NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type |
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20056 |
2ezx   |
cing | 1-original | 15 | PIPP | chemical shift |
SHIFT_FL_FRMT RES_SIAD FIRST_RES_IN_SEQ 1 EXP_PEAK_PICK_TBL Label Exp Par Fl Peak-Pick Fl #-Cross-Ref A barf_40c.DAT hsqc 178 B ft/C cbcaconh 1127 RES_ID 1 RES_TYPE MET SPIN_SYSTEM_ID 1 HETEROGENEITY 100 HA 4.557 CA 55.8144 HB1|HB2 2.088 HB2|HB1 1.987 CB 33.4221 HG1|HG2 2.557 HG2|HG1 2.503 CG 32.240 C 176.405 END_RES_DEF RES_ID 2 RES_TYPE THR PREV_TYPE MET(24.5) SPIN_SYSTEM_ID 2 HETEROGENEITY 100 HN 8.2312 (A.63 B.117 B.118) N 114.9877 (A.63 B.117 B.118) CA:-1 55.8144 (B.117) CB:-1 33.4221 (B.118) HA 4.449 CA 61.9400 HB 4.320 CB 70.1200 CG2 21.891 HG2# 1.226 C 175.0461 END_RES_DEF RES_ID 3 RES_TYPE THR PREV_TYPE THR(100.0) SPIN_SYSTEM_ID 3 HETEROGENEITY 100 CA:-1 61.9116 (B.155) CB:-1 70.1203 (B.154) HN 8.1737 (B.154 B.155 B.205) N 116.0275 (B.154 B.155 B.205) HA 4.272 CA 62.8528 (B.205) HB 4.083 CB 70.1300 HG2# 1.048 CG2 22.007 END_RES_DEF RES_ID 4 RES_TYPE SER PREV_TYPE THR(100.0) SPIN_SYSTEM_ID 4 HETEROGENEITY 100 HN 8.3552 (A.39 B.67 B.68 B.107 B.108 B.109) N 117.1937 (A.39 B.67 B.68 B.107 B.108 B.109) CA:-1 62.7073 (B.67) CB:-1 70.3349 (B.68 B.109) HA 4.486 CA 58.8094 (B.108) HB1|HB2 4.002 HB2|HB1 4.175 CB 64.590 C 175.7096 END_RES_DEF RES_ID 5 RES_TYPE GLN PREV_TYPE SER(100.0) SPIN_SYSTEM_ID 5 HETEROGENEITY 100 CA:-1 58.7811 (B.175) CB:-1 64.5836 (B.174) HN 8.5717 (B.174 B.175 B.224) N 123.2410 (B.174 B.175 B.224) HA 4.020 CA 58.7500 CB 28.9457 (B.224) HB1|HB2 2.107 HB2|HB1 2.21 CG 33.763 HG1|HG2 2.450 NE2 114.48 HE21|HE22 7.867 HE22|HE21 6.863 C 177.4594 END_RES_DEF RES_ID 6 RES_TYPE LYS PREV_TYPE CYS(23.9) GLN(22.8) GLU(21.4) ARG(14.0) TRP(10.9) SPIN_SYSTEM_ID 6 HETEROGENEITY 100 HN 8.2832 (A.38 B.65 B.66 B.103 B.104 B.105 B.106) N 118.2600 (A.38 B.65 B.66 B.103 B.104 B.105 B.106) CA:-1 58.5584 (B.65 B.104) CB:-1 28.7015 (B.66 B.106) CA 59.9050 (B.103) HA 4.178 CB 32.9873 (B.105) HB1|HB2 1.765 HB2|HB1 1.826 CG 26.170 HG1|HG2 1.68 HG2|HG1 1.35 CD 29.65 HD1|HD2 1.762 HD2|HD1 1.647 CE 42.53 HE1|HE2 2.774 HE2|HE1 2.972 END_RES_DEF RES_ID 7 RES_TYPE HIS PREV_TYPE LYS(45.1) MET(23.4) VAL(17.2) PRO(8.3) TRP(6.1) SPIN_SYSTEM_ID 7 HETEROGENEITY 100 HN 8.1660 (A.43 B.75 B.76 B.117) N 119.0645 (A.43 B.75 B.76 B.117) CA:-1 59.9106 (B.76) CB:-1 32.9945 (B.75) CA 60.3000 HA 4.210 CB 31.5690 (B.117) HB1|HB2 3.485 HB2|HB1 3.030 HE1 7.527 CE1 137.64 HD2 6.851 CD2 118.75 C 176.2608 END_RES_DEF RES_ID 8 RES_TYPE ARG PREV_TYPE LYS(35.9) TRP(16.9) VAL(14.0) MET(11.5) PRO(10.4) \ ARG(7.6) SPIN_SYSTEM_ID 8 HETEROGENEITY 100 HN 8.0926 (A.48 B.91 B.92 B.130 B.131) N 118.2206 (A.48 B.91 B.92 B.130 B.131) CA:-1 60.2990 (B.91) CB:-1 31.5612 (B.92) CA 59.7204 (B.131) HA 4.029 CB 30.4970 (B.130) HB# 1.943 CG 27.907 HG# 1.672 CD 44.053 HD# 3.256 C 178.5988 END_RES_DEF RES_ID 9 RES_TYPE ASP PREV_TYPE TRP(27.2) ARG(24.4) GLU(16.8) LYS(10.0) CYS(6.3) SPIN_SYSTEM_ID 9 HETEROGENEITY 100 HN 8.5213 (A.36 B.61 B.62 B.99 B.100) N 117.8516 (A.36 B.61 B.62 B.99 B.100) CA:-1 59.5963 (B.61) CB:-1 30.5387 (B.62) CA 56.5494 (B.99) HA 4.466 CB 40.8421 (B.100) HB1|HB2 2.750 HB2|HB1 2.658 C 177.6013 END_RES_DEF RES_ID 10 RES_TYPE PHE PREV_TYPE ASP(30.8) PHE(27.1) TYR(26.3) LEU(14.0) SPIN_SYSTEM_ID 10 HETEROGENEITY 100 HN 8.0391 (A.47 B.89 B.90 B.127 B.128 B.129) N 119.0528 (A.47 B.89 B.90 B.127 B.128 B.129) CA:-1 56.5586 (B.90 B.129) CB:-1 40.7590 (B.89 B.128) CA 62.0866 (B.127) HA 3.990 CB 40.3860 HB1|HB2 3.357 HB2|HB1 3.079 CD1|CD2 132.21 HD1|HD2 6.945 CE1|CE2 132.11 HE1|HE2 7.284 CZ 128.89 HZ 7.520 C 177.853 END_RES_DEF RES_ID 11 RES_TYPE VAL PREV_TYPE ILE(53.9) PHE(26.1) TYR(19.9) SPIN_SYSTEM_ID 11 HETEROGENEITY 100 HN 8.0720 (A.79 B.144 B.145 B.194 B.195) N 109.4260 (A.79 B.144 B.145 B.194 B.195) CA:-1 62.0930 (B.145) CB:-1 40.4955 (B.144) CA 63.8241 (B.194) HA 4.307 CB 32.0423 (B.195) HB 2.320 CG1|CG2 22.799 HG1#|HG2# 1.09 CG2|CG1 19.880 HG2#|HG1# 1.01 C 175.3066 END_RES_DEF RES_ID 12 RES_TYPE ALA PREV_TYPE GLU(19.5) CYS(18.1) GLN(17.1) ARG(15.6) HIS(12.7) \ HIH(6.7) TRP(6.3) SPIN_SYSTEM_ID 12 HETEROGENEITY 100 HN 