A0A667WNH6_9TELE Loading...

Ribosomal protein S10

AlphaFold DB , UniProt , Accession A0A667WNH6, Species 9TELE (Myripristis murdjan, pinecone soldierfish), Gene RPS10, Length 166 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M88.3Confident93.4Very high119 Ų11979.1 Ų79.159%0.58638%0.382SS*.  0132.10-177.9174.180.400108.4M3 L43 H44 K47M1-M3 HydrophobicContact CE-CE 4.46Å; M1-M3 HydrophobicContact CE-CG 3.35Å; M1-M3 HydrophobicContact CE-SD 3.45Å; M1-M3 WeakPolarHBondContact CE-SD 3.36Å; M1-M3 HydrophobicContact CG-CG 4.42Å; M1-M3 PolarHBondContact O-N 3.2Å; M1-L43 HydrophobicContact CE-CG 4.36Å; M1-L43 HydrophobicContact SD-CD2 4.25Å; M1-L43 HydrophobicContact SD-CG 4.09Å; M1-H44 HydrophobicContact CE-CB 4.44Å; M1-H44 VanDerWaalsContact CE-CD2 3.45Å; M1-H44 WeakPolarHBondContact CE-CD2 3.3Å; M1-K47 HydrophobicContact CB-CB 4.22Å; M1-K47 HydrophobicContact CE-CB 3.48Å; M1-K47 VanDerWaalsContact CE-CB 3.48Å; M1-K47 HydrophobicContact CE-CG 3.82Å; M1-K47 HydrophobicContact SD-CB 3.85Å; M1-K47 HydrophobicContact SD-CG 3.62Å
2L91.9Very high93.6Very high173 Ų17373.4 Ų73.491%0.90635%0.353SS*.  trans-68.9127173.7-17663.5000109.1
3M92.8Very high93.6Very high26 Ų2674.2 Ų74.213%0.12836%0.356CS..  trans-136.8143.5179.4-71.9-173.7-75.200110.3M1 K5 H44 A48M1-M3 HydrophobicContact CE-CE 4.46Å; M1-M3 HydrophobicContact CE-CG 3.35Å; M1-M3 HydrophobicContact CE-SD 3.45Å; M1-M3 WeakPolarHBondContact CE-SD 3.36Å; M1-M3 HydrophobicContact CG-CG 4.42Å; M1-M3 PolarHBondContact O-N 3.2Å; M3-K5 PolarHBondContact O-N 3.21Å; M3-H44 HydrophobicContact CG-CB 4.47Å; M3-H44 HydrophobicContact SD-CB 3.7Å; M3-A48 HydrophobicContact CE-CB 3.8Å; M3-A48 HydrophobicContact SD-CB 4.34Å
4P95.4Very high93.6Very high68 Ų6870.7 Ų70.744%0.44234%0.34SS..  trans-56135.4171.6-24.334000111.3K6 N7 R8P4-K6 PolarHBondContact O-N 2.96Å; P4-N7 HydrophobicContact CB-CB 4.44Å; P4-N7 PolarHBondContact O-N 3.36Å; P4-R8 PolarHBondContact O-N 2.91Å; P4-R8 VanDerWaalsContact O-N 3.17Å
5K93.4Very high93.7Very high141 Ų14166 Ų6661%0.61332%0.318SS*.Hα-helixtrans-56.4-38.7-178.6-168.8178.9-179.6-1780111.7M3 N7 R8 I9M3-K5 PolarHBondContact O-N 3.21Å; K5-N7 VanDerWaalsContact C-N 3.35Å; K5-N7 PolarHBondContact O-N 2.82Å; K5-R8 PolarHBondContact O-N 2.83Å; K5-I9 HydrophobicContact CD-CD1 4.39Å; K5-I9 HydrophobicContact CG-CD1 3.84Å; K5-I9 HydrophobicContact CG-CG1 4.37Å; K5-I9 VanDerWaalsContact O-CG1 3.32Å; K5-I9 WeakPolarHBondContact O-CG1 3.29Å; K5-I9 PolarHBondContact O-N 3.03Å
6K93.7Very high93.7Very high181 Ų18162.4 Ų62.479%0.78730%0.3SS*.Hα-helixtrans-55.9-45.9176.2-62.2-176.4179.9-1780112.3P4 A10P4-K6 PolarHBondContact O-N 2.96Å; K6-A10 WeakPolarHBondContact O-CB 3.25Å; K6-A10 PolarHBondContact O-N 3.23Å
7N94Very high93.7Very high27 Ų2766.9 Ų66.914%0.14432%0.318CS..Hα-helixtrans-69.5-40.8-179.1-67.1-3.5000111.7P4 K5 A10 I11 V40 H44P4-N7 HydrophobicContact CB-CB 4.44Å; P4-N7 PolarHBondContact O-N 3.36Å; K5-N7 VanDerWaalsContact C-N 3.35Å; K5-N7 PolarHBondContact O-N 2.82Å; N7-A10 WeakPolarHBondContact O-CB 3.45Å; N7-A10 PolarHBondContact O-N 3.18Å; N7-I11 WeakPolarHBondContact O-CD1 3.44Å; N7-I11 WeakPolarHBondContact O-CG1 3.32Å; N7-I11 PolarHBondContact O-N 3.39Å; N7-V40 HydrophobicContact CB-CG1 4.38Å; N7-V40 HydrophobicContact CB-CG2 4.31Å; N7-H44 PolarHBondContact ND2-ND1 2.63Å
8R93.9Very high93.7Very high84 Ų8467.8 Ų67.832%0.31732%0.322SS..Hα-helixtrans-63.5-45.2177.3178.7172.848.7-168.1-6.3111.8P4 K5 I11 Y12P4-R8 PolarHBondContact O-N 2.91Å; P4-R8 VanDerWaalsContact O-N 3.17Å; K5-R8 PolarHBondContact O-N 2.83Å; R8-I11 PolarHBondContact O-N 3.37Å; R8-Y12 HydrophobicContact CG-CD2 4.31Å; R8-Y12 HydrophobicContact CG-CE1 4.13Å; R8-Y12 HydrophobicContact CG-CE2 3.82Å; R8-Y12 WeakPolarHBondContact O-CD1 3.3Å; R8-Y12 PolarHBondContact O-N 2.89Å; R8-Y12 VanDerWaalsContact O-N 3.11Å
9I94.7Very high93.7Very high47 Ų4764.4 Ų64.424%0.24131%0.306CS..Hα-helixtrans-60.5-47175.8-68.1168.6000110K5 I11 Y12 E13 F82 L83K5-I9 HydrophobicContact CD-CD1 4.39Å; K5-I9 HydrophobicContact CG-CD1 3.84Å; K5-I9 HydrophobicContact CG-CG1 4.37Å; K5-I9 VanDerWaalsContact O-CG1 3.32Å; K5-I9 WeakPolarHBondContact O-CG1 3.29Å; K5-I9 PolarHBondContact O-N 3.03Å; I9-I11 VanDerWaalsContact C-N 3.31Å; I9-I11 PolarHBondContact O-N 3.27Å; I9-Y12 PolarHBondContact O-N 3.15Å; I9-Y12 VanDerWaalsContact O-N 3.08Å; I9-E13 HydrophobicContact CG2-CG 4.08Å; I9-E13 VanDerWaalsContact CG2-OE1 3.28Å; I9-E13 WeakPolarHBondContact CG2-OE1 3.41Å; I9-E13 WeakPolarHBondContact O-CG 3.17Å; I9-E13 PolarHBondContact O-N 3.31Å; I9-F82 HydrophobicContact CG1-CE1 4.25Å; I9-L83 HydrophobicContact CG2-CD2 4.11Å
10A94.3Very high93.7Very high4 Ų463.3 Ų63.33%0.03330%0.304CS..Hα-helixtrans-56.4-41.4178.400000113.9K6 N7 L14 K38 V40K6-A10 WeakPolarHBondContact O-CB 3.25Å; K6-A10 PolarHBondContact O-N 3.23Å; N7-A10 WeakPolarHBondContact O-CB 3.45Å; N7-A10 PolarHBondContact O-N 3.18Å; A10-L14 PolarHBondContact O-N 3.18Å; A10-K38 HydrophobicContact CB-CB 4.44Å; A10-K38 HydrophobicContact CB-CD 3.43Å; A10-K38 VanDerWaalsContact CB-CD 3.43Å; A10-V40 HydrophobicContact CB-CG2 4.21Å
11I94.9Very high93.8Very high0 Ų060.3 Ų60.30%029%0.29CS..Hα-helixtrans-65.4-44176.9-65.8162000110.3N7 R8 I9 L14 L15 M21 L35 V40 H44 V45 A48 M49N7-I11 WeakPolarHBondContact O-CD1 3.44Å; N7-I11 WeakPolarHBondContact O-CG1 3.32Å; N7-I11 PolarHBondContact O-N 3.39Å; R8-I11 PolarHBondContact O-N 3.37Å; I9-I11 VanDerWaalsContact C-N 3.31Å; I9-I11 PolarHBondContact O-N 3.27Å; I11-L14 PolarHBondContact O-N 3.08Å; I11-L15 WeakPolarHBondContact O-CB 3.27Å; I11-L15 PolarHBondContact O-N 3.22Å; I11-M21 HydrophobicContact CG2-CE 4.14Å; I11-M21 HydrophobicContact CG2-SD 4.25Å; I11-M21 WeakPolarHBondContact O-CE 3.28Å; I11-L35 HydrophobicContact CG1-CD1 3.82Å; I11-V40 HydrophobicContact CD1-CG1 3.93Å; I11-V40 HydrophobicContact CG1-CG1 4.01Å; I11-H44 HydrophobicContact CD1-CB 4.13Å; I11-V45 HydrophobicContact CD1-CG2 4.16Å; I11-V45 HydrophobicContact CG1-CG2 4.09Å; I11-A48 HydrophobicContact CD1-CB 4.05Å; I11-A48 HydrophobicContact CG2-CB 4.24Å; I11-M49 HydrophobicContact CG2-CE 3.46Å; I11-M49 VanDerWaalsContact CG2-CE 3.46Å
