG HD3 3.260 . 4.720 4.416 4.416 4.416 . 0 0 "[ ]" 1
1699 1 100 ARG H 1 100 ARG HG2 2.780 . 3.760 3.765 3.765 3.765 0.005 1 0 "[ ]" 1
1700 1 100 ARG H 1 100 ARG QG 2.680 . 3.560 2.479 2.479 2.479 . 0 0 "[ ]" 1
1701 1 100 ARG H 1 100 ARG HG3 2.780 . 3.760 2.514 2.514 2.514 . 0 0 "[ ]" 1
1702 1 100 ARG H 1 102 GLY H 2.875 . 3.950 3.790 3.790 3.790 . 0 0 "[ ]" 1
1703 1 100 ARG QB 1 101 SER H 2.760 . 3.720 1.943 1.943 1.943 . 0 0 "[ ]" 1
1704 1 100 ARG HB2 1 101 SER H 3.075 . 4.350 1.999 1.999 1.999 . 0 0 "[ ]" 1
1705 1 100 ARG HB3 1 101 SER H 3.075 . 4.350 2.652 2.652 2.652 . 0 0 "[ ]" 1
1706 1 100 ARG HD2 1 101 SER H 3.650 . 5.500 5.022 5.022 5.022 . 0 0 "[ ]" 1
1707 1 100 ARG HD3 1 101 SER H 3.650 . 5.500 4.167 4.167 4.167 . 0 0 "[ ]" 1
1708 1 100 ARG QG 1 101 SER H 3.290 . 4.780 3.946 3.946 3.946 . 0 0 "[ ]" 1
1709 1 100 ARG HG2 1 101 SER H 3.650 . 5.500 4.617 4.617 4.617 . 0 0 "[ ]" 1
1710 1 100 ARG HG3 1 101 SER H 3.650 . 5.500 4.285 4.285 4.285 . 0 0 "[ ]" 1
1711 1 101 SER H 1 101 SER HB2 2.720 . 3.640 3.225 3.225 3.225 . 0 0 "[ ]" 1
1712 1 101 SER H 1 101 SER QB 2.485 . 3.170 2.865 2.865 2.865 . 0 0 "[ ]" 1
1713 1 101 SER H 1 101 SER HB3 2.720 . 3.640 3.207 3.207 3.207 . 0 0 "[ ]" 1
1714 1 101 SER H 1 102 GLY H 2.330 . 2.860 2.192 2.192 2.192 . 0 0 "[ ]" 1
1715 1 101 SER H 1 103 SER H 2.920 . 4.040 4.126 4.126 4.126 0.086 1 0 "[ ]" 1
1716 1 101 SER HA 1 102 GLY H 2.565 . 3.330 2.856 2.856 2.856 . 0 0 "[ ]" 1
1717 1 102 GLY H 1 103 SER H 2.350 . 2.900 1.996 1.996 1.996 . 0 0 "[ ]" 1
1718 1 102 GLY H 1 103 SER HA 3.650 . 5.500 4.699 4.699 4.699 . 0 0 "[ ]" 1
1719 1 103 SER H 1 103 SER HB2 2.520 . 3.240 2.808 2.808 2.808 . 0 0 "[ ]" 1
1720 1 103 SER H 1 103 SER HB3 2.780 . 3.760 3.436 3.436 3.436 . 0 0 "[ ]" 1
1721 1 103 SER H 1 104 ASN H 2.795 . 3.790 4.144 4.144 4.144 0.354 1 0 "[ ]" 1
1722 1 103 SER H 1 104 ASN HD21 3.650 . 5.500 5.506 5.506 5.506 0.006 1 0 "[ ]" 1
1723 1 103 SER HA 1 104 ASN H 2.455 . 3.110 2.928 2.928 2.928 . 0 0 "[ ]" 1
1724 1 103 SER HB2 1 104 ASN H 3.590 . 5.380 3.444 3.444 3.444 . 0 0 "[ ]" 1
1725 1 103 SER HB2 1 104 ASN HD22 3.650 . 5.500 4.840 4.840 4.840 . 0 0 "[ ]" 1
1726 1 103 SER HB3 1 104 ASN H 2.970 . 4.140 1.875 1.875 1.875 . 0 0 "[ ]" 1
1727 1 103 SER HB3 1 104 ASN HD21 3.650 . 5.500 3.677 3.677 3.677 . 0 0 "[ ]" 1
1728 1 103 SER HB3 1 104 ASN HD22 3.650 . 5.500 3.395 3.395 3.395 . 0 0 "[ ]" 1
1729 1 104 ASN H 1 106 ASN H 3.540 . 5.280 5.517 5.517 5.517 0.237 1 0 "[ ]" 1
1730 1 104 ASN HA 1 104 ASN HD21 3.650 . 5.500 3.921 3.921 3.921 . 0 0 "[ ]" 1
1731 1 104 ASN HA 1 106 ASN H 2.640 . 3.480 3.365 3.365 3.365 . 0 0 "[ ]" 1
1732 1 104 ASN QB 1 107 ARG QB 3.800 . 5.800 3.443 3.443 3.443 . 0 0 "[ ]" 1
1733 1 104 ASN HB2 1 107 ARG HB2 4.400 . 7.000 3.636 3.636 3.636 . 0 0 "[ ]" 1
1734 1 104 ASN HB2 1 107 ARG HB3 4.400 . 7.000 4.817 4.817 4.817 . 0 0 "[ ]" 1
1735 1 104 ASN HB3 1 107 ARG HB2 4.400 . 7.000 5.021 5.021 5.021 . 0 0 "[ ]" 1
1736 1 104 ASN HB3 1 107 ARG HB3 4.400 . 7.000 5.834 5.834 5.834 . 0 0 "[ ]" 1
1737 1 105 PRO HA 1 106 ASN HD21 3.435 . 5.070 4.264 4.264 4.264 . 0 0 "[ ]" 1
1738 1 105 PRO QB 1 106 ASN H 2.860 . 3.920 3.535 3.535 3.535 . 0 0 "[ ]" 1
1739 1 105 PRO QB 1 106 ASN HD21 3.720 . 5.640 3.251 3.251 3.251 . 0 0 "[ ]" 1
1740 1 105 PRO HB2 1 106 ASN H 2.955 . 4.110 3.741 3.741 3.741 . 0 0 "[ ]" 1
1741 1 105 PRO HB3 1 106 ASN H 2.955 . 4.110 4.347 4.347 4.347 0.237 1 0 "[ ]" 1
1742 1 105 PRO QD 1 106 ASN H 3.215 . 4.630 2.330 2.330 2.330 . 0 0 "[ ]" 1
1743 1 105 PRO HD2 1 106 ASN H 3.295 . 4.790 2.358 2.358 2.358 . 0 0 "[ ]" 1
1744 1 105 PRO HD3 1 106 ASN H 3.295 . 4.790 3.647 3.647 3.647 . 0 0 "[ ]" 1
1745 1 105 PRO QG 1 106 ASN H 3.690 . 5.580 3.144 3.144 3.144 . 0 0 "[ ]" 1
1746 1 106 ASN H 1 106 ASN HB2 2.780 . 3.760 2.867 2.867 2.867 . 0 0 "[ ]" 1
1747 1 106 ASN H 1 106 ASN QB 2.660 . 3.520 2.761 2.761 2.761 . 0 0 "[ ]" 1
1748 1 106 ASN H 1 106 ASN HB3 2.780 . 3.760 3.604 3.604 3.604 . 0 0 "[ ]" 1
1749 1 106 ASN H 1 106 ASN HD21 3.650 . 5.500 3.972 3.972 3.972 . 0 0 "[ ]" 1
1750 1 106 ASN H 1 106 ASN HD22 3.650 . 5.500 5.483 5.483 5.483 . 0 0 "[ ]" 1
1751 1 106 ASN HA 1 106 ASN HD21 2.970 . 4.140 2.621 2.621 2.621 . 0 0 "[ ]" 1
1752 1 106 ASN HA 1 106 ASN HD22 2.905 . 4.010 3.460 3.460 3.460 . 0 0 "[ ]" 1
1753 1 106 ASN HD21 1 107 ARG H 3.650 . 5.500 4.708 4.708 4.708 . 0 0 "[ ]" 1
1754 1 108 VAL H 1 108 VAL HB 2.830 . 3.860 3.796 3.796 3.796 . 0 0 "[ ]" 1
1755 1 108 VAL HA 1 108 VAL MG1 2.785 . 3.770 2.445 2.445 2.445 . 0 0 "[ ]" 1
1756 1 108 VAL HA 1 108 VAL MG2 2.785 . 3.770 3.186 3.186 3.186 . 0 0 "[ ]" 1
1757 1 108 VAL HA 1 109 ARG H 2.410 . 3.020 2.236 2.236 2.236 . 0 0 "[ ]" 1
1758 1 108 VAL HA 1 146 PHE HZ 2.765 . 3.730 4.060 4.060 4.060 0.330 1 0 "[ ]" 1
1759 1 108 VAL HB 1 146 PHE HZ 3.075 . 4.350 1.871 1.871 1.871 . 0 0 "[ ]" 1
1760 1 108 VAL QG 1 109 ARG H 3.905 . 6.010 3.445 3.445 3.445 . 0 0 "[ ]" 1