7.1465 (A.54 A.55 B.102 B.103 B.145 B.146) N 119.0146 (A.54 A.55 B.102 B.103 B.145 B.146) CA:-1 63.7812 (B.102) CB:-1 29.1982 (B.103) CA 52.7262 (B.146) HA 4.428 CB 20.6724 (B.145) HB# 1.54 C 177.2970 END_RES_DEF RES_ID 13 RES_TYPE GLU PREV_TYPE ALA(100.0) SPIN_SYSTEM_ID 13 HETEROGENEITY 100 HN 7.4426 (A.66 B.119 B.120 B.164 B.165 B.166 B.167) N 114.1581 (A.66 B.119 B.120 B.164 B.165 B.166 B.167) CA:-1 52.7839 (B.119 B.166) CB:-1 20.6668 (B.120 B.165) CA 53.7560 (B.167) HA 4.94 CB 30.5940 (B.164) HB1|HB2 1.99 HB2|HB1 1.93 CG 33.83 HG1|HG2 2.23 HG2|HG1 2.17 END_RES_DEF RES_ID 14 RES_TYPE PRO SPIN_SYSTEM_ID 14 HETEROGENEITY 100 CA 64.2944 HA 4.04 CB 31.7786 HB1|HB2 1.667 HB2|HB1 2.411 CG 27.850 HG1|HG2 1.94 CD 51.044 HD1|HD2 3.52 C 176.2470 END_RES_DEF RES_ID 15 RES_TYPE MET PREV_TYPE PRO(49.6) SPIN_SYSTEM_ID 15 HETEROGENEITY 100 HN 8.2936 (A.14 B.20 B.21 B.34 B.35 B.36 B.37) N 123.0812 (A.14 B.20 B.21 B.34 B.35 B.36 B.37) CA:-1 64.2944 (B.20 B.34) CB:-1 31.7786 (B.21 B.37) CA 57.2356 (B.35) HA 4.229 CB 34.7059 (B.36) HB1|HB2 1.53 HB2|HB1 1.72 CG 30.379 HG1|HG2 2.18 HG2|HG1 1.671 CE 16.50 HE# 0.482 C 176.817 END_RES_DEF RES_ID 16 RES_TYPE GLY PREV_TYPE LYS(43.0) TRP(25.1) MET(20.6) ARG(6.0) ASN(5.2) SPIN_SYSTEM_ID 16 HETEROGENEITY 100 HN 10.1771 (A.62 B.184 B.185 B.161) N 112.3358 (A.62 B.184 B.185 B.161) CA:-1 57.1301 (B.184) CB:-1 34.6152 (B.185) CA 48.3906 (B.161) HA1|HA2 3.71 HA1|HA2 3.75 C 176.5484 END_RES_DEF RES_ID 17 RES_TYPE GLU PREV_TYPE GLY(100.0) SPIN_SYSTEM_ID 17 HETEROGENEITY 100 HN 8.6448 (A.4 B.3 B.7 B.8 B.9 B.1 B.4) N 126.7684 (A.4 B.3 B.7 B.8 B.9 B.1 B.4) CA:-1 48.3483 (B.3 B.7) CA 55.0597 (B.8 B.1) HA 4.568 CB 29.4492 (B.9 B.4) HB1|HB2 1.76 HB2|HB1 2.43 CG 36.082 HG1|HG2 2.39 HG2|HG1 2.19 C 176.204 END_RES_DEF RES_ID 18 RES_TYPE LYS PREV_TYPE GLN(24.3) HIH(15.1) CYS(14.7) GLU(14.6) ARG(12.5) \ HIS(12.4) SPIN_SYSTEM_ID 18 HETEROGENEITY 100 HN 8.4814 (A.19 B.29 B.30 B.52 B.53 B.54 B.55) N 120.9350 (A.19 B.29 B.30 B.52 B.53 B.54 B.55) CA:-1 55.0524 (B.29 B.55) CB:-1 29.3595 (B.30 B.54) CA 57.2564 (B.52) HA 4.36 CB 32.7628 (B.53) HB1|HB2 1.844 HB2|HB1 2.044 CG 27.61 HG1|HG2 1.93 HG2|HG1 1.573 CD 29.34 CE 42.47 END_RES_DEF RES_ID 19 RES_TYPE PRO SPIN_SYSTEM_ID 19 HETEROGENEITY 100 CA 62.4816 HA 4.772 CB 33.3806 HB1|HB2 2.379 HB2|HB1 2.57 CG 27.333 HG1|HG2 2.18 HG2|HG1 2.00 CD 51.267 HD1|HD2 3.95 HD2|HD1 3.78 C 177.6324 END_RES_DEF RES_ID 20 RES_TYPE VAL PREV_TYPE VAL(50.6) PRO(49.4) SPIN_SYSTEM_ID 20 HETEROGENEITY 100 HN 8.1766 (A.25 B.41 B.42 B.72 B.73) N 120.6598 (A.25 B.41 B.42 B.72 B.73) CA:-1 62.4816 (B.41) CB:-1 33.3806 (B.42) CA 65.9821 (B.72) HA 3.517 CB 32.2322 (B.73) HB 1.73 CG1|CG2 23.550 HG1#|HG2# 1.064 CG2|CG1 21.267 HG2#|HG1# 0.98 C 175.5354 END_RES_DEF RES_ID 21 RES_TYPE GLY PREV_TYPE VAL(50.4) PRO(49.6) SPIN_SYSTEM_ID 21 HETEROGENEITY 100 HN 8.2205 (A.75 B.136 B.137 B.188) N 105.2901 (A.75 B.136 B.137 B.188) CA:-1 66.0843 (B.136) CB:-1 32.3341 (B.137) CA 45.7975 (B.188) HA1|HA2 4.037 HA2|HA1 3.729 C 174.3989 END_RES_DEF RES_ID 22 RES_TYPE SER PREV_TYPE GLY(100.0) SPIN_SYSTEM_ID 22 HETEROGENEITY 100 HN 7.7258 (A.68 B.123 B.171 B.172 B.173) N 114.0327 (A.68 B.123 B.171 B.172 B.173) CA:-1 45.7977 (B.123 B.173) CA 60.8003 (B.171) HA 4.372 CB 64.0624 (B.172) HB1|HB2 4.022 HB2|HB1 4.130 C 174.989 END_RES_DEF RES_ID 23 RES_TYPE LEU PREV_TYPE SER(100.0) SPIN_SYSTEM_ID 23 HETEROGENEITY 100 HN 7.5208 (A.26 B.43 B.44 B.74 B.75) N 121.2402 (A.26 B.43 B.44 B.74 B.75) CA:-1 60.7983 (B.43) CB:-1 63.9409 (B.44) CA 55.2209 (B.74) HA 3.402 CB 42.4608 (B.75) HB1|HB2 1.895 HB2|HB1 1.180 CG 27.47 HG 1.31 CD1|CD2 25.82 HD1#|HD2# 0.865 CD2|CD1 25.06 HD2#|HD1# 0.066 C 177.4861 END_RES_DEF RES_ID 24 RES_TYPE ALA PREV_TYPE LEU(48.6) PHE(18.4) TYR(16.8) ASP(16.2) SPIN_SYSTEM_ID 24 HETEROGENEITY 100 HN 6.6642 (A.9 B.12 B.13) N 124.8823 (A.9 B.12 B.13) CA 53.6300 HA 3.966 CB 19.1600 HB# 1.33 C 175.3462 CA:-1 55.2033 (B.12) CB:-1 42.4197 (B.13) END_RES_DEF RES_ID 25 RES_TYPE GLY PREV_TYPE ALA(100.0) SPIN_SYSTEM_ID 25 HETEROGENEITY 100 HN 8.1634 (A.77 B.140 B.141 B.190 B.191) N 107.3640 (A.77 B.140 B.141 B.190 B.191) CA:-1 53.6255 (B.140 B.191) CB:-1 19.1150 (B.141) CA 45.7080 (B.190) HA1|HA2 4.524 HA2|HA1 3.807 C 173.2524 END_RES_DEF RES_ID 26 RES_TYPE ILE PREV_TYPE GLY(100.0) SPIN_SYSTEM_ID 26 HETEROGENEITY 100 HN 7.1254 (A.53 B.101) N 118.4346 (A.53 B.101) CA:-1 45.7124 (B.101) CA 58.4400 HA 4.135 CB 33.9600 HB 2.427 CG1 27.060 HG11|HG12 1.07 HG12|HG11 1.36 CG2 18.306 HG2# 0.721 CD 8.83 HD# 0.555 C 175.5060 END_RES_DEF RES_ID 27 RES_TYPE GLY PREV_TYPE LYS(33.6) MET(28.1) TRP(14.2) VAL(12.7) PRO(6.2) \ ARG(5.1) ILE(0.0) SPIN_SYSTEM_ID 27 HETEROGENEITY 100 HN 6.9580 (A.87 B.150 B.151 B.201) N 111.2722 (A.87 B.150 B.151 B.201) CA:-1 58.3707 (B.150) CB:-1 33.9864 (B.151) CA 44.7478 (B.201) HA1|HA2 3.986 HA2|HA1 4.436 C 174.8065 END_RES_DEF RES_ID 28 RES_TYPE GLU PREV_TYPE GLY(100.0) SPIN_SYSTEM_ID 28 HETEROGENEITY 100 HN 8.5846 (A.34 B.58 B.97 B.98) N 119.0165 (A.34 B.58 B.97 B.98) CA:-1 44.7934 (B.58) CA 60.1740 (B.97) HA 4.015 CB 30.2730 (B.98) HB1|HB2 2.071 HB2|HB1 2.10 CG 36.621 HG1|HG2 2.31 HG2|HG1 2.36 C 177.4337 END_RES_DEF RES_ID 29 RES_TYPE VAL PREV_TYPE GLU(16.9) CYS(9.4) LYS(5.2) SPIN_SYSTEM_ID 29 HETEROGENEITY 100 CA:-1 60.3136 (B.81) CB:-1 30.2640 (B.82) CA 66.6530 HA 3.747 CB 31.6720 HB 2.19 CG1|CG2 22.697 HG1#|HG2# 1.082 CG2|CG1 21.118 HG2#|HG1# 0.97 C 178.7948 HN 8.1437 (B.81 B.82) N 118.9669 (B.81 B.82) END_RES_DEF RES_ID 30 RES_TYPE LEU PREV_TYPE PRO(60.4) VAL(39.6) SPIN_SYSTEM_ID 30 HETEROGENEITY 100 HN 7.8311 (A.46 B.87 B.88) N 119.0696 (A.46 B.87 B.88) CA:-1 66.5880 (B.87) CB:-1 31.7762 (B.88) CA 58.2600 HA 3.99 CB 42.1700 HB1|HB2 1.795 HB2|HB1 1.464 CG 27.65 HG 1.88 CD1|CD2 23.482 HD1#|HD2# 0.7791 CD2|CD1 25.271 HD2#|HD1# 0.953 C 179.4540 END_RES_DEF RES_ID 31 RES_TYPE GLY PREV_TYPE LEU(51.6) ILE(15.2) PHE(13.7) TYR(12.9) ASP(6.6) SPIN_SYSTEM_ID 31 HETEROGENEITY 100 HN 8.6522 (A.73 B.132 B.133 B.186) N 106.3445 (A.73 B.132 B.133 B.186) CA:-1 58.2576 (B.132) CB:-1 42.1352 (B.133) CA 47.5469 (B.186) HA1|HA2 3.410 HA2|HA1 3.867 C 175.4933 END_RES_DEF RES_ID 32 RES_TYPE LYS PREV_TYPE GLY(100.0) SPIN_SYSTEM_ID 32 HETEROGENEITY 100 HN 7.5185 (A.27 B.45 B.76 B.77 B.78 B.231 B.232) N 120.7604 (A.27 B.45 B.76 B.77 B.78 B.231 B.232) CA:-1 47.5760 CA 59.2120 HA 4.182 CB 32.3770 HB1|HB2 1.955 CG 25.158 HG1|HG2 1.60 HG2|HG1 1.53 CD 29.212 HD1|HD2 1.74 CE 42.321 HE1|HE2 3.022 C 179.3199 END_RES_DEF RES_ID 33 RES_TYPE LYS PREV_TYPE LYS(42.0) MET(29.8) TRP(9.1) VAL(7.1) SPIN_SYSTEM_ID 33 HETEROGENEITY 100 HN 7.3593 (A.56 B.104 B.105 B.147 B.148) N 118.0851 (A.56 B.104 B.105 B.147 B.148) CA:-1 59.1978 (B.105 B.147) CB:-1 32.2621 (B.104 B.148) CA 59.3500 HA 4.142 CB 32.6000 HB1|HB2 1.98 CG 22.959 HG1|HG2 1.841 CD 29.433 HD1|HD2 1.656 CE 42.25 C 178.2324 END_RES_DEF RES_ID 34 RES_TYPE LEU PREV_TYPE LYS(16.8) ARG(12.2) HIS(12.0) GLU(7.3) SPIN_SYSTEM_ID 34 HETEROGENEITY 100 HN 8.1825 (A.42 B.73 B.74 B.115 B.116) N 119.5380 (A.42 B.73 B.74 B.115 B.116) CA:-1 59.4505 (B.74) CB:-1 32.7004 (B.73) CA 58.9500 (B.116) HA 3.925 CB 40.7202 (B.115) HB1|HB2 2.06 HB2|HB1 1.99 CG 27.79 HG 1.54 CD1|CD2 23.08 HD1#|HD2# 0.53 CD2|CD1 26.69 HD2#|HD1# 0.780 C 179.8527 END_RES_DEF RES_ID 35 RES_TYPE GLU PREV_TYPE ILE(30.7) PHE(20.4) LEU(20.0) TYR(18.3) ASP(10.6) SPIN_SYSTEM_ID 35 HETEROGENEITY 100 HN 8.7276 (A.21 B.33 B.34 B.60 B.61) N 121.2846 (A.21 B.33 B.34 B.60 B.61) CA:-1 58.9536 (B.33) CB:-1 40.7234 (B.34) CA 60.8437 (B.60) HA 3.429 CB 29.7358 (B.61) HB1|HB2 2.30 HB2|HB1 2.10 CG 37.023 HG1|HG2 2.53 HG2|HG1 2.13 C 180.9294 END_RES_DEF RES_ID 36 RES_TYPE GLU PREV_TYPE TRP(42.6) GLU(16.0) CYS(14.6) ARG(13.5) SPIN_SYSTEM_ID 36 HETEROGENEITY 100 HN 8.1836 (A.41 B.71 B.72 B.113 B.114 B.222) N 120.0003 (A.41 B.71 B.72 B.113 B.114 B.222) CA:-1 60.8873 (B.71 B.222) CB:-1 29.6482 (B.72 B.114) CA 59.1705 (B.113) HA 4.115 CB 29.8000 HB1|HB2 2.17 HB2|HB1 2.276 CG 36.754 HG1|HG2 2.400 HG1|HG2 2.540 C 178.1452 END_RES_DEF RES_ID 37 RES_TYPE ARG PREV_TYPE GLU(23.2) SPIN_SYSTEM_ID 37 HETEROGENEITY 100 HN 7.3657 (A.58 B.108 B.109 B.151 B.152 B.153) N 116.2862 (A.58 B.108 B.109 B.151 B.152 B.153) CA:-1 59.1981 (B.108 B.152) CB:-1 29.8756 (B.109) CA 55.3438 (B.151) HA 4.528 CB 30.5770 (B.153) HB1|HB2 1.98 HB2|HB1 2.44 CG 27.690 HG1|HG2 1.89 CD 