12Y95.4Very high94.1Very high11 Ų1156.7 Ų56.74%0.04327%0.274CS..Hα-helixtrans-69.3-39.3-178.2-70.42.7000112.3R8 I9 L15 F16 A48 L52 Y78 L79 F82R8-Y12 HydrophobicContact CG-CD2 4.31Å; R8-Y12 HydrophobicContact CG-CE1 4.13Å; R8-Y12 HydrophobicContact CG-CE2 3.82Å; R8-Y12 WeakPolarHBondContact O-CD1 3.3Å; R8-Y12 PolarHBondContact O-N 2.89Å; R8-Y12 VanDerWaalsContact O-N 3.11Å; I9-Y12 PolarHBondContact O-N 3.15Å; I9-Y12 VanDerWaalsContact O-N 3.08Å; Y12-L15 PolarHBondContact O-N 3.28Å; Y12-F16 WeakPolarHBondContact O-CB 3.44Å; Y12-F16 PolarHBondContact O-N 3.36Å; Y12-A48 HydrophobicContact CE1-CB 4.49Å; Y12-L52 HydrophobicContact CD1-CD1 4.17Å; Y12-L52 HydrophobicContact CE1-CD1 3.74Å; Y12-L52 HydrophobicContact CE1-CD2 4.27Å; Y12-L52 HydrophobicContact CE1-CG 4.19Å; Y12-Y78 HydrophobicContact CE2-CE1 4.47Å; Y12-L79 HydrophobicContact CD1-CD2 4.22Å; Y12-L79 HydrophobicContact CD2-CD2 3.76Å; Y12-L79 HydrophobicContact CE2-CD2 4.31Å; Y12-L79 HydrophobicContact CG-CD2 3.71Å; Y12-F82 AromaticContact CD2-CD1 3.53Å; Y12-F82 HydrophobicContact CD2-CD1 3.53Å; Y12-F82 AromaticContact CD2-CE1 3.48Å; Y12-F82 HydrophobicContact CD2-CE1 3.48Å; Y12-F82 VanDerWaalsContact CD2-CE1 3.48Å; Y12-F82 HydrophobicContact CD2-CG 4.26Å; Y12-F82 HydrophobicContact CD2-CZ 4.19Å; Y12-F82 AromaticContact CE2-CD1 3.95Å; Y12-F82 HydrophobicContact CE2-CD1 3.95Å; Y12-F82 AromaticContact CE2-CE1 3.74Å; Y12-F82 HydrophobicContact CE2-CE1 3.74Å; Y12-F82 HydrophobicContact CE2-CE2 4.38Å; Y12-F82 HydrophobicContact CE2-CG 4.36Å; Y12-F82 AromaticContact CE2-CZ 3.97Å; Y12-F82 HydrophobicContact CE2-CZ 3.97Å
13E93.9Very high94.3Very high84 Ų8448.5 Ų48.539%0.39323%0.231SC..Hα-helixtrans-58.8-47.8173.4-74.1171.5173.500111.6I9 F16 K17 K38 L83I9-E13 HydrophobicContact CG2-CG 4.08Å; I9-E13 VanDerWaalsContact CG2-OE1 3.28Å; I9-E13 WeakPolarHBondContact CG2-OE1 3.41Å; I9-E13 WeakPolarHBondContact O-CG 3.17Å; I9-E13 PolarHBondContact O-N 3.31Å; E13-F16 PolarHBondContact O-N 3.36Å; E13-K17 VanDerWaalsContact O-CB 3.28Å; E13-K17 WeakPolarHBondContact O-CB 3.28Å; E13-K17 PolarHBondContact O-N 3.44Å; E13-K38 IonicContact OE2-NZ 2.7Å; E13-K38 PolarHBondContact OE2-NZ 3.47Å; E13-L83 HydrophobicContact CG-CD2 4.05Å
14L93.8Very high94.4Very high25 Ų2551.6 Ų51.613%0.13124%0.244CC..Hα-helixtrans-63.9-46.1178.7179.764.8000111A10 I11 F16 K17 E18 M21 E34 L35A10-L14 PolarHBondContact O-N 3.18Å; I11-L14 PolarHBondContact O-N 3.08Å; L14-F16 VanDerWaalsContact C-N 3.31Å; L14-F16 PolarHBondContact O-N 2.9Å; L14-K17 PolarHBondContact O-N 3.21Å; L14-E18 HydrophobicContact CD1-CG 4.14Å; L14-E18 PolarHBondContact O-N 3.49Å; L14-E18 VanDerWaalsContact O-N 3.08Å; L14-M21 HydrophobicContact CB-CE 3.98Å; L14-M21 HydrophobicContact CD2-CE 3.81Å; L14-M21 HydrophobicContact CG-CE 3.89Å; L14-E34 HydrophobicContact CD2-CB 3.81Å; L14-L35 HydrophobicContact CB-CD2 4.03Å; L14-L35 HydrophobicContact CD2-CD1 4.14Å; L14-L35 HydrophobicContact CD2-CD2 3.58Å; L14-L35 HydrophobicContact CD2-CG 3.58Å; L14-L35 HydrophobicContact CG-CD2 4.38Å
15L94.6Very high94.5Very high0 Ų053.6 Ų53.60%025%0.246CC..Hα-helixtrans-59.2-42.3177.6-17962.5000111.8I11 Y12 G19 M21 M49 L52 V58 L71 L79I11-L15 WeakPolarHBondContact O-CB 3.27Å; I11-L15 PolarHBondContact O-N 3.22Å; Y12-L15 PolarHBondContact O-N 3.28Å; L15-G19 WeakPolarHBondContact O-CA 3.24Å; L15-G19 PolarHBondContact O-N 2.97Å; L15-M21 HydrophobicContact CB-CE 3.86Å; L15-M21 HydrophobicContact CD1-CB 3.99Å; L15-M49 HydrophobicContact CB-CE 3.97Å; L15-M49 HydrophobicContact CD1-CE 4.08Å; L15-M49 HydrophobicContact CD2-CE 3.63Å; L15-M49 HydrophobicContact CD2-SD 3.87Å; L15-M49 HydrophobicContact CG-CE 4.1Å; L15-L52 HydrophobicContact CD2-CD1 3.72Å; L15-V58 HydrophobicContact CD2-CG2 3.97Å; L15-L71 HydrophobicContact CD2-CD1 4.03Å; L15-L71 HydrophobicContact CG-CD1 4.25Å; L15-L79 HydrophobicContact CB-CD1 4.49Å; L15-L79 HydrophobicContact CD2-CD1 3.83Å; L15-L79 HydrophobicContact CG-CD1 4.12Å
16F95Very high94.5Very high8 Ų848.9 Ų48.94%0.03523%0.227CC..Hα-helixtrans-72.7-36.8-179.9-170.5-98.2000112.2Y12 E13 L14 L71 I76 L79 R80 L83 L85 I89 P91Y12-F16 WeakPolarHBondContact O-CB 3.44Å; Y12-F16 PolarHBondContact O-N 3.36Å; E13-F16 PolarHBondContact O-N 3.36Å; L14-F16 VanDerWaalsContact C-N 3.31Å; L14-F16 PolarHBondContact O-N 2.9Å; F16-L71 HydrophobicContact CD2-CD2 4.39Å; F16-I76 HydrophobicContact CE2-CG2 3.92Å; F16-L79 HydrophobicContact CB-CD1 4.28Å; F16-L79 HydrophobicContact CD2-CB 3.83Å; F16-L79 HydrophobicContact CD2-CD1 4.36Å; F16-L79 HydrophobicContact CE2-CB 4.5Å; F16-R80 HydrophobicContact CE2-CB 4.43Å; F16-L83 HydrophobicContact CB-CD1 4.21Å; F16-L85 HydrophobicContact CD1-CD1 3.6Å; F16-L85 HydrophobicContact CE1-CD1 3.59Å; F16-L85 HydrophobicContact CG-CD1 4.28Å; F16-L85 HydrophobicContact CZ-CD1 4.26Å; F16-I89 HydrophobicContact CE1-CB 4.26Å; F16-I89 HydrophobicContact CE1-CG2 3.78Å; F16-I89 WeakPolarHBondContact CZ-O 3.46Å; F16-P91 HydrophobicContact CD2-CG 4.29Å; F16-P91 HydrophobicContact CE2-CG 4.23Å; F16-P91 VanDerWaalsContact O-CA 3.25Å; F16-P91 WeakPolarHBondContact O-CA 3.45Å; F16-P91 VanDerWaalsContact O-CB 3.24Å; F16-P91 WeakPolarHBondContact O-CB 3.46Å; F16-P91 WeakPolarHBondContact O-CG 3.45Å