1761 1 108 VAL QG 1 146 PHE HD2 4.945 . 8.090 3.614 3.614 3.614 . 0 0 "[ ]" 1
1762 1 108 VAL QG 1 146 PHE HE2 3.425 . 5.050 1.806 1.806 1.806 . 0 0 "[ ]" 1
1763 1 108 VAL QG 1 146 PHE HZ 3.580 . 5.360 2.510 2.510 2.510 . 0 0 "[ ]" 1
1764 1 109 ARG H 1 109 ARG QB 2.825 . 3.850 2.510 2.510 2.510 . 0 0 "[ ]" 1
1765 1 109 ARG H 1 109 ARG HD2 3.650 . 5.500 4.389 4.389 4.389 . 0 0 "[ ]" 1
1766 1 109 ARG H 1 109 ARG HD3 3.650 . 5.500 4.126 4.126 4.126 . 0 0 "[ ]" 1
1767 1 109 ARG H 1 109 ARG QG 4.090 . 6.380 4.160 4.160 4.160 . 0 0 "[ ]" 1
1768 1 109 ARG H 1 110 MET H 3.015 . 4.230 4.416 4.416 4.416 0.186 1 0 "[ ]" 1
1769 1 109 ARG H 1 110 MET HG2 3.650 . 5.500 4.987 4.987 4.987 . 0 0 "[ ]" 1
1770 1 109 ARG QB 1 110 MET H 3.175 . 4.550 2.526 2.526 2.526 . 0 0 "[ ]" 1
1771 1 110 MET H 1 110 MET QB 2.800 . 3.800 2.811 2.811 2.811 . 0 0 "[ ]" 1
1772 1 110 MET H 1 110 MET HG2 3.340 . 4.880 4.010 4.010 4.010 . 0 0 "[ ]" 1
1773 1 110 MET H 1 110 MET HG3 2.315 . 2.830 2.850 2.850 2.850 0.020 1 0 "[ ]" 1
1774 1 110 MET H 1 111 PHE H 3.185 . 4.570 4.419 4.419 4.419 . 0 0 "[ ]" 1
1775 1 110 MET HA 1 110 MET HG2 2.470 . 3.140 2.635 2.635 2.635 . 0 0 "[ ]" 1
1776 1 110 MET HA 1 110 MET HG3 2.455 . 3.110 3.069 3.069 3.069 . 0 0 "[ ]" 1
1777 1 110 MET HA 1 111 PHE H 2.315 . 2.830 2.537 2.537 2.537 . 0 0 "[ ]" 1
1778 1 110 MET QB 1 111 PHE H 2.765 . 3.730 2.189 2.189 2.189 . 0 0 "[ ]" 1
1779 1 110 MET HB2 1 111 PHE H 2.890 . 3.980 3.206 3.206 3.206 . 0 0 "[ ]" 1
1780 1 110 MET HB3 1 111 PHE H 2.890 . 3.980 2.229 2.229 2.229 . 0 0 "[ ]" 1
1781 1 110 MET HG2 1 111 PHE HD1 3.650 . 5.500 4.914 4.914 4.914 . 0 0 "[ ]" 1
1782 1 110 MET HG3 1 111 PHE HD1 3.650 . 5.500 5.601 5.601 5.601 0.101 1 0 "[ ]" 1
1783 1 111 PHE H 1 111 PHE HB2 2.985 . 4.170 2.911 2.911 2.911 . 0 0 "[ ]" 1
1784 1 111 PHE H 1 111 PHE HB3 2.985 . 4.170 3.915 3.915 3.915 . 0 0 "[ ]" 1
1785 1 111 PHE H 1 111 PHE HD1 2.675 . 3.550 2.198 2.198 2.198 . 0 0 "[ ]" 1
1786 1 111 PHE H 1 111 PHE HE1 3.540 . 5.280 4.420 4.420 4.420 . 0 0 "[ ]" 1
1787 1 111 PHE H 1 112 GLY H 3.090 . 4.380 4.439 4.439 4.439 0.059 1 0 "[ ]" 1
1788 1 111 PHE HA 1 112 GLY H 2.330 . 2.860 2.394 2.394 2.394 . 0 0 "[ ]" 1
1789 1 111 PHE QB 1 115 LYS QG 4.525 . 7.250 3.666 3.666 3.666 . 0 0 "[ ]" 1
1790 1 111 PHE QD 1 115 LYS QD 5.150 . 8.500 2.826 2.826 2.826 . 0 0 "[ ]" 1
1791 1 111 PHE QD 1 115 LYS HE2 4.710 . 7.620 5.515 5.515 5.515 . 0 0 "[ ]" 1
1792 1 111 PHE QD 1 115 LYS HE3 4.710 . 7.620 5.385 5.385 5.385 . 0 0 "[ ]" 1
1793 1 111 PHE QD 1 115 LYS QG 4.980 . 8.160 3.158 3.158 3.158 . 0 0 "[ ]" 1
1794 1 111 PHE QD 1 116 LEU QD 6.010 . 10.220 5.451 5.451 5.451 . 0 0 "[ ]" 1
1795 1 112 GLY H 1 113 PRO HD2 3.170 . 4.540 4.141 4.141 4.141 . 0 0 "[ ]" 1
1796 1 112 GLY H 1 113 PRO HD3 3.215 . 4.630 4.797 4.797 4.797 0.167 1 0 "[ ]" 1
1797 1 112 GLY H 1 114 ASP H 3.075 . 4.350 4.387 4.387 4.387 0.037 1 0 "[ ]" 1
1798 1 112 GLY H 1 114 ASP QB 4.090 . 6.380 4.701 4.701 4.701 . 0 0 "[ ]" 1
1799 1 112 GLY H 1 115 LYS HB2 3.650 . 5.500 1.996 1.996 1.996 . 0 0 "[ ]" 1
1800 1 112 GLY H 1 115 LYS QB 3.525 . 5.250 1.986 1.986 1.986 . 0 0 "[ ]" 1
1801 1 112 GLY H 1 115 LYS HB3 3.650 . 5.500 3.589 3.589 3.589 . 0 0 "[ ]" 1
1802 1 112 GLY H 1 116 LEU QD 4.950 . 8.100 4.249 4.249 4.249 . 0 0 "[ ]" 1
1803 1 112 GLY QA 1 113 PRO HD3 2.355 . 2.910 2.342 2.342 2.342 . 0 0 "[ ]" 1
1804 1 112 GLY QA 1 114 ASP H 3.500 . 5.200 3.560 3.560 3.560 . 0 0 "[ ]" 1
1805 1 112 GLY QA 1 116 LEU QD 4.925 . 8.050 3.428 3.428 3.428 . 0 0 "[ ]" 1
1806 1 112 GLY HA2 1 113 PRO HB3 3.650 . 5.500 5.250 5.250 5.250 . 0 0 "[ ]" 1
1807 1 112 GLY HA2 1 113 PRO HD2 2.505 . 3.210 3.384 3.384 3.384 0.174 1 0 "[ ]" 1
1808 1 112 GLY HA2 1 113 PRO HD3 2.470 . 3.140 2.839 2.839 2.839 . 0 0 "[ ]" 1
1809 1 112 GLY HA2 1 116 LEU MD1 5.735 . 9.670 5.607 5.607 5.607 . 0 0 "[ ]" 1
1810 1 112 GLY HA2 1 116 LEU MD2 5.735 . 9.670 3.644 3.644 3.644 . 0 0 "[ ]" 1
1811 1 112 GLY HA3 1 113 PRO HB3 3.650 . 5.500 5.158 5.158 5.158 . 0 0 "[ ]" 1
1812 1 112 GLY HA3 1 113 PRO HD2 2.505 . 3.210 2.070 2.070 2.070 . 0 0 "[ ]" 1
1813 1 112 GLY HA3 1 113 PRO HD3 2.470 . 3.140 2.494 2.494 2.494 . 0 0 "[ ]" 1
1814 1 112 GLY HA3 1 116 LEU MD1 5.735 . 9.670 5.836 5.836 5.836 . 0 0 "[ ]" 1
1815 1 112 GLY HA3 1 116 LEU MD2 5.735 . 9.670 4.432 4.432 4.432 . 0 0 "[ ]" 1
1816 1 113 PRO HA 1 115 LYS H 2.985 . 4.170 4.151 4.151 4.151 . 0 0 "[ ]" 1
1817 1 113 PRO HA 1 116 LEU H 2.780 . 3.760 3.558 3.558 3.558 . 0 0 "[ ]" 1
1818 1 113 PRO HA 1 116 LEU QD 4.950 . 8.100 1.772 1.772 1.772 0.028 1 0 "[ ]" 1
1819 1 113 PRO HA 1 116 LEU HG 2.875 . 3.950 2.083 2.083 2.083 . 0 0 "[ ]" 1
1820 1 113 PRO HB2 1 114 ASP H 2.970 . 4.140 3.163 3.163 3.163 . 0 0 "[ ]" 1
1821 1 113 PRO HB3 1 114 ASP H 3.090 . 4.380 4.058 4.058 4.058 . 0 0 "[ ]" 1
1822 1 113 PRO HD2 1 114 ASP H 3.650 . 5.500 2.460 2.460 2.460 . 0 0 "[ ]" 1
1823 1 113 PRO HD3 1 114 ASP H 3.650 . 5.500 3.748 3.748 3.748 . 0 0 "[ ]" 1