43.080 HD1|HD2 3.33 HD2|HD1 3.26 C 175.6889 END_RES_DEF RES_ID 38 RES_TYPE GLY PREV_TYPE ARG(19.1) GLU(17.6) HIS(16.5) CYS(15.2) GLN(13.2) \ TRP(7.0) SPIN_SYSTEM_ID 38 HETEROGENEITY 100 HN 7.8317 (A.76 B.138 B.139 B.189) N 105.8745 (A.76 B.138 B.139 B.189) CA:-1 55.3643 (B.138) CB:-1 30.6300 (B.139) CA 45.2359 (B.189) HA1|HA2 4.255 HA2|HA1 3.705 C 174.2643 END_RES_DEF RES_ID 39 RES_TYPE PHE PREV_TYPE GLY(100.0) SPIN_SYSTEM_ID 39 HETEROGENEITY 100 HN 8.3557 (A.15 B.22 B.38 B.39 B.40 B.41) N 122.6136 (A.15 B.22 B.38 B.39 B.40 B.41) CA:-1 45.1759 (B.22 B.40) CA 56.2492 (B.39) HA 4.396 CB 38.3889 (B.41) HB1|HB2 2.765 HB2|HB1 3.055 CD1|CD2 132.17 HD1|HD2 7.065 CE1|CE2 132.237 HE1|HE2 7.473 CZ 130.78 HZ 7.544 C 173.3227 END_RES_DEF RES_ID 40 RES_TYPE ASP PREV_TYPE ASN(43.7) TYR(22.4) PHE(21.1) ASP(9.6) SPIN_SYSTEM_ID 40 HETEROGENEITY 100 HN 8.1486 (A.70 B.126 B.127 B.178 B.179 B.181) N 112.6051 (A.70 B.126 B.127 B.178 B.179 B.181) CA:-1 56.1573 (B.126 B.178) CB:-1 38.3789 (B.127) CA 54.9733 (B.181) HA 4.328 CB 40.6029 (B.179) HB1|HB2 2.865 HB2|HB1 2.604 C 177.2549 END_RES_DEF RES_ID 41 RES_TYPE LYS PREV_TYPE ASP(49.2) LEU(18.3) PHE(14.4) TYR(13.5) SPIN_SYSTEM_ID 41 HETEROGENEITY 100 HN 7.0657 (A.52 B.99 B.100 B.140 B.141) N 118.8066 (A.52 B.99 B.100 B.140 B.141) CA:-1 54.8754 (B.100) CB:-1 40.5999 (B.99) CA 53.9919 (B.140) HA 4.622 CB 35.9977 (B.141) HB1|HB2 1.82 HB2|HB1 0.845 CG 24.837 HG1|HG2 1.28 HG2|HG1 1.34 CD 29.350 HD1|HD2 1.60 HD2|HD1 1.50 CE 43.034 HE1|HE2 3.06 C 176.5959 END_RES_DEF RES_ID 42 RES_TYPE ALA PREV_TYPE MET(33.0) LYS(28.8) ASN(17.6) ARG(8.2) HIS(5.4) SPIN_SYSTEM_ID 42 HETEROGENEITY 100 HN 8.4541 (A.5 B.4 B.5 B.10 B.11 B.12 B.13) N 125.6646 (A.5 B.4 B.5 B.10 B.11 B.12 B.13) CA:-1 53.9402 (B.4 B.11) CB:-1 35.9563 (B.5 B.13) CA 56.7643 (B.12) HA 3.812 CB 17.3484 (B.10) HB# 1.405 C 180.0342 END_RES_DEF RES_ID 43 RES_TYPE TYR PREV_TYPE ALA(100.0) SPIN_SYSTEM_ID 43 HETEROGENEITY 100 HN 9.2633 (A.61 B.114 B.115 B.159 B.160) N 113.6297 (A.61 B.114 B.115 B.159 B.160) CA:-1 56.7322 (B.114) CB:-1 17.3368 (B.115) CA 60.2453 (B.159) HA 4.549 CB 36.8221 (B.160) HB1|HB2 3.339 HB2|HB1 2.759 CD1|CD2 134.95 HD1|HD2 7.155 CE1|CE2 118.385 HE1|HE2 6.830 C 176.8443 END_RES_DEF RES_ID 44 RES_TYPE VAL PREV_TYPE ILE(30.1) VAL(22.6) TYR(20.4) PHE(15.1) PRO(11.7) SPIN_SYSTEM_ID 44 HETEROGENEITY 100 HN 7.2715 (A.8 B.10 B.11 B.19 B.20) N 124.1921 (A.8 B.10 B.11 B.19 B.20) CA:-1 60.2997 (B.10) CB:-1 36.7632 (B.11) CA 65.2779 (B.19) HA 3.626 CB 32.3668 (B.20) HB 2.041 CG1|CG2 23.889 HG1#|HG2# 1.15 CG2|CG1 23.148 HG2#|HG1 0.722 C 178.1669 END_RES_DEF RES_ID 45 RES_TYPE VAL PREV_TYPE VAL(58.9) PRO(41.1) SPIN_SYSTEM_ID 45 HETEROGENEITY 100 HN 6.9040 (A.12 B.16 B.17 B.27 B.29) N 118.5186 (A.12 B.16 B.17 B.27 B.29) CA:-1 65.2238 (B.16) CB:-1 32.5100 (B.17) CA 66.6357 (B.27) HA 3.728 CB 31.3713 (B.29) HB 2.23 CG1|CG2 24.75 HG1#|HG2# 1.117 CG2|CG1 22.64 HG2#|HG1# 1.19 C 179.9119 END_RES_DEF RES_ID 46 RES_TYPE LEU PREV_TYPE VAL(100.0) SPIN_SYSTEM_ID 46 HETEROGENEITY 100 CA:-1 66.6603 (B.163) CB:-1 31.3700 CA 58.7100 HA 3.933 CB 40.1100 HB1|HB2 2.25 HB2|HB1 1.06 CG 27.635 HG 1.50 CD1|CD2 24.04 HD1#|HD2# 0.895 CD2|CD1 26.03 HD2#|HD1# 0.750 C 178.2479 HN 8.1913 (B.163) N 119.5822 (B.163) END_RES_DEF RES_ID 47 RES_TYPE GLY PREV_TYPE PHE(30.5) TYR(27.8) ILE(20.6) ASP(14.4) LEU(6.8) SPIN_SYSTEM_ID 47 HETEROGENEITY 100 HN 8.4546 (A.74 B.134 B.135 B.187) N 105.8470 (A.74 B.134 B.135 B.187) CA:-1 58.7130 (B.134) CB:-1 40.1090 (B.135) CA 50.2463 (B.187) HA1|HA2 3.923 HA2|HA1 3.984 C 174.0185 END_RES_DEF RES_ID 48 RES_TYPE GLN PREV_TYPE GLY(100.0) SPIN_SYSTEM_ID 48 HETEROGENEITY 100 HN 7.4804 (A.10 B.14 B.22 B.23) N 122.3478 (A.10 B.14 B.22 B.23) CA:-1 50.2083 (B.14) CA 58.1353 (B.22) HA 3.933 CB 27.8196 (B.23) HB1|HB2 1.799 HB2|HB1 1.400 CG 31.55 HG1|HG2 2.378 NE2 112.045 HE21|HE22 7.47 HE22|HE21 6.81 C 179.8900 END_RES_DEF RES_ID 49 RES_TYPE PHE PREV_TYPE GLN(36.6) GLN(32.6) GLU(17.5) TRP(7.7) ARG(5.7) SPIN_SYSTEM_ID 49 HETEROGENEITY 100 CA 61.6600 HA 3.956 CB 39.5000 HB1|HB2 3.503 HB2|HB1 2.642 CD1|CD2 131.85 HD1|HD2 6.486 CE1|CE2 131.516 HE1|HE2 6.909 CZ 127.63 HZ 6.601 C 176.4741 CA:-1 