17K93.2Very high94.4Very high140 Ų14043.6 Ų43.661%0.60921%0.21SC*.Hα-helixtrans-62.1-52.8177.9-178.1-177.7174.1-172.50111.3E13 L14 A92E13-K17 VanDerWaalsContact O-CB 3.28Å; E13-K17 WeakPolarHBondContact O-CB 3.28Å; E13-K17 PolarHBondContact O-N 3.44Å; L14-K17 PolarHBondContact O-N 3.21Å; K17-A92 VanDerWaalsContact O-CB 3.3Å; K17-A92 WeakPolarHBondContact O-CB 3.33Å; K17-A92 PolarHBondContact O-N 3.19Å
18E92.9Very high94.3Very high83 Ų8350.2 Ų50.239%0.38824%0.24SC..Hα-helixtrans-86-34.9-175.6-60-56145.800112.2L14 V20 T93L14-E18 HydrophobicContact CD1-CG 4.14Å; L14-E18 PolarHBondContact O-N 3.49Å; L14-E18 VanDerWaalsContact O-N 3.08Å; E18-V20 PolarHBondContact O-N 3.25Å; E18-T93 WeakPolarHBondContact O-CG2 3.45Å
19G93.9Very high94.1Very high2 Ų249.3 Ų49.32%0.02124%0.241CC..SBendtrans82.7-5.3-173.300000114.2L15 L71L15-G19 WeakPolarHBondContact O-CA 3.24Å; L15-G19 PolarHBondContact O-N 2.97Å; G19-L71 WeakPolarHBondContact O-CB 3.15Å; G19-L71 PolarHBondContact O-N 2.74Å; G19-L71 VanDerWaalsContact O-N 3.09Å
20V94.4Very high93.9Very high43 Ų4350.7 Ų50.726%0.26126%0.259SS..EExtended strand (participates in β ladder)trans-138.1147.7177.6-178.90000108.3E18 W69 Y70 T93E18-V20 PolarHBondContact O-N 3.25Å; V20-W69 VanDerWaalsContact CA-O 3.3Å; V20-W69 WeakPolarHBondContact CA-O 3.28Å; V20-W69 WeakPolarHBondContact CG1-O 3.45Å; V20-Y70 HydrophobicContact CG1-CD1 4.47Å; V20-Y70 HydrophobicContact CG1-CE1 4.43Å; V20-Y70 HydrophobicContact CG2-CD1 4.03Å; V20-Y70 HydrophobicContact CG2-CE1 4.43Å; V20-T93 HydrophobicContact CG2-CG2 3.83Å
21M94.7Very high93.7Very high1 Ų155.6 Ų55.61%0.00528%0.28CS..EExtended strand (participates in β ladder)trans-139.6144.2170-170.7173.1-63.500110.7I11 L14 L15 V45 M49 W69I11-M21 HydrophobicContact CG2-CE 4.14Å; I11-M21 HydrophobicContact CG2-SD 4.25Å; I11-M21 WeakPolarHBondContact O-CE 3.28Å; L14-M21 HydrophobicContact CB-CE 3.98Å; L14-M21 HydrophobicContact CD2-CE 3.81Å; L14-M21 HydrophobicContact CG-CE 3.89Å; L15-M21 HydrophobicContact CB-CE 3.86Å; L15-M21 HydrophobicContact CD1-CB 3.99Å; M21-V45 HydrophobicContact SD-CG1 3.57Å; M21-V45 VanDerWaalsContact SD-CG1 3.57Å; M21-M49 HydrophobicContact CB-CE 4.2Å; M21-M49 HydrophobicContact CE-CE 3.49Å; M21-M49 VanDerWaalsContact CE-CE 3.49Å; M21-M49 HydrophobicContact CG-CE 4.3Å; M21-M49 HydrophobicContact SD-CE 3.21Å; M21-M49 WeakPolarHBondContact SD-CE 3.39Å; M21-W69 HydrophobicContact CB-CE3 4.3Å; M21-W69 HydrophobicContact CG-CE3 4.39Å; M21-W69 PolarHBondContact N-O 3.33Å; M21-W69 PolarHBondContact O-N 3.41Å
22V95.7Very high93.5Very high43 Ų4355.7 Ų55.726%0.26128%0.28SS..EExtended strand (participates in β ladder)trans-124135178.5-177.80000109.4H32 F67 Y68V22-H32 PolarHBondContact O-CE1 3.31Å; V22-H32 PolarHBondContact O-NE2 2.91Å; V22-F67 CarbonylContact C-O 3.58Å; V22-F67 VanDerWaalsContact CA-O 3.24Å; V22-F67 WeakPolarHBondContact CA-O 3.24Å; V22-F67 WeakPolarHBondContact CG1-O 3.37Å; V22-Y68 HydrophobicContact CB-CD1 4.5Å; V22-Y68 HydrophobicContact CG1-CD1 4.07Å; V22-Y68 HydrophobicContact CG1-CE1 3.91Å; V22-Y68 HydrophobicContact CG2-CD1 3.68Å; V22-Y68 HydrophobicContact CG2-CE1 4.06Å
23A95.8Very high93.2Very high1 Ų159.9 Ų59.91%0.00831%0.309CS..EExtended strand (participates in β ladder)trans-138.6141171.600000112.6V45 H66 F67 W69A23-V45 HydrophobicContact CB-CG1 4.13Å; A23-H66 CarbonylContact O-C 3.56Å; A23-H66 WeakPolarHBondContact O-CA 3.34Å; A23-F67 PolarHBondContact N-O 3.04Å; A23-F67 PolarHBondContact O-N 3.12Å; A23-W69 HydrophobicContact CB-CH2 3.84Å; A23-W69 HydrophobicContact CB-CZ3 3.49Å; A23-W69 VanDerWaalsContact CB-CZ3 3.49Å
24K95.5Very high92.8Very high91 Ų9160.6 Ų60.640%0.39631%0.312SS..EExtended strand (participates in β ladder)trans-69.9139169.2-170.4178-179.2-177.10109.3D26 N42K24-D26 HydrophobicContact CD-CB 4.43Å; K24-D26 HydrophobicContact CG-CB 4.3Å; K24-D26 PolarHBondContact O-N 3.12Å; K24-N42 PolarHBondContact O-ND2 3.39Å
25K95.7Very high92.4Very high110 Ų11059.7 Ų59.748%0.47831%0.307SS..SBendtrans-73.481.1170.1-173.1-179.1177.8-173.60109.2M46 F62 R65 F67K25-M46 HydrophobicContact CG-CE 4.17Å; K25-F62 HydrophobicContact CB-CE2 3.93Å; K25-F62 HydrophobicContact CB-CZ 4.2Å; K25-F62 HydrophobicContact CD-CE2 3.94Å; K25-F62 HydrophobicContact CD-CZ 3.57Å; K25-F62 HydrophobicContact CG-CE2 4.48Å; K25-F62 HydrophobicContact CG-CZ 4.5Å; K25-R65 HydrophobicContact CB-CB 4.48Å; K25-R65 WeakPolarHBondContact CB-O 3.34Å; K25-R65 PolarHBondContact N-O 3.45Å; K25-F67 HydrophobicContact CB-CD2 4.24Å; K25-F67 HydrophobicContact CB-CE2 3.53Å; K25-F67 HydrophobicContact CB-CZ 4.17Å; K25-F67 HydrophobicContact CD-CE2 4.32Å; K25-F67 HydrophobicContact CD-CZ 4.11Å; K25-F67 HydrophobicContact CG-CE2 3.74Å; K25-F67 HydrophobicContact CG-CZ 4.01Å
26D94.1Very high91.5Very high42 Ų4261.7 Ų61.723%0.22532%0.324CS..  trans-147.6110.8177.2-169.2-17.4000109.4K24 H28 L29 N42K24-D26 HydrophobicContact CD-CB 4.43Å; K24-D26 HydrophobicContact CG-CB 4.3Å; K24-D26 PolarHBondContact O-N 3.12Å; D26-H28 VanDerWaalsContact C-N 3.35Å; D26-H28 PolarHBondContact OD1-N 3.05Å; D26-L29 HydrophobicContact CB-CB 4.25Å; D26-L29 PolarHBondContact OD1-N 2.94Å; D26-N42 PolarHBondContact O-ND2 3.46Å
27V91.8Very high90.6Very high70 Ų7068.6 Ų68.642%0.42436%0.361SS..SBendtrans-81.2-18-176.6-63.60000112.8L43 M46V27-L43 HydrophobicContact CB-CD1 4.22Å; V27-L43 HydrophobicContact CG1-CD1 4Å; V27-M46 HydrophobicContact CG1-CE 4.25Å; V27-M46 HydrophobicContact CG1-SD 4.46Å
28H92Very high90.2Very high166 Ų16666.5 Ų66.577%0.76935%0.352SS*.SBendtrans-92.9-8.2-176.4-59.4-66.2000112.5D26 A30D26-H28 VanDerWaalsContact C-N 3.35Å; D26-H28 PolarHBondContact OD1-N 3.05Å; H28-A30 PolarHBondContact O-N 3.3Å