1824 1 113 PRO QG 1 114 ASP H 2.870 . 3.940 2.384 2.384 2.384 . 0 0 "[ ]" 1
1825 1 113 PRO HG2 1 114 ASP H 3.000 . 4.200 2.408 2.408 2.408 . 0 0 "[ ]" 1
1826 1 113 PRO HG3 1 114 ASP H 3.000 . 4.200 3.845 3.845 3.845 . 0 0 "[ ]" 1
1827 1 113 PRO O 1 116 LEU H 1.900 . 2.000 2.075 2.075 2.075 0.075 1 0 "[ ]" 1
1828 1 113 PRO O 1 116 LEU N 2.850 2.700 3.000 3.012 3.012 3.012 0.012 1 0 "[ ]" 1
1829 1 114 ASP H 1 115 LYS H 2.485 . 3.170 2.586 2.586 2.586 . 0 0 "[ ]" 1
1830 1 114 ASP H 1 115 LYS QB 4.090 . 6.380 4.478 4.478 4.478 . 0 0 "[ ]" 1
1831 1 114 ASP H 1 116 LEU H 2.830 . 3.860 4.022 4.022 4.022 0.162 1 0 "[ ]" 1
1832 1 114 ASP H 1 116 LEU QD 4.950 . 8.100 4.088 4.088 4.088 . 0 0 "[ ]" 1
1833 1 114 ASP QB 1 115 LYS QD 4.215 . 6.630 4.357 4.357 4.357 . 0 0 "[ ]" 1
1834 1 114 ASP QB 1 116 LEU H 4.090 . 6.380 4.503 4.503 4.503 . 0 0 "[ ]" 1
1835 1 114 ASP QB 1 116 LEU QD 5.170 . 8.540 5.027 5.027 5.027 . 0 0 "[ ]" 1
1836 1 115 LYS H 1 115 LYS HB2 2.955 . 4.110 2.250 2.250 2.250 . 0 0 "[ ]" 1
1837 1 115 LYS H 1 115 LYS QB 2.820 . 3.840 2.227 2.227 2.227 . 0 0 "[ ]" 1
1838 1 115 LYS H 1 115 LYS HB3 2.955 . 4.110 3.552 3.552 3.552 . 0 0 "[ ]" 1
1839 1 115 LYS H 1 115 LYS QD 3.575 . 5.350 3.431 3.431 3.431 . 0 0 "[ ]" 1
1840 1 115 LYS H 1 115 LYS HE2 3.650 . 5.500 4.235 4.235 4.235 . 0 0 "[ ]" 1
1841 1 115 LYS H 1 115 LYS QE 3.435 . 5.070 4.014 4.014 4.014 . 0 0 "[ ]" 1
1842 1 115 LYS H 1 115 LYS HE3 3.650 . 5.500 4.977 4.977 4.977 . 0 0 "[ ]" 1
1843 1 115 LYS H 1 115 LYS HG2 3.295 . 4.790 4.298 4.298 4.298 . 0 0 "[ ]" 1
1844 1 115 LYS H 1 115 LYS HG3 3.295 . 4.790 3.096 3.096 3.096 . 0 0 "[ ]" 1
1845 1 115 LYS H 1 116 LEU H 2.380 . 2.960 2.594 2.594 2.594 . 0 0 "[ ]" 1
1846 1 115 LYS HA 1 115 LYS HG2 2.640 . 3.480 2.759 2.759 2.759 . 0 0 "[ ]" 1
1847 1 115 LYS HA 1 115 LYS QG 2.540 . 3.280 2.209 2.209 2.209 . 0 0 "[ ]" 1
1848 1 115 LYS HA 1 115 LYS HG3 2.640 . 3.480 2.325 2.325 2.325 . 0 0 "[ ]" 1
1849 1 115 LYS HA 1 116 LEU H 2.535 . 3.270 3.308 3.308 3.308 0.038 1 0 "[ ]" 1
1850 1 115 LYS QB 1 116 LEU H 3.265 . 4.730 3.482 3.482 3.482 . 0 0 "[ ]" 1
1851 1 115 LYS HB2 1 116 LEU H 3.590 . 5.380 3.733 3.733 3.733 . 0 0 "[ ]" 1
1852 1 115 LYS HB3 1 116 LEU H 3.590 . 5.380 4.165 4.165 4.165 . 0 0 "[ ]" 1
1853 1 115 LYS QG 1 116 LEU H 4.090 . 6.380 4.595 4.595 4.595 . 0 0 "[ ]" 1
1854 1 116 LEU H 1 116 LEU QB 2.805 . 3.810 3.179 3.179 3.179 . 0 0 "[ ]" 1
1855 1 116 LEU H 1 116 LEU MD1 3.730 . 5.660 2.988 2.988 2.988 . 0 0 "[ ]" 1
1856 1 116 LEU H 1 116 LEU QD 3.335 . 4.870 2.859 2.859 2.859 . 0 0 "[ ]" 1
1857 1 116 LEU H 1 116 LEU MD2 3.730 . 5.660 3.642 3.642 3.642 . 0 0 "[ ]" 1
1858 1 116 LEU H 1 116 LEU HG 2.595 . 3.390 1.934 1.934 1.934 . 0 0 "[ ]" 1
1859 1 116 LEU H 1 117 VAL H 3.060 . 4.320 4.427 4.427 4.427 0.107 1 0 "[ ]" 1
1860 1 116 LEU HA 1 117 VAL H 2.455 . 3.110 2.180 2.180 2.180 . 0 0 "[ ]" 1
1861 1 116 LEU HA 1 121 ALA H 3.650 . 5.500 5.653 5.653 5.653 0.153 1 0 "[ ]" 1
1862 1 116 LEU QB 1 117 VAL H 3.470 . 5.140 2.915 2.915 2.915 . 0 0 "[ ]" 1
1863 1 116 LEU QD 1 117 VAL H 4.110 . 6.420 3.585 3.585 3.585 . 0 0 "[ ]" 1
1864 1 116 LEU QD 1 121 ALA H 4.950 . 8.100 3.651 3.651 3.651 . 0 0 "[ ]" 1
1865 1 116 LEU QD 1 121 ALA MB 4.395 . 6.990 1.660 1.660 1.660 0.140 1 0 "[ ]" 1
1866 1 116 LEU HG 1 121 ALA MB 3.095 . 4.390 3.738 3.738 3.738 . 0 0 "[ ]" 1
1867 1 117 VAL H 1 117 VAL HB 2.935 . 4.070 2.546 2.546 2.546 . 0 0 "[ ]" 1
1868 1 117 VAL H 1 117 VAL MG1 2.940 . 4.080 1.958 1.958 1.958 . 0 0 "[ ]" 1
1869 1 117 VAL HA 1 118 ARG H 2.350 . 2.900 2.237 2.237 2.237 . 0 0 "[ ]" 1
1870 1 117 VAL HB 1 118 ARG H 3.650 . 5.500 4.298 4.298 4.298 . 0 0 "[ ]" 1
1871 1 117 VAL HB 1 119 ALA H 3.650 . 5.500 4.972 4.972 4.972 . 0 0 "[ ]" 1
1872 1 117 VAL HB 1 120 ALA H 3.620 . 5.440 4.438 4.438 4.438 . 0 0 "[ ]" 1
1873 1 117 VAL HB 1 120 ALA MB 3.220 . 4.640 3.837 3.837 3.837 . 0 0 "[ ]" 1
1874 1 117 VAL MG1 1 118 ARG H 3.495 . 5.190 3.913 3.913 3.913 . 0 0 "[ ]" 1
1875 1 117 VAL MG1 1 119 ALA H 3.590 . 5.380 3.792 3.792 3.792 . 0 0 "[ ]" 1
1876 1 117 VAL MG1 1 120 ALA H 3.435 . 5.070 1.950 1.950 1.950 . 0 0 "[ ]" 1
1877 1 117 VAL MG1 1 121 ALA H 3.280 . 4.760 1.925 1.925 1.925 . 0 0 "[ ]" 1
1878 1 117 VAL MG1 1 122 GLU H 3.980 . 6.160 4.442 4.442 4.442 . 0 0 "[ ]" 1
1879 1 117 VAL MG2 1 118 ARG H 3.265 . 4.730 2.588 2.588 2.588 . 0 0 "[ ]" 1
1880 1 117 VAL MG2 1 119 ALA H 2.830 . 3.860 2.263 2.263 2.263 . 0 0 "[ ]" 1
1881 1 117 VAL MG2 1 120 ALA H 2.955 . 4.110 2.045 2.045 2.045 . 0 0 "[ ]" 1
1882 1 117 VAL MG2 1 121 ALA H 3.560 . 5.320 3.507 3.507 3.507 . 0 0 "[ ]" 1
1883 1 117 VAL MG2 1 122 GLU H 4.165 . 6.530 5.252 5.252 5.252 . 0 0 "[ ]" 1
1884 1 118 ARG H 1 118 ARG HB2 2.875 . 3.950 2.316 2.316 2.316 . 0 0 "[ ]" 1
1885 1 118 ARG H 1 118 ARG QB 2.770 . 3.740 2.289 2.289 2.289 . 0 0 "[ ]" 1
1886 1 118 ARG H 1 118 ARG HB3 2.875 . 3.950 3.590 3.590 3.590 . 0 0 "[ ]" 1
1887 1 118 ARG H 1 118 ARG QD 4.090 . 6.380 3.049 3.049 3.049 . 0 0 "[ ]" 1