58.1354 (B.80) CB:-1 28.8199 (B.79) HN 8.1915 (B.79 B.80) N 119.2876 (B.79 B.80) END_RES_DEF RES_ID 50 RES_TYPE LEU PREV_TYPE ILE(38.0) PHE(32.8) TYR(29.2) SPIN_SYSTEM_ID 50 HETEROGENEITY 100 HN 8.4115 (A.37 B.63 B.64 B.101 B.102) N 117.8928 (A.37 B.63 B.64 B.101 B.102) CA:-1 61.6562 (B.63) CB:-1 39.5017 (B.64) CA 58.0405 (B.101) HA 4.003 CB 40.9941 (B.102) HB1|HB2 2.28 HB2|HB1 1.84 CG 26.65 HG 2.27 CD1|CD2 26.00 HD1#|HD2# 1.05 CD2|CD1 22.377 HD2#|HD1# 0.816 C 181.0049 END_RES_DEF RES_ID 51 RES_TYPE VAL PREV_TYPE LEU(28.7) PHE(20.4) TYR(19.4) ASP(18.3) ILE(13.2) SPIN_SYSTEM_ID 51 HETEROGENEITY 100 HN 8.8314 (A.22 B.35 B.36) N 121.1055 (A.22 B.35 B.36) CA:-1 58.1343 (B.35) CB:-1 41.0302 (B.36) CA 66.7180 HA 4.031 CB 31.6600 HB 2.152 CG1|CG2 23.082 HG1#|HG2# 1.093 CG2|CG1 21.591 HG2#|HG1# 1.01 C 178.0316 END_RES_DEF RES_ID 52 RES_TYPE LEU PREV_TYPE VAL(37.1) SPIN_SYSTEM_ID 52 HETEROGENEITY 100 HN 7.4927 (A.57 B.106 B.107 B.149 B.150) N 117.5475 (A.57 B.106 B.107 B.149 B.150) CA:-1 66.6735 (B.106) CB:-1 31.5765 (B.107) CA 54.5521 (B.149) HA 4.329 CB 40.3899 (B.150) HB1|HB2 1.85 CG 26.183 HG 1.88 CD1|CD2 21.90 HD1#|HD2# 0.85 CD2|CD1 26.09 HD2#|HD1# 0.79 C 175.8365 END_RES_DEF RES_ID 53 RES_TYPE LYS PREV_TYPE LEU(16.1) PHE(10.9) TYR(10.3) ASN(7.2) SPIN_SYSTEM_ID 53 HETEROGENEITY 100 HN 8.2470 (A.59 B.110 B.111 B.154 B.156) N 115.8767 (A.59 B.110 B.111 B.154 B.156) CA:-1 54.5493 (B.110) CB:-1 40.3924 (B.111) CA 57.5106 (B.156) HA 3.965 CB 28.4608 (B.154) HB1|HB2 1.96 HB2|HB1 2.03 CG 26.225 HG1|HG2 1.47 HG2|HG1 1.32 CD 29.465 HD1|HD2 1.75 HD2|HD1 1.75 CE 42.60 HE1|HE2 2.961 HE2|HE1 3.063 C 175.808 END_RES_DEF RES_ID 54 RES_TYPE LYS PREV_TYPE CYS(24.7) GLN(23.8) GLU(15.6) HIH(12.6) ARG(9.4) \ TRP(8.7) HIS(5.2) SPIN_SYSTEM_ID 54 HETEROGENEITY 100 HN 8.2823 (A.78 B.142 B.143 B.192 B.193) N 108.1188 (A.78 B.142 B.143 B.192 B.193) CA:-1 57.5924 (B.142) CB:-1 28.4978 (B.143) CA 55.9897 (B.192) HA 1.956 CB 29.7170 (B.193) HB1|HB2 1.963 HB2|HB1 1.37 CG 24.930 HG1|HG2 0.49 HG2|HG1 0.60 CD 30.39 HD1|HD2 1.27 HD2|HD1 1.35 CE 41.34 HE1|HE2 2.18 HE2|HE1 1.89 C 174.8432 END_RES_DEF RES_ID 55 RES_TYPE ASP PREV_TYPE LYS(100.0) SPIN_SYSTEM_ID 55 HETEROGENEITY 100 CA:-1 55.3953 (B.156) CB:-1 32.1565 (B.157) HN 7.1438 (B.156 B.157 B.206 B.207 B.209 B.211) N 119.1554 (B.156 B.157 B.206 B.207 B.209 B.211) CA 55.3625 (B.206 B.209) HA 4.475 CB 44.0806 (B.207 B.211) HB1|HB2 2.979 HB2|HB1 2.58 C 176.1598 END_RES_DEF RES_ID 56 RES_TYPE GLU PREV_TYPE LEU(57.6) PHE(17.6) TYR(14.0) ASP(10.8) SPIN_SYSTEM_ID 56 HETEROGENEITY 100 HN 8.6471 (A.3 B.1 B.2 B.3 B.4) N 128.2092 (A.3 B.1 B.2 B.3 B.4) CA:-1 55.3613 (B.1 B.2) CB:-1 44.0847 (B.2 B.3) CA 60.3954 (B.1) HA 3.262 CB 30.2147 (B.4) HB1|HB2 1.51 HB2|HB1 1.35 CG 35.548 HG1|HG2 1.75 HG1|HG2 0.83 C 177.9539 END_RES_DEF RES_ID 57 RES_TYPE ASP PREV_TYPE TRP(39.0) ARG(18.2) GLU(16.8) CYS(10.0) SPIN_SYSTEM_ID 57 HETEROGENEITY 100 HN 7.9587 (A.49 B.93 B.94 B.132 B.133) N 118.2519 (A.49 B.93 B.94 B.132 B.133) CA:-1 60.4170 (B.93) CB:-1 30.1870 (B.94) CA 58.0226 (B.132) HA 4.351 CB 40.7587 (B.133) HB1|HB2 2.643 HB2|HB1 2.7800 C 179.7577 END_RES_DEF RES_ID 58 RES_TYPE LEU PREV_TYPE ASP(22.0) LEU(20.6) ILE(10.9) SPIN_SYSTEM_ID 58 HETEROGENEITY 100 HN 8.9229 (A.32 B.54 B.55 B.92 B.93 B.94) N 119.3339 (A.32 B.54 B.55 B.92 B.93 B.94) CA:-1 58.0376 (B.55 B.93) CB:-1 40.7550 (B.54 B.94) CA 57.9800 HA 4.177 CB 42.7435 (B.92) HB1|HB2 1.985 HB2|HB1 1.643 CG 27.27 HG 1.882 CD1|CD2 22.76 HD1#|HD2# 0.933 CD2|CD1 25.711 HD2#|HD1# 1.027 C 180.8617 END_RES_DEF RES_ID 59 RES_TYPE PHE PREV_TYPE LEU(55.5) PHE(15.4) TYR(14.2) ILE(10.9) SPIN_SYSTEM_ID 59 HETEROGENEITY 100 HN 8.8933 (A.30 B.50 B.51 B.86 B.87) N 120.2547 (A.30 B.50 B.51 B.86 B.87) CA:-1 57.9561 (B.50) CB:-1 42.7486 (B.51) CA 62.7590 (B.86) HA 4.34 CB 39.9638 (B.87) HB1|HB2 3.31 HB2|HB1 3.455 CD1|CD2 131.56 HD1|HD2 7.302 C 176.8546 END_RES_DEF RES_ID 60 RES_TYPE ARG PREV_TYPE PHE(100.0) SPIN_SYSTEM_ID 60 HETEROGENEITY 100 HN 8.8142 N 119.0361 CA:-1 52.6022 CB:-1 39.9689 CA 61.0500 HA 3.835 CB 29.8500 HB1|HB2 2.04 HB2|HB1 1.50 CG 27.887 HG1|HG2 2.13 CE 43.58 HE1|HE2 3.20 C 179.0392 END_RES_DEF RES_ID 61 RES_TYPE