29L90.6Very high89.9Confident64 Ų6467 Ų6734%0.33536%0.357SS..  trans-64.6108.8176.2-170.671.4000110.2D26 K31 N42D26-L29 HydrophobicContact CB-CB 4.25Å; D26-L29 PolarHBondContact OD1-N 2.94Å; L29-K31 VanDerWaalsContact C-N 3.26Å; L29-K31 WeakPolarHBondContact CD2-O 3.28Å; L29-K31 WeakPolarHBondContact CG-O 3.41Å; L29-K31 PolarHBondContact O-N 3.07Å; L29-N42 HydrophobicContact CB-CB 3.89Å; L29-N42 HydrophobicContact CD2-CB 4.07Å; L29-N42 HydrophobicContact CG-CB 4.33Å; L29-N42 PolarHBondContact O-N 3.47Å
30A89.1Confident89.7Confident76 Ų7666.9 Ų66.963%0.62836%0.356SS*.SBendtrans-61.8-30.9-172.800000113.6H28 P41H28-A30 PolarHBondContact O-N 3.3Å; A30-P41 WeakPolarHBondContact O-CA 3.23Å
31K90.8Very high89.7Confident108 Ų10866.5 Ų66.547%0.4736%0.355SS..SBendtrans-138.3137.4180-58.6-173.5-170.9-170.40110.9L29 N39 V40L29-K31 VanDerWaalsContact C-N 3.26Å; L29-K31 WeakPolarHBondContact CD2-O 3.28Å; L29-K31 WeakPolarHBondContact CG-O 3.41Å; L29-K31 PolarHBondContact O-N 3.07Å; K31-N39 WeakPolarHBondContact CE-OD1 3.47Å; K31-N39 PolarHBondContact NZ-OD1 3.19Å; K31-V40 WeakPolarHBondContact CA-O 3.39Å
32H90.5Very high89.7Confident1 Ų166.5 Ų66.51%0.00536%0.355CS..  trans-78.6133.6172.6-175.378.2000110.3V22 E34 L35 A36 V40 N42 V45V22-H32 PolarHBondContact O-CE1 3.31Å; V22-H32 PolarHBondContact O-NE2 2.91Å; H32-E34 PolarHBondContact CD2-N 3.45Å; H32-E34 PolarHBondContact O-N 3.08Å; H32-L35 HydrophobicContact CB-CB 4.26Å; H32-L35 CarbonylContact O-C 3.59Å; H32-L35 VanDerWaalsContact O-C 3.29Å; H32-L35 PolarHBondContact O-N 3.2Å; H32-A36 PolarHBondContact O-N 2.8Å; H32-V40 PolarHBondContact N-O 3.46Å; H32-N42 PolarHBondContact ND1-OD1 2.7Å; H32-V45 HydrophobicContact CB-CG2 4.06Å
33P90Very high89.6Confident99 Ų9967.1 Ų67.164%0.64336%0.356SS*.G310 helixtrans-58.1-41.6-172.820.3-33000114.1L35P33-L35 VanDerWaalsContact C-N 3.29Å; P33-L35 PolarHBondContact O-N 3.4Å
34E85.5Confident89.5Confident99 Ų9968.5 Ų68.546%0.46336%0.362SS..G310 helixtrans-79-11.1179.2-60.6-179.1172.800113.7L14 H32L14-E34 HydrophobicContact CD2-CB 3.81Å; H32-E34 PolarHBondContact CD2-N 3.45Å; H32-E34 PolarHBondContact O-N 3.08Å
35L84.6Confident89.5Confident6 Ų664.1 Ų64.13%0.03134%0.344CS..G310 helixtrans-121.125.8179.4-67.3169.4000111.4I11 L14 H32 P33 D37 K38 N39 V40 V45I11-L35 HydrophobicContact CG1-CD1 3.82Å; L14-L35 HydrophobicContact CB-CD2 4.03Å; L14-L35 HydrophobicContact CD2-CD1 4.14Å; L14-L35 HydrophobicContact CD2-CD2 3.58Å; L14-L35 HydrophobicContact CD2-CG 3.58Å; L14-L35 HydrophobicContact CG-CD2 4.38Å; H32-L35 HydrophobicContact CB-CB 4.26Å; H32-L35 CarbonylContact O-C 3.59Å; H32-L35 VanDerWaalsContact O-C 3.29Å; H32-L35 PolarHBondContact O-N 3.2Å; P33-L35 VanDerWaalsContact C-N 3.29Å; P33-L35 PolarHBondContact O-N 3.4Å; L35-D37 VanDerWaalsContact C-N 3.25Å; L35-D37 PolarHBondContact O-N 2.88Å; L35-K38 HydrophobicContact CD2-CD 4.43Å; L35-K38 PolarHBondContact O-N 2.85Å; L35-N39 PolarHBondContact O-N 3.4Å; L35-V40 HydrophobicContact CB-CB 3.95Å; L35-V40 HydrophobicContact CB-CG2 4.24Å; L35-V40 HydrophobicContact CD1-CB 4.12Å; L35-V40 HydrophobicContact CD1-CG1 4.16Å; L35-V40 HydrophobicContact CD1-CG2 4.36Å; L35-V45 HydrophobicContact CD1-CG2 3.9Å
36A75.1Confident89.5Confident42 Ų4259.8 Ų59.835%0.34733%0.325SS..THydrogen-bonded Turntrans-58.6-40.3-177.300000111.4H32 K38 N39H32-A36 PolarHBondContact O-N 2.8Å; A36-K38 VanDerWaalsContact C-N 3.28Å; A36-K38 PolarHBondContact O-N 2.91Å; A36-N39 PolarHBondContact O-N 3.5Å
37D77.6Confident89.6Confident154 Ų15461.6 Ų61.682%0.82433%0.331SS*.THydrogen-bonded Turntrans-63.2-34.1-178.7-54.5-33.2000112.8L35 N39L35-D37 VanDerWaalsContact C-N 3.25Å; L35-D37 PolarHBondContact O-N 2.88Å; D37-N39 VanDerWaalsContact C-N 3.35Å
38K82.9Confident89.8Confident96 Ų9658.3 Ų58.342%0.41731%0.311SS..THydrogen-bonded Turntrans-92.44.4-176.8-62.5-176.7-178.1177.70112.7A10 E13 L35 A36 V40A10-K38 HydrophobicContact CB-CB 4.44Å; A10-K38 HydrophobicContact CB-CD 3.43Å; A10-K38 VanDerWaalsContact CB-CD 3.43Å; E13-K38 IonicContact OE2-NZ 2.7Å; E13-K38 PolarHBondContact OE2-NZ 3.47Å; L35-K38 HydrophobicContact CD2-CD 4.43Å; L35-K38 PolarHBondContact O-N 2.85Å; A36-K38 VanDerWaalsContact C-N 3.28Å; A36-K38 PolarHBondContact O-N 2.91Å; K38-V40 HydrophobicContact CB-CG2 3.95Å; K38-V40 PolarHBondContact O-N 3.02Å
39N87.4Confident89.9Confident92 Ų9250.4 Ų50.449%0.49228%0.275SS..THydrogen-bonded Turntrans51.439.1-178.5-66.5-55.6000113.6K31 L35 A36 D37 P41K31-N39 WeakPolarHBondContact CE-OD1 3.47Å; K31-N39 PolarHBondContact NZ-OD1 3.19Å; L35-N39 PolarHBondContact O-N 3.4Å; A36-N39 PolarHBondContact O-N 3.5Å; D37-N39 VanDerWaalsContact C-N 3.35Å; N39-P41 WeakPolarHBondContact O-CD 3.3Å
40V90.3Very high90.2Very high0 Ų052.3 Ų52.30%028%0.282CS..  trans-85.6122.4-179.1-178.10000110.2N7 A10 I11 K31 H32 L35 K38 H44 V45N7-V40 HydrophobicContact CB-CG1 4.38Å; N7-V40 HydrophobicContact CB-CG2 4.31Å; A10-V40 HydrophobicContact CB-CG2 4.21Å; I11-V40 HydrophobicContact CD1-CG1 3.93Å; I11-V40 HydrophobicContact CG1-CG1 4.01Å; K31-V40 WeakPolarHBondContact CA-O 3.39Å; H32-V40 PolarHBondContact N-O 3.46Å; L35-V40 HydrophobicContact CB-CB 3.95Å; L35-V40 HydrophobicContact CB-CG2 4.24Å; L35-V40 HydrophobicContact CD1-CB 4.12Å; L35-V40 HydrophobicContact CD1-CG1 4.16Å; L35-V40 HydrophobicContact CD1-CG2 4.36Å; K38-V40 HydrophobicContact CB-CG2 3.95Å; K38-V40 PolarHBondContact O-N 3.02Å; V40-H44 HydrophobicContact CG1-CB 4.11Å; V40-V45 HydrophobicContact CG1-CG2 4.15Å
41P93.5Very high90.5Very high36 Ų3651.6 Ų51.623%0.23427%0.272CS..  trans-65.2146.6173.6-21.232.8000112.8A30 N39 L43 H44 V45A30-P41 WeakPolarHBondContact O-CA 3.23Å; N39-P41 WeakPolarHBondContact O-CD 3.3Å; P41-L43 PolarHBondContact O-N 3.02Å; P41-H44 WeakPolarHBondContact O-CB 3.3Å; P41-H44 PolarHBondContact O-N 3.21Å; P41-V45 PolarHBondContact O-N 3.42Å