1888 1 118 ARG H 1 118 ARG QG 3.470 . 5.140 2.738 2.738 2.738 . 0 0 "[ ]" 1
1889 1 118 ARG H 1 119 ALA MB 4.165 . 6.530 4.187 4.187 4.187 . 0 0 "[ ]" 1
1890 1 118 ARG H 1 121 ALA MB 4.165 . 6.530 4.293 4.293 4.293 . 0 0 "[ ]" 1
1891 1 118 ARG HA 1 121 ALA H 2.675 . 3.550 3.586 3.586 3.586 0.036 1 0 "[ ]" 1
1892 1 118 ARG HA 1 121 ALA MB 2.615 . 3.430 2.523 2.523 2.523 . 0 0 "[ ]" 1
1893 1 118 ARG HA 1 122 GLU H 3.400 . 5.000 3.311 3.311 3.311 . 0 0 "[ ]" 1
1894 1 118 ARG QB 1 119 ALA HA 3.130 . 4.460 3.897 3.897 3.897 . 0 0 "[ ]" 1
1895 1 118 ARG HB2 1 119 ALA H 2.750 . 3.700 2.714 2.714 2.714 . 0 0 "[ ]" 1
1896 1 118 ARG HB3 1 119 ALA H 2.750 . 3.700 3.507 3.507 3.507 . 0 0 "[ ]" 1
1897 1 118 ARG QD 1 119 ALA H 4.090 . 6.380 4.444 4.444 4.444 . 0 0 "[ ]" 1
1898 1 118 ARG QD 1 121 ALA MB 4.600 . 7.400 5.385 5.385 5.385 . 0 0 "[ ]" 1
1899 1 118 ARG QG 1 119 ALA H 3.730 . 5.660 4.313 4.313 4.313 . 0 0 "[ ]" 1
1900 1 118 ARG QG 1 122 GLU QG 3.925 . 6.050 4.681 4.681 4.681 . 0 0 "[ ]" 1
1901 1 119 ALA H 1 119 ALA HA 2.300 . 2.800 2.831 2.831 2.831 0.031 1 0 "[ ]" 1
1902 1 119 ALA H 1 119 ALA MB 2.615 . 3.430 2.128 2.128 2.128 . 0 0 "[ ]" 1
1903 1 119 ALA H 1 120 ALA H 2.520 . 3.240 2.741 2.741 2.741 . 0 0 "[ ]" 1
1904 1 119 ALA HA 1 120 ALA H 2.705 . 3.610 3.492 3.492 3.492 . 0 0 "[ ]" 1
1905 1 119 ALA HA 1 122 GLU QG 3.130 . 4.460 3.262 3.262 3.262 . 0 0 "[ ]" 1
1906 1 120 ALA H 1 120 ALA MB 2.705 . 3.610 2.383 2.383 2.383 . 0 0 "[ ]" 1
1907 1 120 ALA H 1 121 ALA H 2.395 . 2.990 2.228 2.228 2.228 . 0 0 "[ ]" 1
1908 1 120 ALA H 1 121 ALA MB 3.325 . 4.850 3.855 3.855 3.855 . 0 0 "[ ]" 1
1909 1 120 ALA H 1 122 GLU H 3.030 . 4.260 3.727 3.727 3.727 . 0 0 "[ ]" 1
1910 1 120 ALA H 1 125 TRP HZ2 3.650 . 5.500 5.572 5.572 5.572 0.072 1 0 "[ ]" 1
1911 1 120 ALA HA 1 122 GLU H 3.400 . 5.000 4.207 4.207 4.207 . 0 0 "[ ]" 1
1912 1 120 ALA HA 1 123 LYS H 2.765 . 3.730 3.481 3.481 3.481 . 0 0 "[ ]" 1
1913 1 120 ALA HA 1 125 TRP HE1 3.140 . 4.480 3.069 3.069 3.069 . 0 0 "[ ]" 1
1914 1 120 ALA MB 1 121 ALA H 3.050 . 4.300 2.478 2.478 2.478 . 0 0 "[ ]" 1
1915 1 120 ALA MB 1 122 GLU H 3.900 . 6.000 4.473 4.473 4.473 . 0 0 "[ ]" 1
1916 1 120 ALA MB 1 123 LYS H 4.165 . 6.530 4.311 4.311 4.311 . 0 0 "[ ]" 1
1917 1 120 ALA MB 1 125 TRP HE1 3.235 . 4.670 2.936 2.936 2.936 . 0 0 "[ ]" 1
1918 1 120 ALA O 1 125 TRP HE1 1.900 . 2.000 1.745 1.745 1.745 0.055 1 0 "[ ]" 1
1919 1 120 ALA O 1 125 TRP NE1 2.850 2.700 3.000 2.674 2.674 2.674 0.026 1 0 "[ ]" 1
1920 1 121 ALA H 1 122 GLU H 2.595 . 3.390 2.955 2.955 2.955 . 0 0 "[ ]" 1
1921 1 121 ALA H 1 123 LYS H 3.435 . 5.070 4.133 4.133 4.133 . 0 0 "[ ]" 1
1922 1 121 ALA MB 1 122 GLU HA 3.295 . 4.790 3.864 3.864 3.864 . 0 0 "[ ]" 1
1923 1 121 ALA MB 1 122 GLU QG 3.920 . 6.040 4.058 4.058 4.058 . 0 0 "[ ]" 1
1924 1 122 GLU H 1 122 GLU HB2 2.845 . 3.890 3.670 3.670 3.670 . 0 0 "[ ]" 1
1925 1 122 GLU H 1 122 GLU HB3 2.765 . 3.730 2.704 2.704 2.704 . 0 0 "[ ]" 1
1926 1 122 GLU H 1 122 GLU HG2 3.110 . 4.420 3.016 3.016 3.016 . 0 0 "[ ]" 1
1927 1 122 GLU H 1 122 GLU QG 2.970 . 4.140 2.042 2.042 2.042 . 0 0 "[ ]" 1
1928 1 122 GLU H 1 122 GLU HG3 3.110 . 4.420 2.077 2.077 2.077 . 0 0 "[ ]" 1
1929 1 122 GLU H 1 123 LYS H 2.610 . 3.420 2.638 2.638 2.638 . 0 0 "[ ]" 1
1930 1 122 GLU H 1 123 LYS QG 4.090 . 6.380 3.607 3.607 3.607 . 0 0 "[ ]" 1
1931 1 122 GLU HA 1 122 GLU HB2 2.350 . 2.900 2.461 2.461 2.461 . 0 0 "[ ]" 1
1932 1 122 GLU HA 1 122 GLU HB3 2.300 . 2.800 2.475 2.475 2.475 . 0 0 "[ ]" 1
1933 1 122 GLU HB2 1 123 LYS H 3.605 . 5.410 4.355 4.355 4.355 . 0 0 "[ ]" 1
1934 1 122 GLU HB3 1 123 LYS H 3.465 . 5.130 4.431 4.431 4.431 . 0 0 "[ ]" 1
1935 1 122 GLU QG 1 123 LYS H 3.875 . 5.950 2.840 2.840 2.840 . 0 0 "[ ]" 1
1936 1 123 LYS H 1 123 LYS HA 2.350 . 2.900 2.951 2.951 2.951 0.051 1 0 "[ ]" 1
1937 1 123 LYS H 1 123 LYS QB 2.845 . 3.890 2.519 2.519 2.519 . 0 0 "[ ]" 1
1938 1 123 LYS H 1 123 LYS QD 4.090 . 6.380 4.158 4.158 4.158 . 0 0 "[ ]" 1
1939 1 123 LYS H 1 123 LYS QE 4.090 . 6.380 4.734 4.734 4.734 . 0 0 "[ ]" 1
1940 1 123 LYS H 1 123 LYS HG2 2.690 . 3.580 3.177 3.177 3.177 . 0 0 "[ ]" 1
1941 1 123 LYS H 1 123 LYS HG3 2.690 . 3.580 2.452 2.452 2.452 . 0 0 "[ ]" 1
1942 1 123 LYS H 1 125 TRP HE1 3.370 . 4.940 2.947 2.947 2.947 . 0 0 "[ ]" 1
1943 1 123 LYS HA 1 123 LYS HG2 2.580 . 3.360 2.427 2.427 2.427 . 0 0 "[ ]" 1
1944 1 123 LYS HA 1 123 LYS QG 2.415 . 3.030 2.376 2.376 2.376 . 0 0 "[ ]" 1
1945 1 123 LYS HA 1 123 LYS HG3 2.580 . 3.360 3.392 3.392 3.392 0.032 1 0 "[ ]" 1
1946 1 123 LYS HA 1 124 ARG H 2.240 . 2.680 2.223 2.223 2.223 . 0 0 "[ ]" 1
1947 1 123 LYS HA 1 125 TRP HE1 3.280 . 4.760 4.751 4.751 4.751 . 0 0 "[ ]" 1
1948 1 123 LYS QB 1 125 TRP HE1 3.080 . 4.360 2.112 2.112 2.112 . 0 0 "[ ]" 1
1949 1 123 LYS QE 1 125 TRP HE1 4.090 . 6.380 5.594 5.594 5.594 . 0 0 "[ ]" 1
1950 1 123 LYS QG 1 124 ARG H 4.090 . 6.380 4.257 4.257 4.257 . 0 0 "[ ]" 1