GLU PREV_TYPE TRP(46.4) GLU(13.4) ARG(12.7) CYS(11.4) VAL(6.2) SPIN_SYSTEM_ID 61 HETEROGENEITY 100 HN 7.9351 (A.45 B.85 B.86) N 119.2810 (A.45 B.85 B.86) CA:-1 60.9607 (B.85) CB:-1 29.9113 (B.86) CA 59.5400 HA 3.985 CB 29.6800 HB1|HB2 2.138 CG 36.272 HG1|HG2 2.385 C 177.9138 END_RES_DEF RES_ID 62 RES_TYPE TRP PREV_TYPE GLU(24.5) ARG(23.7) TRP(21.6) CYS(15.3) GLN(7.1) SPIN_SYSTEM_ID 62 HETEROGENEITY 100 HN 8.1099 (A.24 B.39 B.40 B.70 B.71) N 120.8135 (A.24 B.39 B.40 B.70 B.71) CA:-1 59.5717 (B.39) CB:-1 29.6600 (B.40) CA 62.4303 (B.70) HA 4.194 CB 27.7114 (B.71) HB1|HB2 3.39 HB2|HB1 3.31 CD1 126.98 HD1 7.282 CZ2 115.17 HZ2 6.02 CH2 122.701 HH2 6.03 CZ3 121.51 HZ3 6.490 CE3 119.73 HE3 6.805 NE1 131.657 HE1 9.876 C 179.6055 END_RES_DEF RES_ID 63 RES_TYPE LEU PREV_TYPE CYS(61.4) TRP(38.6) SPIN_SYSTEM_ID 63 HETEROGENEITY 100 HN 8.5741 (A.16 B.23 B.24 B.42 B.43 B.44 B.45) N 122.8417 (A.16 B.23 B.24 B.42 B.43 B.44 B.45) CA:-1 62.4318 (B.23 B.44) CB:-1 27.6337 (B.24 B.45) CA 57.98 (B.42) HA 2.873 CB 42.2613 (B.43) HB1|HB2 1.26 HB2|HB1 1.19 CG 26.89 HG 1.10 CD1|CD2 25.57 HD1#|HD2# 0.572 CD2|CD1 26.17 HD2#|HD1# 0.64 C 179.740 END_RES_DEF RES_ID 64 RES_TYPE LYS PREV_TYPE LEU(50.8) PHE(15.3) TYR(14.4) ILE(11.9) ASP(7.5) SPIN_SYSTEM_ID 64 HETEROGENEITY 100 HN 7.9952 (A.23 B.37 B.38 B.66 B.67 B.68 B.69) N 120.9844 (A.23 B.37 B.38 B.66 B.67 B.68 B.69) CA:-1 57.9858 (B.37 B.68) CB:-1 42.2270 (B.38 B.69) CA 60.3564 (B.67) HA 3.942 CB 32.0787 (B.66) HB1|HB2 1.923 CG 24.297 HG1|HG2 1.47 HG2|HG1 1.29 CD 29.368 HD1|HD2 1.62 HD2|HD1 1.69 CE 42.373 HE1|HE2 2.93 C 179.4601 END_RES_DEF RES_ID 65 RES_TYPE ASP PREV_TYPE LYS(39.9) VAL(22.0) PRO(14.9) MET(11.3) TRP(8.7) SPIN_SYSTEM_ID 65 HETEROGENEITY 100 HN 8.2484 (A.40 B.69 B.70 B.110 B.111 B.112) N 119.6397 (A.40 B.69 B.70 B.110 B.111 B.112) CA:-1 60.3800 (B.69 B.110) CB:-1 32.0403 (B.70 B.111) CA 57.3790 (B.112) HA 4.248 CB 41.3730 HB1|HB2 2.649 HB2|HB1 2.515 C 177.9469 END_RES_DEF RES_ID 66 RES_TYPE THR PREV_TYPE LEU(26.5) PHE(23.4) TYR(22.5) ASP(22.5) ILE(5.1) SPIN_SYSTEM_ID 66 HETEROGENEITY 100 HN 7.8332 (A.69 B.124 B.125 B.174 B.175 B.176 B.177) N 112.9168 (A.69 B.124 B.125 B.174 B.175 B.176 B.177) CA:-1 57.3037 (B.124 B.176) CB:-1 41.3005 (B.125 B.177) CA 65.8117 (B.175) HA 3.723 CB 68.5253 (B.174) HB 2.83 CG2 21.169 HG2# 0.674 C 174.9030 END_RES_DEF RES_ID 67 RES_TYPE CYS PREV_TYPE THR(100.0) SPIN_SYSTEM_ID 67 HETEROGENEITY 100 HN 7.7801 (A.81 B.146 B.147 B.198 B.199) N 110.0805 (A.81 B.146 B.147 B.198 B.199) CA:-1 65.7008 (B.147) CB:-1 68.5666 (B.146) CA 56.4357 (B.199) HA 4.905 CB 31.4557 (B.198) HB1|HB2 3.060 HB2|HB1 2.339 C 173.2759 END_RES_DEF RES_ID 68 RES_TYPE GLY PREV_TYPE TRP(17.7) ARG(16.6) GLU(13.0) LYS(12.2) HIS(12.2) \ MET(11.7) CYS(11.3) GLN(5.3) SPIN_SYSTEM_ID 68 HETEROGENEITY 100 HN 7.8541 (A.82 B.148 B.149 B.200) N 110.2433 (A.82 B.148 B.149 B.200) CA:-1 56.4128 (B.148) CB:-1 31.4641 (B.149) CA 46.5402 (B.200) HA1|HA2 3.897 HA2|HA1 3.980 C 174.5191 END_RES_DEF RES_ID 69 RES_TYPE ALA PREV_TYPE GLY(100.0) SPIN_SYSTEM_ID 69 HETEROGENEITY 100 HN 6.5942 (A.11 B.15 B.24 B.25 B.26) N 121.4111 (A.11 B.15 B.24 B.25 B.26) CA:-1 46.5376 (B.15 B.25) CA 52.7033 (B.26) HA 4.143 CB 20.7181 (B.24) HB# 1.033 C 176.7892 END_RES_DEF RES_ID 70 RES_TYPE ASN PREV_TYPE ALA(100.0) SPIN_SYSTEM_ID 70 HETEROGENEITY 100 HN 8.9360 (A.31 B.52 B.53 B.88 B.89 B.90 B.91) N 120.4948 (A.31 B.52 B.53 B.88 B.89 B.90 B.91) CA:-1 52.5954 (B.52 B.89) CB:-1 20.7130 (B.53 B.91) CA 51.2044 (B.88) HA 4.73 CB 38.7664 (B.90) HB1|HB2 2.92 HB2|HB1 3.45 ND2 110.49 HD21|HD22 7.395 HD22|HD21 6.967 C 175.4043 END_RES_DEF RES_ID 71 RES_TYPE ALA PREV_TYPE ASN(93.1) ASP(6.9) SPIN_SYSTEM_ID 71 HETEROGENEITY 100 CA:-1 51.2482 (B.166) CB:-1 38.7994 (B.167) HN 8.3391 (B.166 B.167 B.217 B.218) N 119.9072 (B.166 B.167 B.217 B.218) CA 56.0873 (B.218) HA 3.974 CB 18.8866 (B.217) HB# 1.440 C 179.8670 END_RES_DEF RES_ID 72 RES_TYPE LYS PREV_TYPE ALA(100.0) SPIN_SYSTEM_ID 72 HETEROGENEITY 100 HN 7.9047 (A.44 B.83 B.84 B.120 B.121 B.122 B.123) N 119.9681 (A.44 B.83 B.84 B.120 B.121 B.122 B.123) CA:-1 55.9747 (B.83 B.123) CB:-1 18.8619 (B.84 B.121) CA 59.7918 (B.122) HA 4.020 