42N94.6Very high90.8Very high0 Ų046.6 Ų46.60%025%0.251CS..Hα-helixtrans-64.8-30.5-179.8-167.353000112.7K24 D26 L29 H32 H44 V45 M46K24-N42 PolarHBondContact O-ND2 3.39Å; D26-N42 PolarHBondContact O-ND2 3.46Å; L29-N42 HydrophobicContact CB-CB 3.89Å; L29-N42 HydrophobicContact CD2-CB 4.07Å; L29-N42 HydrophobicContact CG-CB 4.33Å; L29-N42 PolarHBondContact O-N 3.47Å; H32-N42 PolarHBondContact ND1-OD1 2.7Å; N42-H44 VanDerWaalsContact C-N 3.26Å; N42-H44 PolarHBondContact O-N 3.37Å; N42-V45 WeakPolarHBondContact O-CB 3.34Å; N42-V45 PolarHBondContact O-N 3.03Å; N42-M46 WeakPolarHBondContact O-CG 3.4Å; N42-M46 PolarHBondContact O-N 2.93Å
43L94.4Very high91.1Very high56 Ų5651.2 Ų51.229%0.29327%0.271SS..Hα-helixtrans-56.8-40.5172.9179.664.6000112.2M1 V27 P41 M46 K47M1-L43 HydrophobicContact CE-CG 4.36Å; M1-L43 HydrophobicContact SD-CD2 4.25Å; M1-L43 HydrophobicContact SD-CG 4.09Å; V27-L43 HydrophobicContact CB-CD1 4.22Å; V27-L43 HydrophobicContact CG1-CD1 4Å; P41-L43 PolarHBondContact O-N 3.02Å; L43-M46 PolarHBondContact O-N 3.32Å; L43-K47 HydrophobicContact CD1-CG 4.02Å; L43-K47 WeakPolarHBondContact O-CB 3.49Å; L43-K47 WeakPolarHBondContact O-CG 3.4Å; L43-K47 PolarHBondContact O-N 3.39Å
44H94.6Very high91.4Very high30 Ų3051 Ų5114%0.13927%0.272CS..Hα-helixtrans-64.4-43.5178.3-68.4178.6000111.2M1 M3 N7 I11 V40 P41 N42 K47 A48M1-H44 HydrophobicContact CE-CB 4.44Å; M1-H44 VanDerWaalsContact CE-CD2 3.45Å; M1-H44 WeakPolarHBondContact CE-CD2 3.3Å; M3-H44 HydrophobicContact CG-CB 4.47Å; M3-H44 HydrophobicContact SD-CB 3.7Å; N7-H44 PolarHBondContact ND2-ND1 2.63Å; I11-H44 HydrophobicContact CD1-CB 4.13Å; V40-H44 HydrophobicContact CG1-CB 4.11Å; P41-H44 WeakPolarHBondContact O-CB 3.3Å; P41-H44 PolarHBondContact O-N 3.21Å; N42-H44 VanDerWaalsContact C-N 3.26Å; N42-H44 PolarHBondContact O-N 3.37Å; H44-K47 PolarHBondContact O-N 3.4Å; H44-A48 WeakPolarHBondContact O-CB 3.46Å; H44-A48 PolarHBondContact O-N 2.95Å
45V95.1Very high91.8Very high0 Ų049.5 Ų49.50%027%0.271CS..Hα-helixtrans-58.7-53.2175.2177.80000110.5I11 M21 A23 H32 L35 V40 P41 N42 K47 A48 M49 W69I11-V45 HydrophobicContact CD1-CG2 4.16Å; I11-V45 HydrophobicContact CG1-CG2 4.09Å; M21-V45 HydrophobicContact SD-CG1 3.57Å; M21-V45 VanDerWaalsContact SD-CG1 3.57Å; A23-V45 HydrophobicContact CB-CG1 4.13Å; H32-V45 HydrophobicContact CB-CG2 4.06Å; L35-V45 HydrophobicContact CD1-CG2 3.9Å; V40-V45 HydrophobicContact CG1-CG2 4.15Å; P41-V45 PolarHBondContact O-N 3.42Å; N42-V45 WeakPolarHBondContact O-CB 3.34Å; N42-V45 PolarHBondContact O-N 3.03Å; V45-K47 VanDerWaalsContact C-N 3.31Å; V45-K47 PolarHBondContact O-N 3.44Å; V45-A48 PolarHBondContact O-N 3.33Å; V45-M49 HydrophobicContact CG1-CG 4.36Å; V45-M49 WeakPolarHBondContact O-CB 3.36Å; V45-M49 VanDerWaalsContact O-CG 3.28Å; V45-M49 WeakPolarHBondContact O-CG 3.2Å; V45-M49 PolarHBondContact O-N 3.21Å; V45-W69 HydrophobicContact CG1-CZ3 4.03Å
46M95.3Very high92.4Very high19 Ų1950.9 Ų50.99%0.09429%0.287CS..Hα-helixtrans-57.9-42.7-178.3-71.9178.153.300112.6K25 V27 N42 L43 Q50 F67 W69K25-M46 HydrophobicContact CG-CE 4.17Å; V27-M46 HydrophobicContact CG1-CE 4.25Å; V27-M46 HydrophobicContact CG1-SD 4.46Å; N42-M46 WeakPolarHBondContact O-CG 3.4Å; N42-M46 PolarHBondContact O-N 2.93Å; L43-M46 PolarHBondContact O-N 3.32Å; M46-Q50 VanDerWaalsContact O-CB 3.3Å; M46-Q50 WeakPolarHBondContact O-CB 3.49Å; M46-Q50 PolarHBondContact O-N 3.2Å; M46-F67 HydrophobicContact CE-CE2 3.57Å; M46-F67 HydrophobicContact CE-CZ 4.09Å; M46-F67 HydrophobicContact CG-CD2 4.38Å; M46-F67 HydrophobicContact CG-CE2 4.25Å; M46-F67 HydrophobicContact SD-CE2 4.16Å; M46-W69 HydrophobicContact CG-CH2 4.45Å
47K95.8Very high93.4Very high80 Ų8051.8 Ų51.835%0.34828%0.282SS..Hα-helixtrans-80.4-31.8-177.4-64-59.9-178.6-177.80113.2M1 L43 H44 V45 S51M1-K47 HydrophobicContact CB-CB 4.22Å; M1-K47 HydrophobicContact CE-CB 3.48Å; M1-K47 VanDerWaalsContact CE-CB 3.48Å; M1-K47 HydrophobicContact CE-CG 3.82Å; M1-K47 HydrophobicContact SD-CB 3.85Å; M1-K47 HydrophobicContact SD-CG 3.62Å; L43-K47 HydrophobicContact CD1-CG 4.02Å; L43-K47 WeakPolarHBondContact O-CB 3.49Å; L43-K47 WeakPolarHBondContact O-CG 3.4Å; L43-K47 PolarHBondContact O-N 3.39Å; H44-K47 PolarHBondContact O-N 3.4Å; V45-K47 VanDerWaalsContact C-N 3.31Å; V45-K47 PolarHBondContact O-N 3.44Å; K47-S51 PolarHBondContact O-N 3.01Å
48A95.4Very high94.3Very high1 Ų144.7 Ų44.71%0.00824%0.244CC..Hα-helixtrans-62.6-48.117000000110.5M3 I11 Y12 H44 V45 Q50 S51 L52M3-A48 HydrophobicContact CE-CB 3.8Å; M3-A48 HydrophobicContact SD-CB 4.34Å; I11-A48 HydrophobicContact CD1-CB 4.05Å; I11-A48 HydrophobicContact CG2-CB 4.24Å; Y12-A48 HydrophobicContact CE1-CB 4.49Å; H44-A48 WeakPolarHBondContact O-CB 3.46Å; H44-A48 PolarHBondContact O-N 2.95Å; V45-A48 PolarHBondContact O-N 3.33Å; A48-Q50 PolarHBondContact O-N 3.39Å; A48-S51 WeakPolarHBondContact O-CB 3.38Å; A48-S51 PolarHBondContact O-N 3.05Å; A48-S51 VanDerWaalsContact O-N 3.14Å; A48-L52 PolarHBondContact O-N 3.42Å
49M95.9Very high95Very high0 Ų046.9 Ų46.90%025%0.254CS..Hα-helixtrans-67.7-36.5179.8-66.2-58.7169.300112.8I11 L15 M21 V45 S51 L52 K53 W69I11-M49 HydrophobicContact CG2-CE 3.46Å; I11-M49 VanDerWaalsContact CG2-CE 3.46Å; L15-M49 HydrophobicContact CB-CE 3.97Å; L15-M49 HydrophobicContact CD1-CE 4.08Å; L15-M49 HydrophobicContact CD2-CE 3.63Å; L15-M49 HydrophobicContact CD2-SD 3.87Å; L15-M49 HydrophobicContact CG-CE 4.1Å; M21-M49 HydrophobicContact CB-CE 4.2Å; M21-M49 HydrophobicContact CE-CE 3.49Å; M21-M49 VanDerWaalsContact CE-CE 3.49Å; M21-M49 HydrophobicContact CG-CE 4.3Å; M21-M49 HydrophobicContact SD-CE 3.21Å; M21-M49 WeakPolarHBondContact SD-CE 3.39Å; V45-M49 HydrophobicContact CG1-CG 4.36Å; V45-M49 WeakPolarHBondContact O-CB 3.36Å; V45-M49 VanDerWaalsContact O-CG 3.28Å; V45-M49 WeakPolarHBondContact O-CG 3.2Å; V45-M49 PolarHBondContact O-N 3.21Å; M49-S51 VanDerWaalsContact C-N 3.25Å; M49-S51 PolarHBondContact O-N 3.33Å; M49-L52 PolarHBondContact O-N 3.25Å; M49-L52 HydrophobicContact SD-CD1 3.94Å; M49-K53 WeakPolarHBondContact O-CB 3.39Å; M49-K53 PolarHBondContact O-N 2.98Å; M49-W69 HydrophobicContact CB-CD2 3.62Å; M49-W69 HydrophobicContact CB-CE3 3.97Å; M49-W69 HydrophobicContact CB-CG 4.21Å; M49-W69 HydrophobicContact CB-CH2 3.77Å; M49-W69 HydrophobicContact CB-CZ2 3.43Å; M49-W69 VanDerWaalsContact CB-CZ2 3.43Å; M49-W69 HydrophobicContact CB-CZ3 4.02Å; M49-W69 HydrophobicContact CG-CD2 3.7Å; M49-W69 HydrophobicContact CG-CE3 3.6Å; M49-W69 HydrophobicContact CG-CG 4.33Å; M49-W69 HydrophobicContact CG-CH2 3.97Å; M49-W69 HydrophobicContact CG-CZ2 4.09Å; M49-W69 HydrophobicContact CG-CZ3 3.72Å; M49-W69 HydrophobicContact SD-CD2 4.42Å; M49-W69 HydrophobicContact SD-CE3 4.48Å