1951 1 123 LYS QG 1 125 TRP HE1 2.925 . 4.050 3.415 3.415 3.415 . 0 0 "[ ]" 1
1952 1 124 ARG H 1 124 ARG QB 2.615 . 3.430 2.338 2.338 2.338 . 0 0 "[ ]" 1
1953 1 124 ARG H 1 124 ARG HD2 3.650 . 5.500 3.800 3.800 3.800 . 0 0 "[ ]" 1
1954 1 124 ARG H 1 124 ARG QD 3.390 . 4.980 3.659 3.659 3.659 . 0 0 "[ ]" 1
1955 1 124 ARG H 1 124 ARG HD3 3.650 . 5.500 4.774 4.774 4.774 . 0 0 "[ ]" 1
1956 1 124 ARG H 1 124 ARG HG2 3.155 . 4.510 3.706 3.706 3.706 . 0 0 "[ ]" 1
1957 1 124 ARG H 1 124 ARG QG 2.730 . 3.660 2.365 2.365 2.365 . 0 0 "[ ]" 1
1958 1 124 ARG H 1 124 ARG HG3 3.155 . 4.510 2.393 2.393 2.393 . 0 0 "[ ]" 1
1959 1 124 ARG H 1 125 TRP H 3.110 . 4.420 4.437 4.437 4.437 0.017 1 0 "[ ]" 1
1960 1 124 ARG H 1 125 TRP HE1 3.650 . 5.500 5.540 5.540 5.540 0.040 1 0 "[ ]" 1
1961 1 124 ARG HA 1 125 TRP H 2.365 . 2.930 2.163 2.163 2.163 . 0 0 "[ ]" 1
1962 1 124 ARG HB2 1 125 TRP H 3.650 . 5.500 4.442 4.442 4.442 . 0 0 "[ ]" 1
1963 1 124 ARG HB3 1 125 TRP H 3.650 . 5.500 3.659 3.659 3.659 . 0 0 "[ ]" 1
1964 1 125 TRP H 1 125 TRP HD1 2.795 . 3.790 3.215 3.215 3.215 . 0 0 "[ ]" 1
1965 1 125 TRP H 1 125 TRP HE3 3.650 . 5.500 5.123 5.123 5.123 . 0 0 "[ ]" 1
1966 1 125 TRP HA 1 125 TRP HE3 2.240 . 2.680 2.589 2.589 2.589 . 0 0 "[ ]" 1
1967 1 125 TRP HA 1 125 TRP HZ3 3.370 . 4.940 4.815 4.815 4.815 . 0 0 "[ ]" 1
1968 1 125 TRP HA 1 126 ASP H 2.520 . 3.240 2.447 2.447 2.447 . 0 0 "[ ]" 1
1969 1 125 TRP HB2 1 125 TRP HD1 2.780 . 3.760 2.526 2.526 2.526 . 0 0 "[ ]" 1
1970 1 125 TRP HB2 1 126 ASP H 3.340 . 4.880 3.592 3.592 3.592 . 0 0 "[ ]" 1
1971 1 125 TRP HB2 1 127 ARG H 3.325 . 4.850 3.709 3.709 3.709 . 0 0 "[ ]" 1
1972 1 125 TRP HB3 1 126 ASP H 2.890 . 3.980 2.571 2.571 2.571 . 0 0 "[ ]" 1
1973 1 125 TRP HB3 1 127 ARG H 2.970 . 4.140 2.759 2.759 2.759 . 0 0 "[ ]" 1
1974 1 125 TRP HE3 1 126 ASP H 3.355 . 4.910 3.678 3.678 3.678 . 0 0 "[ ]" 1
1975 1 125 TRP HE3 1 127 ARG H 3.650 . 5.500 4.719 4.719 4.719 . 0 0 "[ ]" 1
1976 1 126 ASP H 1 127 ARG H 2.425 . 3.050 2.014 2.014 2.014 . 0 0 "[ ]" 1
1977 1 126 ASP H 1 127 ARG QG 3.485 . 5.170 3.664 3.664 3.664 . 0 0 "[ ]" 1
1978 1 126 ASP HA 1 126 ASP HB2 2.285 . 2.770 2.462 2.462 2.462 . 0 0 "[ ]" 1
1979 1 126 ASP HA 1 126 ASP QB 2.120 . 2.440 2.188 2.188 2.188 . 0 0 "[ ]" 1
1980 1 126 ASP HA 1 126 ASP HB3 2.285 . 2.770 2.451 2.451 2.451 . 0 0 "[ ]" 1
1981 1 126 ASP HA 1 127 ARG H 2.520 . 3.240 3.110 3.110 3.110 . 0 0 "[ ]" 1
1982 1 127 ARG H 1 127 ARG HD2 3.650 . 5.500 5.406 5.406 5.406 . 0 0 "[ ]" 1
1983 1 127 ARG H 1 127 ARG HD3 3.650 . 5.500 5.518 5.518 5.518 0.018 1 0 "[ ]" 1
1984 1 127 ARG H 1 127 ARG HG2 3.650 . 5.500 3.628 3.628 3.628 . 0 0 "[ ]" 1
1985 1 127 ARG H 1 127 ARG QG 3.450 . 5.100 3.254 3.254 3.254 . 0 0 "[ ]" 1
1986 1 127 ARG H 1 127 ARG HG3 3.650 . 5.500 3.678 3.678 3.678 . 0 0 "[ ]" 1
1987 1 127 ARG H 1 128 VAL MG2 4.165 . 6.530 5.451 5.451 5.451 . 0 0 "[ ]" 1
1988 1 127 ARG HA 1 127 ARG HD2 3.295 . 4.790 4.128 4.128 4.128 . 0 0 "[ ]" 1
1989 1 127 ARG HA 1 127 ARG QD 3.170 . 4.540 3.314 3.314 3.314 . 0 0 "[ ]" 1
1990 1 127 ARG HA 1 127 ARG HD3 3.295 . 4.790 3.491 3.491 3.491 . 0 0 "[ ]" 1
1991 1 127 ARG HA 1 128 VAL H 2.255 . 2.710 2.315 2.315 2.315 . 0 0 "[ ]" 1
1992 1 127 ARG HA 1 128 VAL MG1 3.900 . 6.000 4.045 4.045 4.045 . 0 0 "[ ]" 1
1993 1 127 ARG QB 1 128 VAL H 2.720 . 3.640 2.888 2.888 2.888 . 0 0 "[ ]" 1
1994 1 127 ARG HB2 1 128 VAL H 2.860 . 3.920 3.997 3.997 3.997 0.077 1 0 "[ ]" 1
1995 1 127 ARG HB3 1 128 VAL H 2.860 . 3.920 2.963 2.963 2.963 . 0 0 "[ ]" 1
1996 1 127 ARG QG 1 128 VAL H 3.780 . 5.760 4.231 4.231 4.231 . 0 0 "[ ]" 1
1997 1 128 VAL H 1 128 VAL HB 2.550 . 3.300 3.117 3.117 3.117 . 0 0 "[ ]" 1
1998 1 128 VAL H 1 128 VAL MG1 3.235 . 4.670 2.361 2.361 2.361 . 0 0 "[ ]" 1
1999 1 128 VAL H 1 128 VAL MG2 3.235 . 4.670 3.979 3.979 3.979 . 0 0 "[ ]" 1
2000 1 128 VAL H 1 129 LYS H 3.510 . 5.220 4.378 4.378 4.378 . 0 0 "[ ]" 1
2001 1 128 VAL HA 1 128 VAL HB 2.240 . 2.680 2.539 2.539 2.539 . 0 0 "[ ]" 1
2002 1 128 VAL HA 1 128 VAL MG2 2.755 . 3.710 2.287 2.287 2.287 . 0 0 "[ ]" 1
2003 1 128 VAL HA 1 129 LYS H 2.565 . 3.330 2.233 2.233 2.233 . 0 0 "[ ]" 1
2004 1 128 VAL HB 1 129 LYS H 2.985 . 4.170 4.215 4.215 4.215 0.045 1 0 "[ ]" 1
2005 1 128 VAL HB 1 149 PHE HE2 2.955 . 4.110 3.929 3.929 3.929 . 0 0 "[ ]" 1
2006 1 128 VAL MG1 1 129 LYS H 3.125 . 4.450 3.689 3.689 3.689 . 0 0 "[ ]" 1
2007 1 128 VAL MG1 1 130 ILE H 4.165 . 6.530 3.917 3.917 3.917 . 0 0 "[ ]" 1
2008 1 128 VAL MG1 1 130 ILE HG12 3.325 . 4.850 2.453 2.453 2.453 . 0 0 "[ ]" 1
2009 1 128 VAL MG1 1 130 ILE QG 3.240 . 4.680 2.391 2.391 2.391 . 0 0 "[ ]" 1
2010 1 128 VAL MG1 1 130 ILE HG13 3.325 . 4.850 3.304 3.304 3.304 . 0 0 "[ ]" 1
2011 1 128 VAL MG1 1 149 PHE HE2 3.235 . 4.670 1.934 1.934 1.934 . 0 0 "[ ]" 1
2012 1 128 VAL MG2 1 149 PHE HE2 3.170 . 4.540 3.585 3.585 3.585 . 0 0 "[ ]" 1
2013 1 129 LYS H 1 129 LYS HB2 3.000 . 4.200 2.920 2.920 2.920 . 0 0 "[ ]" 1
2014 1 129 LYS H 1 129 LYS QB 2.650 . 3.500 2.426 2.426 2.426 . 0 0 "[ ]" 1