CB 32.6653 (B.120) HB1|HB2 1.90 CG 25.271 HG1|HG2 1.49 CD 29.122 HD1|HD2 1.69 HD2|HD1 1.79 CE 42.749 HE1|HE2 3.07 C 178.3717 END_RES_DEF RES_ID 73 RES_TYPE GLN PREV_TYPE LYS(47.1) MET(21.3) VAL(17.0) PRO(8.6) TRP(5.9) SPIN_SYSTEM_ID 73 HETEROGENEITY 100 HN 8.5667 (A.35 B.59 B.60) N 118.6372 (A.35 B.59 B.60) CA:-1 59.6898 (B.59) CB:-1 32.6281 (B.60) CA 59.2210 HA 4.084 CB 28.3510 HB1|HB2 2.10 HB2|HB1 1.95 CG 34.287 HG1|HG2 2.75 HG2|HG1 2.634 NE2 111.413 HE21|HE22 6.668 HE22|HE21 7.500 C 179.4766 END_RES_DEF RES_ID 74 RES_TYPE SER PREV_TYPE GLN(29.5) CYS(27.8) GLU(20.5) ARG(9.7) TRP(8.7) SPIN_SYSTEM_ID 74 HETEROGENEITY 100 HN 8.6995 (A.71 B.128 B.129) N 112.2862 (A.71 B.128 B.129) CA:-1 59.0814 (B.128) CB:-1 28.3607 (B.129) CA 61.8400 HA 4.097 CB 62.7400 HB1|HB2 3.952 HB2|HB1 3.786 C 176.4406 END_RES_DEF RES_ID 75 RES_TYPE ARG PREV_TYPE SER(100.0) SPIN_SYSTEM_ID 75 HETEROGENEITY 100 HN 8.1142 (A.6 B.6 B.7 B.14) N 125.2927 (A.6 B.6 B.7 B.14) CA:-1 61.9422 (B.6) CB:-1 62.6199 (B.7) CA 60.3550 HA 4.114 CB 30.1760 (B.14) HB1|HB2 2.16 HB2|HB1 2.08 CG 27.573 HG1|HG2 1.78 HG2|HG1 1.87 CD 43.779 HD1|HD2 3.260 C 179.5064 END_RES_DEF RES_ID 76 RES_TYPE ASP PREV_TYPE CYS(10.9) SPIN_SYSTEM_ID 76 HETEROGENEITY 100 HN 8.6575 (A.17 B.25 B.26 B.46 B.47 B.48 B.49) N 122.3688 (A.17 B.25 B.26 B.46 B.47 B.48 B.49) CA:-1 60.2568 (B.25 B.48) CB:-1 30.1076 (B.26 B.49) CA 57.4394 (B.47) HA 4.429 CB 39.4886 (B.46) HB1|HB2 2.774 HB2|HB1 2.296 C 178.8485 END_RES_DEF RES_ID 77 RES_TYPE CYS PREV_TYPE PHE(35.7) TYR(34.7) ASP(22.1) SPIN_SYSTEM_ID 77 HETEROGENEITY 100 HN 8.2428 (A.13 B.18 B.19 B.30 B.31 B.32 B.33) N 123.2362 (A.13 B.18 B.19 B.30 B.31 B.32 B.33) CA:-1 57.3016 (B.18 B.33) CB:-1 39.4831 (B.19 B.32) CA 63.1891 (B.30) HA 4.383 CB 27.4539 (B.31) HB1|HB2 2.885 HB2|HB1 3.22 C 176.597 END_RES_DEF RES_ID 78 RES_TYPE PHE SPIN_SYSTEM_ID 78 HETEROGENEITY 100 HN 8.8142 (A.33 B.56 B.57) N 119.0361 (A.33 B.56 B.57) CA:-1 63.0032 (B.56) CB:-1 27.4499 (B.57) CA 62.3500 HA 3.701 CB 39.7400 HB1|HB2 3.45 HB2|HB1 3.37 CD1|CD2 131.95 HD1|HD2 7.237 C 176.5131 END_RES_DEF RES_ID 79 RES_TYPE GLY PREV_TYPE ILE(44.5) PHE(28.8) TYR(26.7) SPIN_SYSTEM_ID 79 HETEROGENEITY 100 HN 8.7579 (A.72 B.130 B.131 B.183 B.184 B.185) N 104.5800 (A.72 B.130 B.131 B.183 B.184 B.185) CA:-1 62.3489 (B.130 B.185) CB:-1 39.6793 (B.131 B.184) CA 47.5285 (B.183) HA1|HA2 3.575 HA2|HA1 4.112 C 175.8882 END_RES_DEF RES_ID 80 RES_TYPE CYS PREV_TYPE GLY(100.0) SPIN_SYSTEM_ID 80 HETEROGENEITY 100 HN 7.5599 (A.29 B.49 B.83 B.84 B.85) N 119.7295 (A.29 B.49 B.83 B.84 B.85) CA:-1 47.5613 (B.49 B.84) CA 61.7238 (B.83) HA 4.140 CB 27.3614 (B.85) HB1|HB2 2.914 HB2|HB1 3.026 C 175.521 END_RES_DEF RES_ID 81 RES_TYPE LEU PREV_TYPE CYS(50.0) GLN(24.4) TRP(13.9) GLU(11.8) SPIN_SYSTEM_ID 81 HETEROGENEITY 100 HN 7.4249 (A.28 B.47 B.48 B.79 B.80 B.81 B.82) N 120.5205 (A.28 B.47 B.48 B.79 B.80 B.81 B.82) CA:-1 61.7340 (B.47 B.80) CB:-1 27.3500 (B.48 B.82) CA 57.8405 (B.79) HA 3.855 CB 40.7362 (B.81) HB1|HB2 0.76 HB2|HB1 -0.15 CG 26.28 HG 1.417 CD1|CD2 23.248 HD1#|HD2# 0.448 CD2|CD1 28.091 HD2#|HD1# 0.325 C 178.7006 END_RES_DEF RES_ID 82 RES_TYPE ARG PREV_TYPE PHE(24.9) ASP(23.9) TYR(23.5) LEU(18.9) ILE(8.9) SPIN_SYSTEM_ID 82 HETEROGENEITY 100 HN 8.5543 (A.20 B.31 B.32 B.56 B.57 B.58 B.59) N 120.5055 (A.20 B.31 B.32 B.56 B.57 B.58 B.59) CA:-1 57.8876 (B.31 B.58) CB:-1 40.7180 (B.32 B.59) CA 59.9303 (B.56) HA 3.761 CB 29.7653 (B.57) HB1|HB2 1.235 HB2|HB1 1.66 CG 26.765 HG1|HG2 1.64 CD 43.833 HD1|HD2 3.21 HD2|HD1 3.31 C 178.768 END_RES_DEF RES_ID 83 RES_TYPE GLU PREV_TYPE TRP(26.2) GLU(23.0) ARG(20.8) CYS(16.0) GLN(5.9) SPIN_SYSTEM_ID 83 HETEROGENEITY 100 HN 7.9184 (A.50 B.95 B.96 B.134 B.135) N 117.7332 (A.50 B.95 B.96 B.134 B.135) CA:-1 59.9921 (B.95 B.135) CB:-1 29.6544 (B.96 B.134) CA 60.1000 HA 4.098 CB 29.7500 HB1|HB2 2.152 HB2|HB1 2.23 CG 37.418 HG1|HG2 2.355 HG2|HG1 2.62 C 179.3490 END_RES_DEF RES_ID 84 RES_TYPE TRP PREV_TYPE TRP(30.6) GLU(21.0) ARG(20.6) CYS(13.8) SPIN_SYSTEM_ID 84 HETEROGENEITY 100 HN 8.3530 (A.18 B.27 B.28) N 121.3145 (A.18 B.27 B.28) CA:-1 60.1338 (B.27) CB:-1 29.8522 (B.28) CA 64.1000 HA 4.116 CB 30.2100 HB1|HB2 3.495 