50Q96Very high95.4Very high104 Ų10444.8 Ų44.849%0.48624%0.241SC..Hα-helixtrans-57.7-40.1171.5-174.9178.30.400111.7M46 A48 S54M46-Q50 VanDerWaalsContact O-CB 3.3Å; M46-Q50 WeakPolarHBondContact O-CB 3.49Å; M46-Q50 PolarHBondContact O-N 3.2Å; A48-Q50 PolarHBondContact O-N 3.39Å; Q50-S54 PolarHBondContact O-N 3.05Å; Q50-S54 VanDerWaalsContact O-N 3.11Å; Q50-S54 PolarHBondContact O-OG 3Å
51S95.8Very high95.8Very high61 Ų6149.9 Ų49.943%0.42727%0.265SS..Hα-helixtrans-67.1-43.3176.3-168.10000112.2K47 A48 M49 K53 S54 C55K47-S51 PolarHBondContact O-N 3.01Å; A48-S51 WeakPolarHBondContact O-CB 3.38Å; A48-S51 PolarHBondContact O-N 3.05Å; A48-S51 VanDerWaalsContact O-N 3.14Å; M49-S51 VanDerWaalsContact C-N 3.25Å; M49-S51 PolarHBondContact O-N 3.33Å; S51-K53 VanDerWaalsContact C-N 3.33Å; S51-K53 PolarHBondContact O-N 3.31Å; S51-S54 PolarHBondContact O-N 3.42Å; S51-S54 PolarHBondContact O-OG 3.08Å; S51-C55 PolarHBondContact O-N 3.11Å; S51-C55 PolarHBondContact O-SG 3.41Å; S51-C55 VanDerWaalsContact O-SG 3.38Å
52L95.9Very high95.9Very high3 Ų352.3 Ų52.32%0.01627%0.272CS..Hα-helixtrans-66-37.3178.2-68.3177.6000111.8Y12 L15 A48 M49 C55 G56 Y57 V58 Y78Y12-L52 HydrophobicContact CD1-CD1 4.17Å; Y12-L52 HydrophobicContact CE1-CD1 3.74Å; Y12-L52 HydrophobicContact CE1-CD2 4.27Å; Y12-L52 HydrophobicContact CE1-CG 4.19Å; L15-L52 HydrophobicContact CD2-CD1 3.72Å; A48-L52 PolarHBondContact O-N 3.42Å; M49-L52 PolarHBondContact O-N 3.25Å; M49-L52 HydrophobicContact SD-CD1 3.94Å; L52-C55 PolarHBondContact O-N 3.03Å; L52-G56 PolarHBondContact O-N 3.09Å; L52-Y57 HydrophobicContact CD2-CD2 3.86Å; L52-Y57 PolarHBondContact O-N 3.17Å; L52-Y57 VanDerWaalsContact O-N 3.08Å; L52-V58 HydrophobicContact CB-CB 4.3Å; L52-V58 HydrophobicContact CB-CG2 3.82Å; L52-V58 HydrophobicContact CD1-CG2 4.15Å; L52-Y78 HydrophobicContact CD2-CD1 4.22Å; L52-Y78 HydrophobicContact CD2-CE1 3.85Å
53K96.8Very high96Very high97 Ų9753.8 Ų53.842%0.42228%0.284SS..Hα-helixtrans-61.1-46.7173.6-178.3-155.6-176.2168.80111.7M49 S51 C55 G56 E60M49-K53 WeakPolarHBondContact O-CB 3.39Å; M49-K53 PolarHBondContact O-N 2.98Å; S51-K53 VanDerWaalsContact C-N 3.33Å; S51-K53 PolarHBondContact O-N 3.31Å; K53-C55 PolarHBondContact O-N 3.29Å; K53-G56 PolarHBondContact O-N 3.36Å; K53-E60 HydrophobicContact CD-CB 4Å; K53-E60 WeakPolarHBondContact CD-OE2 3.32Å; K53-E60 HydrophobicContact CG-CB 4.23Å; K53-E60 IonicContact NZ-OE1 2.77Å; K53-E60 PolarHBondContact NZ-OE1 2.97Å; K53-E60 IonicContact NZ-OE2 3.71Å
54S96.5Very high96.1Very high95 Ų9562.4 Ų62.466%0.66431%0.313SS*.Hα-helixtrans-62.5-25.2-179.851.60000113.3Q50 S51Q50-S54 PolarHBondContact O-N 3.05Å; Q50-S54 VanDerWaalsContact O-N 3.11Å; Q50-S54 PolarHBondContact O-OG 3Å; S51-S54 PolarHBondContact O-N 3.42Å; S51-S54 PolarHBondContact O-OG 3.08Å
55C94.6Very high96.2Very high68 Ų6868 Ų6846%0.45933%0.333SS..THydrogen-bonded Turntrans-89-3175.9-610000113.8S51 L52 K53 Y57S51-C55 PolarHBondContact O-N 3.11Å; S51-C55 PolarHBondContact O-SG 3.41Å; S51-C55 VanDerWaalsContact O-SG 3.38Å; L52-C55 PolarHBondContact O-N 3.03Å; K53-C55 PolarHBondContact O-N 3.29Å; C55-Y57 VanDerWaalsContact C-N 3.35Å; C55-Y57 HydrophobicContact CB-CD2 3.59Å; C55-Y57 HydrophobicContact CB-CE2 3.48Å; C55-Y57 VanDerWaalsContact CB-CE2 3.48Å; C55-Y57 HydrophobicContact CB-CG 4.25Å
56G96.1Very high96.3Very high35 Ų3571.1 Ų71.136%0.36135%0.347SS..THydrogen-bonded Turntrans831.5-178.800000115.8L52 K53 V58 T72L52-G56 PolarHBondContact O-N 3.09Å; K53-G56 PolarHBondContact O-N 3.36Å; G56-V58 VanDerWaalsContact C-N 3.3Å; G56-V58 PolarHBondContact O-N 3.37Å; G56-T72 PolarHBondContact O-OG1 2.96Å; G56-T72 VanDerWaalsContact O-OG1 3.06Å
57Y96.9Very high96.3Very high61 Ų6171.4 Ų71.424%0.23935%0.348CS..SBendtrans-74.5-18.8-177.9-60.2-37000114.1L52 C55 T72 E74 G75 Y78L52-Y57 HydrophobicContact CD2-CD2 3.86Å; L52-Y57 PolarHBondContact O-N 3.17Å; L52-Y57 VanDerWaalsContact O-N 3.08Å; C55-Y57 VanDerWaalsContact C-N 3.35Å; C55-Y57 HydrophobicContact CB-CD2 3.59Å; C55-Y57 HydrophobicContact CB-CE2 3.48Å; C55-Y57 VanDerWaalsContact CB-CE2 3.48Å; C55-Y57 HydrophobicContact CB-CG 4.25Å; Y57-T72 WeakPolarHBondContact CA-OG1 3.33Å; Y57-T72 PolarHBondContact O-N 2.95Å; Y57-T72 PolarHBondContact O-OG1 3.05Å; Y57-E74 HydrophobicContact CD1-CB 4.33Å; Y57-G75 WeakPolarHBondContact O-CA 3.46Å; Y57-Y78 HydrophobicContact CD1-CG 4.42Å; Y57-Y78 AromaticContact CD2-CD1 3.7Å; Y57-Y78 HydrophobicContact CD2-CD1 3.7Å; Y57-Y78 HydrophobicContact CD2-CD2 4.4Å; Y57-Y78 HydrophobicContact CD2-CE1 4.14Å; Y57-Y78 AromaticContact CD2-CG 3.85Å; Y57-Y78 HydrophobicContact CD2-CG 3.85Å; Y57-Y78 HydrophobicContact CE1-CD2 4.42Å; Y57-Y78 HydrophobicContact CE1-CG 4.14Å; Y57-Y78 AromaticContact CE2-CD1 3.72Å; Y57-Y78 HydrophobicContact CE2-CD1 3.72Å; Y57-Y78 AromaticContact CE2-CD2 3.61Å; Y57-Y78 HydrophobicContact CE2-CD2 3.61Å; Y57-Y78 HydrophobicContact CE2-CE1 4.03Å; Y57-Y78 AromaticContact CE2-CE2 3.92Å; Y57-Y78 HydrophobicContact CE2-CE2 3.92Å; Y57-Y78 AromaticContact CE2-CG 3.5Å; Y57-Y78 HydrophobicContact CE2-CG 3.5Å; Y57-Y78 VanDerWaalsContact CE2-CG 3.5Å; Y57-Y78 HydrophobicContact CG-CD1 4.3Å; Y57-Y78 HydrophobicContact CG-CG 4.31Å; Y57-Y78 AromaticContact CZ-CD2 3.62Å; Y57-Y78 AromaticContact CZ-CG 3.66Å