2015 1 129 LYS H 1 129 LYS HB3 3.000 . 4.200 2.592 2.592 2.592 . 0 0 "[ ]" 1
2016 1 129 LYS H 1 129 LYS HD2 3.650 . 5.500 4.807 4.807 4.807 . 0 0 "[ ]" 1
2017 1 129 LYS H 1 129 LYS QD 3.325 . 4.850 4.408 4.408 4.408 . 0 0 "[ ]" 1
2018 1 129 LYS H 1 129 LYS HD3 3.650 . 5.500 5.123 5.123 5.123 . 0 0 "[ ]" 1
2019 1 129 LYS H 1 129 LYS HG2 3.495 . 5.190 4.428 4.428 4.428 . 0 0 "[ ]" 1
2020 1 129 LYS H 1 129 LYS QG 3.170 . 4.540 4.083 4.083 4.083 . 0 0 "[ ]" 1
2021 1 129 LYS H 1 129 LYS HG3 3.495 . 5.190 4.785 4.785 4.785 . 0 0 "[ ]" 1
2022 1 129 LYS HA 1 130 ILE H 2.365 . 2.930 2.190 2.190 2.190 . 0 0 "[ ]" 1
2023 1 129 LYS HA 1 130 ILE QG 3.840 . 5.880 3.830 3.830 3.830 . 0 0 "[ ]" 1
2024 1 129 LYS QB 1 130 ILE H 4.090 . 6.380 3.933 3.933 3.933 . 0 0 "[ ]" 1
2025 1 129 LYS QE 1 131 VAL MG2 3.350 . 4.900 1.917 1.917 1.917 . 0 0 "[ ]" 1
2026 1 130 ILE H 1 130 ILE MD 3.930 . 6.060 3.484 3.484 3.484 . 0 0 "[ ]" 1
2027 1 130 ILE H 1 130 ILE HG12 3.385 . 4.970 2.481 2.481 2.481 . 0 0 "[ ]" 1
2028 1 130 ILE H 1 130 ILE HG13 3.385 . 4.970 3.859 3.859 3.859 . 0 0 "[ ]" 1
2029 1 130 ILE H 1 131 VAL H 3.245 . 4.690 4.433 4.433 4.433 . 0 0 "[ ]" 1
2030 1 130 ILE HA 1 130 ILE MD 3.250 . 4.700 1.945 1.945 1.945 . 0 0 "[ ]" 1
2031 1 130 ILE HA 1 130 ILE HG12 2.905 . 4.010 3.084 3.084 3.084 . 0 0 "[ ]" 1
2032 1 130 ILE HA 1 130 ILE QG 2.820 . 3.840 2.946 2.946 2.946 . 0 0 "[ ]" 1
2033 1 130 ILE HA 1 130 ILE HG13 2.905 . 4.010 3.736 3.736 3.736 . 0 0 "[ ]" 1
2034 1 130 ILE HB 1 131 VAL H 3.650 . 5.500 4.313 4.313 4.313 . 0 0 "[ ]" 1
2035 1 130 ILE MD 1 149 PHE HE1 2.895 . 3.990 2.888 2.888 2.888 . 0 0 "[ ]" 1
2036 1 130 ILE MD 1 149 PHE HZ 2.970 . 4.140 1.974 1.974 1.974 . 0 0 "[ ]" 1
2037 1 130 ILE QG 1 131 VAL H 4.090 . 6.380 4.791 4.791 4.791 . 0 0 "[ ]" 1
2038 1 130 ILE QG 1 149 PHE HZ 3.390 . 4.980 2.836 2.836 2.836 . 0 0 "[ ]" 1
2039 1 130 ILE HG12 1 149 PHE HZ 3.510 . 5.220 3.253 3.253 3.253 . 0 0 "[ ]" 1
2040 1 130 ILE HG13 1 149 PHE HZ 3.510 . 5.220 3.122 3.122 3.122 . 0 0 "[ ]" 1
2041 1 130 ILE MG 1 131 VAL H 3.450 . 5.100 2.881 2.881 2.881 . 0 0 "[ ]" 1
2042 1 131 VAL H 1 131 VAL HB 2.735 . 3.670 2.675 2.675 2.675 . 0 0 "[ ]" 1
2043 1 131 VAL H 1 131 VAL MG1 3.030 . 4.260 3.855 3.855 3.855 . 0 0 "[ ]" 1
2044 1 131 VAL H 1 131 VAL MG2 3.095 . 4.390 2.762 2.762 2.762 . 0 0 "[ ]" 1
2045 1 131 VAL HA 1 132 CYS H 2.380 . 2.960 2.174 2.174 2.174 . 0 0 "[ ]" 1
2046 1 131 VAL HB 1 132 CYS H 3.650 . 5.500 4.315 4.315 4.315 . 0 0 "[ ]" 1
2047 1 131 VAL MG1 1 133 SER QB 4.215 . 6.630 3.808 3.808 3.808 . 0 0 "[ ]" 1
2048 1 131 VAL MG2 1 132 CYS H 3.375 . 4.950 4.149 4.149 4.149 . 0 0 "[ ]" 1
2049 1 132 CYS H 1 133 SER H 3.480 . 5.160 4.622 4.622 4.622 . 0 0 "[ ]" 1
2050 1 132 CYS HA 1 133 SER H 2.270 . 2.740 2.302 2.302 2.302 . 0 0 "[ ]" 1
2051 1 132 CYS QB 1 133 SER HA 4.090 . 6.380 4.496 4.496 4.496 . 0 0 "[ ]" 1
2052 1 132 CYS QB 1 144 LEU QD 4.150 . 6.500 2.271 2.271 2.271 . 0 0 "[ ]" 1
2053 1 133 SER H 1 134 GLN H 3.125 . 4.450 4.297 4.297 4.297 . 0 0 "[ ]" 1
2054 1 133 SER HA 1 133 SER HB2 2.395 . 2.990 2.838 2.838 2.838 . 0 0 "[ ]" 1
2055 1 133 SER HA 1 133 SER HB3 2.395 . 2.990 2.892 2.892 2.892 . 0 0 "[ ]" 1
2056 1 133 SER HA 1 134 GLN H 2.380 . 2.960 2.158 2.158 2.158 . 0 0 "[ ]" 1
2057 1 133 SER HA 1 136 TYR QD 4.720 . 7.640 6.384 6.384 6.384 . 0 0 "[ ]" 1
2058 1 133 SER HA 1 136 TYR QE 4.205 . 6.610 4.835 4.835 4.835 . 0 0 "[ ]" 1
2059 1 133 SER QB 1 134 GLN H 3.115 . 4.430 3.428 3.428 3.428 . 0 0 "[ ]" 1
2060 1 133 SER QB 1 134 GLN HA 3.935 . 6.070 4.197 4.197 4.197 . 0 0 "[ ]" 1
2061 1 133 SER HB2 1 134 GLN H 3.340 . 4.880 4.426 4.426 4.426 . 0 0 "[ ]" 1
2062 1 133 SER HB3 1 134 GLN H 3.340 . 4.880 3.570 3.570 3.570 . 0 0 "[ ]" 1
2063 1 134 GLN H 1 136 TYR HD2 3.650 . 5.500 4.988 4.988 4.988 . 0 0 "[ ]" 1
2064 1 134 GLN H 1 136 TYR HE2 3.605 . 5.410 4.082 4.082 4.082 . 0 0 "[ ]" 1
2065 1 134 GLN HA 1 134 GLN HE21 3.650 . 5.500 4.839 4.839 4.839 . 0 0 "[ ]" 1
2066 1 134 GLN HA 1 134 GLN HE22 3.650 . 5.500 4.796 4.796 4.796 . 0 0 "[ ]" 1
2067 1 135 PRO HA 1 137 SER H 3.385 . 4.970 3.615 3.615 3.615 . 0 0 "[ ]" 1
2068 1 135 PRO QB 1 137 SER H 3.565 . 5.330 4.630 4.630 4.630 . 0 0 "[ ]" 1
2069 1 136 TYR H 1 136 TYR HD2 2.875 . 3.950 3.214 3.214 3.214 . 0 0 "[ ]" 1
2070 1 136 TYR H 1 136 TYR HE2 3.635 . 5.470 4.332 4.332 4.332 . 0 0 "[ ]" 1
2071 1 136 TYR H 1 137 SER H 2.350 . 2.900 1.984 1.984 1.984 . 0 0 "[ ]" 1
2072 1 136 TYR HA 1 137 SER H 2.535 . 3.270 3.429 3.429 3.429 0.159 1 0 "[ ]" 1
2073 1 136 TYR QD 1 137 SER H 4.410 . 7.020 3.086 3.086 3.086 . 0 0 "[ ]" 1
2074 1 136 TYR HE1 1 143 GLY H 3.525 . 5.250 4.001 4.001 4.001 . 0 0 "[ ]" 1
2075 1 137 SER H 1 137 SER HB2 2.580 . 3.360 2.443 2.443 2.443 . 0 0 "[ ]" 1
2076 1 137 SER H 1 137 SER HB3 2.735 . 3.670 3.310 3.310 3.310 . 0 0 "[ ]" 1
2077 1 137 SER H 1 138 LYS H 3.355 . 4.910 4.437 4.437 4.437 . 0 0 "[ ]" 1