HB2|HB1 3.72 CD1 128.66 HD1 7.528 CZ2 114.28 HZ2 7.387 CH2 125.15 HH2 7.237 CZ3 121.660 HZ3 7.059 CE3 121.656 HE3 7.769 NE1 129.30 HE1 9.339 C 178.7989 END_RES_DEF RES_ID 85 RES_TYPE CYS PREV_TYPE PRO(60.9) VAL(39.1) SPIN_SYSTEM_ID 85 HETEROGENEITY 100 HN 8.6915 (A.60 B.112 B.113) N 115.8503 (A.60 B.112 B.113) CA:-1 64.0987 (B.112) CB:-1 30.2112 (B.113) CA 64.5400 HA 4.23 CB 26.8800 HB1|HB2 2.87 HB2|HB1 3.37 C 177.4679 END_RES_DEF RES_ID 86 RES_TYPE ASP SPIN_SYSTEM_ID 86 HETEROGENEITY 100 CA:-1 64.6626 (B.78 B.187) CB:-1 26.9169 (B.77 B.188) HN 8.1686 (B.77 B.78 B.187 B.188 B.202 B.203) N 119.1031 (B.77 B.78 B.187 B.188 B.202 B.203) CA 57.3102 (B.202) HA 4.235 CB 40.5306 (B.203) HB1|HB2 2.61 HB2|HB1 2.70 C 177.1675 END_RES_DEF RES_ID 87 RES_TYPE ALA PREV_TYPE ASP(30.0) PHE(27.8) TYR(26.5) LEU(11.7) SPIN_SYSTEM_ID 87 HETEROGENEITY 100 HN 7.1929 (A.51 B.97 B.98 B.136 B.137 B.138 B.139) N 119.7539 (A.51 B.97 B.98 B.136 B.137 B.138 B.139) CA:-1 57.3075 (B.97 B.137) CB:-1 40.4899 (B.98 B.139) CA 54.0898 (B.136) HA 3.953 CB 19.6459 (B.138) HB# 0.651 C 179.4758 END_RES_DEF RES_ID 88 RES_TYPE PHE PREV_TYPE ALA(100.0) SPIN_SYSTEM_ID 88 HETEROGENEITY 100 HN 7.5996 (A.67 B.121 B.122 B.168 B.169 B.170) N 114.4095 (A.67 B.121 B.122 B.168 B.169 B.170) CA:-1 54.0909 (B.121) CB:-1 19.6026 (B.122 B.170) CA 59.6346 (B.168) HA 4.456 CB 42.0467 (B.169) HB1|HB2 2.60 HB2|HB1 0.74 CD1|CD2 132.36 HD1|HD2 6.336 CE1|CE2 130.672 HE1|HE2 6.989 CZ 127.76 HZ 6.699 C 175.0814 END_RES_DEF RES_ID 89 RES_TYPE LEU PREV_TYPE PHE(10.1) SPIN_SYSTEM_ID 89 HETEROGENEITY 100 HN 8.0368 (A.7 B.8 B.9 B.15 B.16 B.17 B.18) N 124.1079 (A.7 B.8 B.9 B.15 B.16 B.17 B.18) CA:-1 59.5628 (B.8 B.15) CB:-1 42.0257 (B.9 B.18) CA 58.3964 (B.16) HA 4.56 CB 44.9108 (B.17) HB1|HB2 2.05 HB2|HB1 1.512 CG 28.20 HG 1.79 CD1|CD2 27.45 HD1#|HD2# 0.851 CD2|CD1 25.21 HD2#|HD1# 1.12 END_RES_DEF ## the minore form RES_ID 305 RES_TYPE GLN PREV_TYPE SER SPIN_SYSTEM_ID 305 HETEROGENEITY 100 HN 8.3098 N 122.0089 CA:-1 58.6310 CB:-1 64.1674 CA 56.2333 CB 30.0831 C 177.6013 END_RES_DEF RES_ID 308 RES_TYPE ARG PREV_TYPE LYS SPIN_SYSTEM_ID 308 HETEROGENEITY 100 CA 56.2984 CB 31.0780 C 178.5988 END_RES_DEF RES_ID 309 RES_TYPE ASP PREV_TYPE TRP SPIN_SYSTEM_ID 309 HETEROGENEITY 100 HN 8.3503 N 120.7936 CA:-1 56.1133 CB:-1 30.0230 CA 54.4844 CB 41.6141 C 177.6013 END_RES_DEF RES_ID 310 RES_TYPE PHE PREV_TYPE ASP SPIN_SYSTEM_ID 310 HETEROGENEITY 100 HN 8.0301 N 119.8968 CA:-1 54.4840 CB:-1 41.6140 CA 57.9150 CB 39.9100 C 177.853 END_RES_DEF RES_ID 311 RES_TYPE VAL PREV_TYPE PHE SPIN_SYSTEM_ID 311 HETEROGENEITY 100 HN 7.9040 N 122.1780 CA:-1 57.9150 CB:-1 39.9100 CA 62.2281 CB 33.0763 C 175.3066 END_RES_DEF RES_ID 312 RES_TYPE ALA PREV_TYPE VAL SPIN_SYSTEM_ID 312 HETEROGENEITY 100 HN 8.11800 N 127.1200 CA:-1 62.2281 CB:-1 33.0763 CA 52.3850 CB 19.7340 C 177.2970 END_RES_DEF RES_ID 313 RES_TYPE GLU PREV_TYPE ALA(100.0) SPIN_SYSTEM_ID 313 HETEROGENEITY 100 HN 8.1600 N 120.9900 CA:-1 52.3850 CB:-1 19.7340 CA 54.4040 CB 30.1870 END_RES_DEF RES_ID 314 RES_TYPE PRO SPIN_SYSTEM_ID 314 HETEROGENEITY 100 CA 63.5200 CB 32.1900 C 176.2470 END_RES_DEF RES_ID 315 RES_TYPE MET PREV_TYPE PRO(49.6) SPIN_SYSTEM_ID 315 HETEROGENEITY 100 HN 8.4110 N 120.140 CA:-1 63.5200 CB:-1 32.1900 CA 55.8800 CB 33.0800 C 176.817 END_RES_DEF RES_ID 316 RES_TYPE GLY PREV_TYPE MET SPIN_SYSTEM_ID 316 HETEROGENEITY 100 HN 8.26000 N 109.4500 CA:-1 55.8800 CB:-1 33.0800 CA 45.5580 C 176.5484 END_RES_DEF RES_ID 317 RES_TYPE GLU PREV_TYPE GLY(100.0) SPIN_SYSTEM_ID 317 HETEROGENEITY 100 HN 8.6448 N 126.7684 CA:-1 45.5580 C 176.204 END_RES_DEF RES_ID * RES_TYPE UNK PREV_TYPE UNK(100.0) SPIN_SYSTEM_ID 318 HETEROGENEITY 100 HN 8.1725 N 121.4741 CA:-1 56.3040 CB:-1 29.6631 CA 56.709 CB 33.145 C 176.204 END_RES_DEF RES_ID * RES_TYPE UNK PREV_TYPE UNK(100.0) SPIN_SYSTEM_ID 319 HETEROGENEITY 100 HN 8.3597 N 121.1941 CA:-1 53.2425 CB:-1 31.1571 CA 56.146 CB 33.459 END_RES_DEF RES_ID * RES_TYPE UNK PREV_TYPE UNK(100.0) SPIN_SYSTEM_ID 320 HETEROGENEITY 100 HN 7.8157 N 114.0740 CA:-1 53.2425 CB:-1 31.1571 CA 56.146 CB 33.459 END_RES_DEF
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