58V97.6Very high96.4Very high5 Ų571.2 Ų71.23%0.0335%0.345CS..EExtended strand (participates in β ladder)trans-139.9136.6-175.7174.40000109.5L15 L52 G56 W69 Y70 L71L15-V58 HydrophobicContact CD2-CG2 3.97Å; L52-V58 HydrophobicContact CB-CB 4.3Å; L52-V58 HydrophobicContact CB-CG2 3.82Å; L52-V58 HydrophobicContact CD1-CG2 4.15Å; G56-V58 VanDerWaalsContact C-N 3.3Å; G56-V58 PolarHBondContact O-N 3.37Å; V58-W69 HydrophobicContact CG1-CB 3.48Å; V58-W69 VanDerWaalsContact CG1-CB 3.48Å; V58-W69 HydrophobicContact CG1-CG 3.81Å; V58-Y70 CarbonylContact C-O 3.29Å; V58-Y70 WeakPolarHBondContact CA-O 3.36Å; V58-L71 HydrophobicContact CG2-CD1 4.08Å
59K96.8Very high96.5Very high141 Ų14171.2 Ų71.261%0.61335%0.345SS*.EExtended strand (participates in β ladder)trans-90.9125.6169.7-174.5178.7-178.2178.50109.7W69 Y70 T72K59-W69 CarbonylContact O-C 3.58Å; K59-W69 WeakPolarHBondContact O-CA 3.21Å; K59-Y70 PolarHBondContact N-O 2.99Å; K59-Y70 PolarHBondContact O-N 3.13Å; K59-T72 HydrophobicContact CB-CG2 4.38Å
60E96.6Very high96.5Very high49 Ų4976.4 Ų76.423%0.22937%0.365CS..EExtended strand (participates in β ladder)trans-100.1135.4177.9-179.1178.5104.700111.2K53 F67 Y68 W69K53-E60 HydrophobicContact CD-CB 4Å; K53-E60 WeakPolarHBondContact CD-OE2 3.32Å; K53-E60 HydrophobicContact CG-CB 4.23Å; K53-E60 IonicContact NZ-OE1 2.77Å; K53-E60 PolarHBondContact NZ-OE1 2.97Å; K53-E60 IonicContact NZ-OE2 3.71Å; E60-F67 HydrophobicContact CG-CD1 4.3Å; E60-Y68 CarbonylContact C-O 3.57Å; E60-Y68 WeakPolarHBondContact CA-O 3.47Å; E60-W69 PolarHBondContact OE2-NE1 3.06Å
61Q96.8Very high96.5Very high106 Ų10672.6 Ų72.650%0.49535%0.349SS..EExtended strand (participates in β ladder)trans-123.8131.7165.3-18068.37.600108.1Y68 Y70Q61-Y68 PolarHBondContact N-O 3.21Å; Q61-Y68 PolarHBondContact O-N 2.95Å; Q61-Y70 HydrophobicContact CB-CE2 4.22Å
62F97.1Very high96.5Very high88 Ų8871.6 Ų71.639%0.38634%0.34SS..EExtended strand (participates in β ladder)trans-119.7122.8-179.8-176.4-108.7000110.6K25 H66 F67K25-F62 HydrophobicContact CB-CE2 3.93Å; K25-F62 HydrophobicContact CB-CZ 4.2Å; K25-F62 HydrophobicContact CD-CE2 3.94Å; K25-F62 HydrophobicContact CD-CZ 3.57Å; K25-F62 HydrophobicContact CG-CE2 4.48Å; K25-F62 HydrophobicContact CG-CZ 4.5Å; F62-H66 WeakPolarHBondContact CA-O 3.5Å; F62-H66 WeakPolarHBondContact CD2-O 3.45Å; F62-F67 HydrophobicContact CB-CD1 4.45Å; F62-F67 AromaticContact CD2-CD1 3.44Å; F62-F67 HydrophobicContact CD2-CD1 3.44Å; F62-F67 VanDerWaalsContact CD2-CD1 3.44Å; F62-F67 HydrophobicContact CD2-CD2 4.35Å; F62-F67 AromaticContact CD2-CE1 3.48Å; F62-F67 HydrophobicContact CD2-CE1 3.48Å; F62-F67 VanDerWaalsContact CD2-CE1 3.48Å; F62-F67 HydrophobicContact CD2-CE2 4.39Å; F62-F67 AromaticContact CD2-CG 3.9Å; F62-F67 HydrophobicContact CD2-CG 3.9Å; F62-F67 AromaticContact CD2-CZ 3.98Å; F62-F67 HydrophobicContact CD2-CZ 3.98Å; F62-F67 HydrophobicContact CE2-CD1 4.08Å; F62-F67 HydrophobicContact CE2-CD2 4.28Å; F62-F67 AromaticContact CE2-CE1 3.84Å; F62-F67 HydrophobicContact CE2-CE1 3.84Å; F62-F67 HydrophobicContact CE2-CE2 4.06Å; F62-F67 HydrophobicContact CE2-CG 4.29Å; F62-F67 AromaticContact CE2-CZ 3.83Å; F62-F67 HydrophobicContact CE2-CZ 3.83Å; F62-F67 HydrophobicContact CG-CD1 4.3Å; F62-F67 HydrophobicContact CG-CE1 4.24Å
63A96.8Very high96.5Very high31 Ų3177.8 Ų77.826%0.25637%0.373SS..EExtended strand (participates in β ladder)trans-149141.418000000110.3R65 H66 Y68A63-R65 PolarHBondContact O-N 3.06Å; A63-R65 VanDerWaalsContact O-N 3.11Å; A63-H66 PolarHBondContact N-O 3.06Å; A63-H66 WeakPolarHBondContact O-CA 3.49Å; A63-H66 WeakPolarHBondContact O-CB 3.17Å; A63-H66 PolarHBondContact O-N 3.32Å; A63-H66 VanDerWaalsContact O-O 3.1Å; A63-Y68 HydrophobicContact CB-CE2 4.25Å
64W96.1Very high96.4Very high237 Ų23778.9 Ų78.990%0.89838%0.38SS*.THydrogen-bonded Turntrans53.535173.3-57.386.6000115.2H66W64-H66 PolarHBondContact O-CD2 2.81Å; W64-H66 VanDerWaalsContact O-CD2 3.28Å; W64-H66 PolarHBondContact O-N 2.97Å
65R96.2Very high96.4Very high148 Ų14874.4 Ų74.456%0.55835%0.348SS*.THydrogen-bonded Turntrans64.419.3-172.3-53.7174.558.3-169-0.9114.6K25 A63K25-R65 HydrophobicContact CB-CB 4.48Å; K25-R65 WeakPolarHBondContact CB-O 3.34Å; K25-R65 PolarHBondContact N-O 3.45Å; A63-R65 PolarHBondContact O-N 3.06Å; A63-R65 VanDerWaalsContact O-N 3.11Å
66H96.6Very high96.4Very high64 Ų6472.1 Ų72.130%0.29633%0.331SS..EExtended strand (participates in β ladder)trans-114.7134.4171.7-72.4-98.3000110.4A23 F62 A63 W64 Y68A23-H66 CarbonylContact O-C 3.56Å; A23-H66 WeakPolarHBondContact O-CA 3.34Å; F62-H66 WeakPolarHBondContact CA-O 3.5Å; F62-H66 WeakPolarHBondContact CD2-O 3.45Å; A63-H66 PolarHBondContact N-O 3.06Å; A63-H66 WeakPolarHBondContact O-CA 3.49Å; A63-H66 WeakPolarHBondContact O-CB 3.17Å; A63-H66 PolarHBondContact O-N 3.32Å; A63-H66 VanDerWaalsContact O-O 3.1Å; W64-H66 PolarHBondContact O-CD2 2.81Å; W64-H66 VanDerWaalsContact O-CD2 3.28Å; W64-H66 PolarHBondContact O-N 2.97Å; H66-Y68 HydrophobicContact CB-CD2 4.41Å; H66-Y68 HydrophobicContact CB-CE2 3.63Å