2078 1 137 SER HB2 1 139 ASP H 3.650 . 5.500 5.557 5.557 5.557 0.057 1 0 "[ ]" 1
2079 1 137 SER HB2 1 140 SER H 3.650 . 5.500 5.476 5.476 5.476 . 0 0 "[ ]" 1
2080 1 138 LYS H 1 138 LYS HG2 3.650 . 5.500 4.786 4.786 4.786 . 0 0 "[ ]" 1
2081 1 138 LYS H 1 138 LYS HG3 3.650 . 5.500 4.733 4.733 4.733 . 0 0 "[ ]" 1
2082 1 138 LYS QB 1 139 ASP H 3.455 . 5.110 2.590 2.590 2.590 . 0 0 "[ ]" 1
2083 1 138 LYS HB2 1 139 ASP H 3.650 . 5.500 3.526 3.526 3.526 . 0 0 "[ ]" 1
2084 1 138 LYS HB3 1 139 ASP H 3.650 . 5.500 2.665 2.665 2.665 . 0 0 "[ ]" 1
2085 1 138 LYS QD 1 139 ASP H 4.090 . 6.380 4.717 4.717 4.717 . 0 0 "[ ]" 1
2086 1 138 LYS QG 1 139 ASP H 3.565 . 5.330 4.181 4.181 4.181 . 0 0 "[ ]" 1
2087 1 138 LYS HG2 1 139 ASP H 3.650 . 5.500 4.460 4.460 4.460 . 0 0 "[ ]" 1
2088 1 138 LYS HG3 1 139 ASP H 3.650 . 5.500 5.052 5.052 5.052 . 0 0 "[ ]" 1
2089 1 139 ASP H 1 139 ASP HB2 2.675 . 3.550 3.685 3.685 3.685 0.135 1 0 "[ ]" 1
2090 1 139 ASP H 1 139 ASP HB3 2.890 . 3.980 3.088 3.088 3.088 . 0 0 "[ ]" 1
2091 1 139 ASP H 1 140 SER H 2.410 . 3.020 2.036 2.036 2.036 . 0 0 "[ ]" 1
2092 1 139 ASP HA 1 140 SER H 2.535 . 3.270 3.501 3.501 3.501 0.231 1 0 "[ ]" 1
2093 1 139 ASP HB2 1 140 SER H 2.920 . 4.040 3.543 3.543 3.543 . 0 0 "[ ]" 1
2094 1 139 ASP HB3 1 140 SER H 3.155 . 4.510 3.922 3.922 3.922 . 0 0 "[ ]" 1
2095 1 140 SER H 1 140 SER HB2 2.595 . 3.390 3.506 3.506 3.506 0.116 1 0 "[ ]" 1
2096 1 140 SER H 1 140 SER HB3 2.505 . 3.210 3.256 3.256 3.256 0.046 1 0 "[ ]" 1
2097 1 140 SER HA 1 140 SER HB2 2.225 . 2.650 2.670 2.670 2.670 0.020 1 0 "[ ]" 1
2098 1 140 SER HA 1 140 SER HB3 2.225 . 2.650 2.300 2.300 2.300 . 0 0 "[ ]" 1
2099 1 140 SER HA 1 141 PRO HD2 2.270 . 2.740 2.756 2.756 2.756 0.016 1 0 "[ ]" 1
2100 1 140 SER HA 1 141 PRO HD3 2.270 . 2.740 1.942 1.942 1.942 . 0 0 "[ ]" 1
2101 1 141 PRO HA 1 142 PHE H 2.365 . 2.930 2.410 2.410 2.410 . 0 0 "[ ]" 1
2102 1 141 PRO QB 1 142 PHE H 3.100 . 4.400 2.682 2.682 2.682 . 0 0 "[ ]" 1
2103 1 142 PHE H 1 143 GLY H 3.060 . 4.320 4.342 4.342 4.342 0.022 1 0 "[ ]" 1
2104 1 142 PHE HA 1 142 PHE HD2 2.795 . 3.790 3.666 3.666 3.666 . 0 0 "[ ]" 1
2105 1 142 PHE HA 1 143 GLY H 2.440 . 3.080 2.825 2.825 2.825 . 0 0 "[ ]" 1
2106 1 142 PHE QB 1 143 GLY H 2.785 . 3.770 1.984 1.984 1.984 . 0 0 "[ ]" 1
2107 1 142 PHE HB2 1 143 GLY H 2.875 . 3.950 3.559 3.559 3.559 . 0 0 "[ ]" 1
2108 1 142 PHE HB3 1 143 GLY H 2.875 . 3.950 1.994 1.994 1.994 . 0 0 "[ ]" 1
2109 1 142 PHE QD 1 143 GLY H 4.400 . 7.000 2.216 2.216 2.216 . 0 0 "[ ]" 1
2110 1 142 PHE HD1 1 144 LEU H 3.650 . 5.500 5.437 5.437 5.437 . 0 0 "[ ]" 1
2111 1 143 GLY H 1 144 LEU H 3.060 . 4.320 3.858 3.858 3.858 . 0 0 "[ ]" 1
2112 1 143 GLY H 1 144 LEU HA 3.200 . 4.600 4.648 4.648 4.648 0.048 1 0 "[ ]" 1
2113 1 143 GLY H 1 144 LEU QD 4.950 . 8.100 4.573 4.573 4.573 . 0 0 "[ ]" 1
2114 1 143 GLY HA2 1 144 LEU H 2.610 . 3.420 3.378 3.378 3.378 . 0 0 "[ ]" 1
2115 1 143 GLY HA3 1 144 LEU H 2.610 . 3.420 2.187 2.187 2.187 . 0 0 "[ ]" 1
2116 1 144 LEU H 1 144 LEU MD1 3.980 . 6.160 2.963 2.963 2.963 . 0 0 "[ ]" 1
2117 1 144 LEU H 1 144 LEU QD 3.790 . 5.780 2.911 2.911 2.911 . 0 0 "[ ]" 1
2118 1 144 LEU H 1 144 LEU MD2 3.980 . 6.160 4.268 4.268 4.268 . 0 0 "[ ]" 1
2119 1 144 LEU HA 1 144 LEU MD1 3.280 . 4.760 2.232 2.232 2.232 . 0 0 "[ ]" 1
2120 1 144 LEU HA 1 144 LEU QD 2.820 . 3.840 2.214 2.214 2.214 . 0 0 "[ ]" 1
2121 1 144 LEU HA 1 144 LEU MD2 3.280 . 4.760 3.701 3.701 3.701 . 0 0 "[ ]" 1
2122 1 144 LEU HA 1 145 SER H 2.520 . 3.240 2.297 2.297 2.297 . 0 0 "[ ]" 1
2123 1 144 LEU QD 1 146 PHE H 4.035 . 6.270 3.738 3.738 3.738 . 0 0 "[ ]" 1
2124 1 144 LEU HG 1 146 PHE H 2.845 . 3.890 3.948 3.948 3.948 0.058 1 0 "[ ]" 1
2125 1 145 SER H 1 146 PHE H 2.455 . 3.110 2.308 2.308 2.308 . 0 0 "[ ]" 1
2126 1 145 SER H 1 146 PHE HD2 3.650 . 5.500 4.461 4.461 4.461 . 0 0 "[ ]" 1
2127 1 145 SER H 1 146 PHE HE2 3.650 . 5.500 5.211 5.211 5.211 . 0 0 "[ ]" 1
2128 1 145 SER HA 1 146 PHE H 2.640 . 3.480 3.506 3.506 3.506 0.026 1 0 "[ ]" 1
2129 1 145 SER QB 1 146 PHE HE2 3.210 . 4.620 2.986 2.986 2.986 . 0 0 "[ ]" 1
2130 1 145 SER HB2 1 146 PHE H 2.905 . 4.010 2.958 2.958 2.958 . 0 0 "[ ]" 1
2131 1 145 SER HB2 1 146 PHE HD2 2.580 . 3.360 2.773 2.773 2.773 . 0 0 "[ ]" 1
2132 1 145 SER HB2 1 146 PHE HE2 3.340 . 4.880 3.243 3.243 3.243 . 0 0 "[ ]" 1
2133 1 145 SER HB3 1 146 PHE H 2.905 . 4.010 3.696 3.696 3.696 . 0 0 "[ ]" 1
2134 1 145 SER HB3 1 146 PHE HD2 2.580 . 3.360 2.173 2.173 2.173 . 0 0 "[ ]" 1
2135 1 145 SER HB3 1 146 PHE HE2 3.340 . 4.880 3.493 3.493 3.493 . 0 0 "[ ]" 1
2136 1 146 PHE H 1 146 PHE HD2 3.185 . 4.570 3.452 3.452 3.452 . 0 0 "[ ]" 1
2137 1 146 PHE H 1 146 PHE HE2 3.650 . 5.500 4.793 4.793 4.793 . 0 0 "[ ]" 1
2138 1 146 PHE H 1 147 VAL QG 4.760 . 7.720 3.495 3.495 3.495 . 0 0 "[ ]" 1
2139 1 146 PHE HA 1 146 PHE HB2 2.270 . 2.740 2.473 2.473 2.473 . 0 0 "[ ]" 1
2140 1 146 PHE HA 1 146 PHE HB3 2.270 . 2.740 2.492 2.492 2.492 . 0 0 "[ ]" 1
2141 1 146 PHE HA 1 147 VAL H 2.410 . 3.020 2.450 2.450 2.450 . 0 0 "[ ]" 1
2142 1 146 PHE HA 1 147 VAL QG 4.790 . 7.780 3.166 3.166 3.166 . 0 0 "[ ]" 1
2143 1 146 PHE HB2 1 147 VAL H 2.955 . 4.110 2.482 2.482 2.482 . 0 0 "[ ]" 1
2144 1 146 PHE HB3 1 147 VAL H 3.030 . 4.260 3.841 3.841 3.841 . 0 0 "[ ]" 1
2145 1 146 PHE HD1 1 147 VAL H 2.905 . 4.010 3.072 3.072 3.072 . 0 0 "[ ]" 1
2146 1 146 PHE HD1 1 147 VAL HA 3.030 . 4.260 3.053 3.053 3.053 . 0 0 "[ ]" 1
2147 1 146 PHE HD1 1 148 ARG H 3.435 . 5.070 3.793 3.793 3.793 . 0 0 "[ ]" 1
2148 1 146 PHE HD1 1 148 ARG HB2 3.650 . 5.500 4.135 4.135 4.135 . 0 0 "[ ]" 1
2149 1 146 PHE HD1 1 148 ARG QB 3.585 . 5.370 3.960 3.960 3.960 . 0 0 "[ ]" 1
2150 1 146 PHE HD1 1 148 ARG HB3 3.650 . 5.500 5.068 5.068 5.068 . 0 0 "[ ]" 1
2151 1 146 PHE HD1 1 148 ARG HD2 3.650 . 5.500 4.775 4.775 4.775 . 0 0 "[ ]" 1
2152 1 146 PHE HD1 1 148 ARG QD 3.525 . 5.250 4.002 4.002 4.002 . 0 0 "[ ]" 1
2153 1 146 PHE HD1 1 148 ARG HD3 3.650 . 5.500 4.296 4.296 4.296 . 0 0 "[ ]" 1
2154 1 146 PHE HD1 1 148 ARG QG 3.595 . 5.390 2.067 2.067 2.067 . 0 0 "[ ]" 1
2155 1 146 PHE HE1 1 147 VAL H 3.650 . 5.500 5.445 5.445 5.445 . 0 0 "[ ]" 1
2156 1 146 PHE HE1 1 147 VAL HA 3.650 . 5.500 4.263 4.263 4.263 . 0 0 "[ ]" 1
2157 1 146 PHE HE1 1 148 ARG H 3.650 . 5.500 4.433 4.433 4.433 . 0 0 "[ ]" 1
2158 1 146 PHE HE1 1 148 ARG HB2 3.605 . 5.410 4.090 4.090 4.090 . 0 0 "[ ]" 1
2159 1 146 PHE HE1 1 148 ARG QB 3.530 . 5.260 3.988 3.988 3.988 . 0 0 "[ ]" 1
2160 1 146 PHE HE1 1 148 ARG HB3 3.605 . 5.410 5.532 5.532 5.532 0.122 1 0 "[ ]" 1
2161 1 146 PHE HE1 1 148 ARG HD2 3.650 . 5.500 5.142 5.142 5.142 . 0 0 "[ ]" 1
2162 1 146 PHE HE1 1 148 ARG HD3 3.650 . 5.500 5.394 5.394 5.394 . 0 0 "[ ]" 1
2163 1 146 PHE HE1 1 148 ARG QG 3.765 . 5.730 3.117 3.117 3.117 . 0 0 "[ ]" 1
2164 1 147 VAL H 1 147 VAL MG1 3.295 . 4.790 3.000 3.000 3.000 . 0 0 "[ ]" 1
2165 1 147 VAL H 1 147 VAL QG 3.040 . 4.280 2.117 2.117 2.117 . 0 0 "[ ]" 1
2166 1 147 VAL H 1 147 VAL MG2 3.295 . 4.790 2.164 2.164 2.164 . 0 0 "[ ]" 1
2167 1 147 VAL H 1 148 ARG QG 3.890 . 5.980 3.383 3.383 3.383 . 0 0 "[ ]" 1
2168 1 147 VAL HA 1 147 VAL HB 2.240 . 2.680 2.444 2.444 2.444 . 0 0 "[ ]" 1
2169 1 147 VAL HA 1 148 ARG H 2.350 . 2.900 2.210 2.210 2.210 . 0 0 "[ ]" 1
2170 1 147 VAL HB 1 148 ARG H 2.875 . 3.950 3.127 3.127 3.127 . 0 0 "[ ]" 1
2171 1 147 VAL HB 1 149 PHE HE1 3.435 . 5.070 5.049 5.049 5.049 . 0 0 "[ ]" 1
2172 1 147 VAL HB 1 149 PHE HZ 3.200 . 4.600 3.959 3.959 3.959 . 0 0 "[ ]" 1
2173 1 147 VAL QG 1 148 ARG H 3.310 . 4.820 3.494 3.494 3.494 . 0 0 "[ ]" 1
2174 1 147 VAL QG 1 149 PHE QE 4.705 . 7.610 3.563 3.563 3.563 . 0 0 "[ ]" 1
2175 1 147 VAL MG1 1 148 ARG H 3.590 . 5.380 4.003 4.003 4.003 . 0 0 "[ ]" 1
2176 1 147 VAL MG1 1 149 PHE QE 5.100 . 8.400 5.012 5.012 5.012 . 0 0 "[ ]" 1
2177 1 147 VAL MG2 1 148 ARG H 3.590 . 5.380 3.851 3.851 3.851 . 0 0 "[ ]" 1
2178 1 147 VAL MG2 1 149 PHE QE 5.100 . 8.400 3.646 3.646 3.646 . 0 0 "[ ]" 1
2179 1 148 ARG H 1 148 ARG HD2 3.650 . 5.500 5.208 5.208 5.208 . 0 0 "[ ]" 1
2180 1 148 ARG H 1 148 ARG HD3 3.650 . 5.500 5.542 5.542 5.542 0.042 1 0 "[ ]" 1
2181 1 148 ARG H 1 148 ARG HG2 3.650 . 5.500 3.594 3.594 3.594 . 0 0 "[ ]" 1
2182 1 148 ARG H 1 148 ARG QG 3.335 . 4.870 2.926 2.926 2.926 . 0 0 "[ ]" 1
2183 1 148 ARG H 1 148 ARG HG3 3.650 . 5.500 3.099 3.099 3.099 . 0 0 "[ ]" 1
2184 1 148 ARG HA 1 148 ARG HE 3.650 . 5.500 5.323 5.323 5.323 . 0 0 "[ ]" 1
2185 1 148 ARG HA 1 149 PHE H 2.365 . 2.930 2.413 2.413 2.413 . 0 0 "[ ]" 1
2186 1 148 ARG HB2 1 149 PHE H 3.650 . 5.500 3.542 3.542 3.542 . 0 0 "[ ]" 1
2187 1 148 ARG HB3 1 149 PHE H 3.650 . 5.500 2.564 2.564 2.564 . 0 0 "[ ]" 1
2188 1 148 ARG QD 1 149 PHE H 4.090 . 6.380 4.347 4.347 4.347 . 0 0 "[ ]" 1
2189 1 148 ARG QG 1 149 PHE H 3.995 . 6.190 4.124 4.124 4.124 . 0 0 "[ ]" 1
2190 1 149 PHE H 1 149 PHE HD2 3.110 . 4.420 3.789 3.789 3.789 . 0 0 "[ ]" 1
2191 1 149 PHE H 1 149 PHE QE 4.710 . 7.620 5.263 5.263 5.263 . 0 0 "[ ]" 1
2192 1 149 PHE H 1 150 HIS H 3.200 . 4.600 4.434 4.434 4.434 . 0 0 "[ ]" 1
2193 1 149 PHE HA 1 150 HIS H 2.455 . 3.110 2.387 2.387 2.387 . 0 0 "[ ]" 1
2194 1 149 PHE HA 1 150 HIS HD2 3.200 . 4.600 3.074 3.074 3.074 . 0 0 "[ ]" 1
2195 1 149 PHE HB2 1 150 HIS H 3.650 . 5.500 3.845 3.845 3.845 . 0 0 "[ ]" 1
2196 1 149 PHE HB2 1 150 HIS HA 3.155 . 4.510 4.528 4.528 4.528 0.018 1 0 "[ ]" 1
2197 1 149 PHE HB3 1 150 HIS H 3.510 . 5.220 2.755 2.755 2.755 . 0 0 "[ ]" 1
2198 1 149 PHE QD 1 150 HIS H 4.710 . 7.620 3.740 3.740 3.740 . 0 0 "[ ]" 1
2199 1 150 HIS H 1 150 HIS HD2 3.260 . 4.720 3.401 3.401 3.401 . 0 0 "[ ]" 1
2200 1 150 HIS H 1 151 SER H 3.060 . 4.320 4.193 4.193 4.193 . 0 0 "[ ]" 1
2201 1 150 HIS HA 1 151 SER H 2.425 . 3.050 2.164 2.164 2.164 . 0 0 "[ ]" 1
2202 1 150 HIS HB2 1 151 SER H 2.985 . 4.170 3.362 3.362 3.362 . 0 0 "[ ]" 1
2203 1 150 HIS HB3 1 151 SER H 3.355 . 4.910 3.742 3.742 3.742 . 0 0 "[ ]" 1
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