67F97.1Very high96.3Very high26 Ų2676.5 Ų76.511%0.11434%0.342CS..EExtended strand (participates in β ladder)trans-87.5133.6166.4-62.8-78.5000108.9V22 A23 K25 M46 E60 F62 W69V22-F67 CarbonylContact C-O 3.58Å; V22-F67 VanDerWaalsContact CA-O 3.24Å; V22-F67 WeakPolarHBondContact CA-O 3.24Å; V22-F67 WeakPolarHBondContact CG1-O 3.37Å; A23-F67 PolarHBondContact N-O 3.04Å; A23-F67 PolarHBondContact O-N 3.12Å; K25-F67 HydrophobicContact CB-CD2 4.24Å; K25-F67 HydrophobicContact CB-CE2 3.53Å; K25-F67 HydrophobicContact CB-CZ 4.17Å; K25-F67 HydrophobicContact CD-CE2 4.32Å; K25-F67 HydrophobicContact CD-CZ 4.11Å; K25-F67 HydrophobicContact CG-CE2 3.74Å; K25-F67 HydrophobicContact CG-CZ 4.01Å; M46-F67 HydrophobicContact CE-CE2 3.57Å; M46-F67 HydrophobicContact CE-CZ 4.09Å; M46-F67 HydrophobicContact CG-CD2 4.38Å; M46-F67 HydrophobicContact CG-CE2 4.25Å; M46-F67 HydrophobicContact SD-CE2 4.16Å; E60-F67 HydrophobicContact CG-CD1 4.3Å; F62-F67 HydrophobicContact CB-CD1 4.45Å; F62-F67 AromaticContact CD2-CD1 3.44Å; F62-F67 HydrophobicContact CD2-CD1 3.44Å; F62-F67 VanDerWaalsContact CD2-CD1 3.44Å; F62-F67 HydrophobicContact CD2-CD2 4.35Å; F62-F67 AromaticContact CD2-CE1 3.48Å; F62-F67 HydrophobicContact CD2-CE1 3.48Å; F62-F67 VanDerWaalsContact CD2-CE1 3.48Å; F62-F67 HydrophobicContact CD2-CE2 4.39Å; F62-F67 AromaticContact CD2-CG 3.9Å; F62-F67 HydrophobicContact CD2-CG 3.9Å; F62-F67 AromaticContact CD2-CZ 3.98Å; F62-F67 HydrophobicContact CD2-CZ 3.98Å; F62-F67 HydrophobicContact CE2-CD1 4.08Å; F62-F67 HydrophobicContact CE2-CD2 4.28Å; F62-F67 AromaticContact CE2-CE1 3.84Å; F62-F67 HydrophobicContact CE2-CE1 3.84Å; F62-F67 HydrophobicContact CE2-CE2 4.06Å; F62-F67 HydrophobicContact CE2-CG 4.29Å; F62-F67 AromaticContact CE2-CZ 3.83Å; F62-F67 HydrophobicContact CE2-CZ 3.83Å; F62-F67 HydrophobicContact CG-CD1 4.3Å; F62-F67 HydrophobicContact CG-CE1 4.24Å; F67-W69 HydrophobicContact CB-CD2 4.08Å; F67-W69 HydrophobicContact CB-CE3 4.09Å; F67-W69 HydrophobicContact CB-CH2 3.39Å; F67-W69 HydrophobicContact CB-CZ2 3.34Å; F67-W69 HydrophobicContact CB-CZ3 3.78Å; F67-W69 AromaticContact CD1-CZ2 3.88Å; F67-W69 HydrophobicContact CD1-CZ2 3.88Å; F67-W69 AromaticContact CD2-CH2 3.96Å; F67-W69 HydrophobicContact CD2-CH2 3.96Å; F67-W69 HydrophobicContact CD2-CZ2 4.08Å; F67-W69 AromaticContact CG-CH2 3.73Å; F67-W69 HydrophobicContact CG-CH2 3.73Å; F67-W69 AromaticContact CG-CZ2 3.51Å; F67-W69 HydrophobicContact CG-CZ2 3.51Å
68Y97.1Very high96.2Very high75 Ų7577 Ų7729%0.29434%0.344SS..EExtended strand (participates in β ladder)trans-120.3120.5172.2-59.7-91.6000107V22 E60 Q61 A63 H66V22-Y68 HydrophobicContact CB-CD1 4.5Å; V22-Y68 HydrophobicContact CG1-CD1 4.07Å; V22-Y68 HydrophobicContact CG1-CE1 3.91Å; V22-Y68 HydrophobicContact CG2-CD1 3.68Å; V22-Y68 HydrophobicContact CG2-CE1 4.06Å; E60-Y68 CarbonylContact C-O 3.57Å; E60-Y68 WeakPolarHBondContact CA-O 3.47Å; Q61-Y68 PolarHBondContact N-O 3.21Å; Q61-Y68 PolarHBondContact O-N 2.95Å; A63-Y68 HydrophobicContact CB-CE2 4.25Å; H66-Y68 HydrophobicContact CB-CD2 4.41Å; H66-Y68 HydrophobicContact CB-CE2 3.63Å
69W97.5Very high96.1Very high2 Ų276.9 Ų76.91%0.00834%0.343CS..EExtended strand (participates in β ladder)trans-116.9129.8-177.9-71.1-62.8000110.3V20 M21 A23 V45 M46 M49 V58 K59 E60 F67V20-W69 VanDerWaalsContact CA-O 3.3Å; V20-W69 WeakPolarHBondContact CA-O 3.28Å; V20-W69 WeakPolarHBondContact CG1-O 3.45Å; M21-W69 HydrophobicContact CB-CE3 4.3Å; M21-W69 HydrophobicContact CG-CE3 4.39Å; M21-W69 PolarHBondContact N-O 3.33Å; M21-W69 PolarHBondContact O-N 3.41Å; A23-W69 HydrophobicContact CB-CH2 3.84Å; A23-W69 HydrophobicContact CB-CZ3 3.49Å; A23-W69 VanDerWaalsContact CB-CZ3 3.49Å; V45-W69 HydrophobicContact CG1-CZ3 4.03Å; M46-W69 HydrophobicContact CG-CH2 4.45Å; M49-W69 HydrophobicContact CB-CD2 3.62Å; M49-W69 HydrophobicContact CB-CE3 3.97Å; M49-W69 HydrophobicContact CB-CG 4.21Å; M49-W69 HydrophobicContact CB-CH2 3.77Å; M49-W69 HydrophobicContact CB-CZ2 3.43Å; M49-W69 VanDerWaalsContact CB-CZ2 3.43Å; M49-W69 HydrophobicContact CB-CZ3 4.02Å; M49-W69 HydrophobicContact CG-CD2 3.7Å; M49-W69 HydrophobicContact CG-CE3 3.6Å; M49-W69 HydrophobicContact CG-CG 4.33Å; M49-W69 HydrophobicContact CG-CH2 3.97Å; M49-W69 HydrophobicContact CG-CZ2 4.09Å; M49-W69 HydrophobicContact CG-CZ3 3.72Å; M49-W69 HydrophobicContact SD-CD2 4.42Å; M49-W69 HydrophobicContact SD-CE3 4.48Å; V58-W69 HydrophobicContact CG1-CB 3.48Å; V58-W69 VanDerWaalsContact CG1-CB 3.48Å; V58-W69 HydrophobicContact CG1-CG 3.81Å; K59-W69 CarbonylContact O-C 3.58Å; K59-W69 WeakPolarHBondContact O-CA 3.21Å; E60-W69 PolarHBondContact OE2-NE1 3.06Å; F67-W69 HydrophobicContact CB-CD2 4.08Å; F67-W69 HydrophobicContact CB-CE3 4.09Å; F67-W69 HydrophobicContact CB-CH2 3.39Å; F67-W69 HydrophobicContact CB-CZ2 3.34Å; F67-W69 HydrophobicContact CB-CZ3 3.78Å; F67-W69 AromaticContact CD1-CZ2 3.88Å; F67-W69 HydrophobicContact CD1-CZ2 3.88Å; F67-W69 AromaticContact CD2-CH2 3.96Å; F67-W69 HydrophobicContact CD2-CH2 3.96Å; F67-W69 HydrophobicContact CD2-CZ2 4.08Å; F67-W69 AromaticContact CG-CH2 3.73Å; F67-W69 HydrophobicContact CG-CH2 3.73Å; F67-W69 AromaticContact CG-CZ2 3.51Å; F67-W69 HydrophobicContact CG-CZ2 3.51Å
70Y96.4Very high96Very high108 Ų10872.6 Ų72.642%0.42432%0.323SS..EExtended strand (participates in β ladder)trans-114124.9177.5-56.7-87.9000108.9V20 V58 K59 Q61V20-Y70 HydrophobicContact CG1-CD1 4.47Å; V20-Y70 HydrophobicContact CG1-CE1 4.43Å; V20-Y70 HydrophobicContact CG2-CD1 4.03Å; V20-Y70 HydrophobicContact CG2-CE1 4.43Å; V58-Y70 CarbonylContact C-O 3.29Å; V58-Y70 WeakPolarHBondContact CA-O 3.36Å; K59-Y70 PolarHBondContact N-O 2.99Å; K59-Y70 PolarHBondContact O-N 3.13Å; Q61-Y70 HydrophobicContact CB-CE2 4.22Å
71L95.8Very high95.9Very high25 Ų2575.6 Ų75.613%0.13134%0.341CS..EExtended strand (participates in β ladder)trans-69.3131.4177.8-169.963.6000110.2L15 F16 G19 V58 I76 L79 P91L15-L71 HydrophobicContact CD2-CD1 4.03Å; L15-L71 HydrophobicContact CG-CD1 4.25Å; F16-L71 HydrophobicContact CD2-CD2 4.39Å; G19-L71 WeakPolarHBondContact O-CB 3.15Å; G19-L71 PolarHBondContact O-N 2.74Å; G19-L71 VanDerWaalsContact O-N 3.09Å; V58-L71 HydrophobicContact CG2-CD1 4.08Å; L71-I76 HydrophobicContact CD2-CG1 3.6Å; L71-I76 HydrophobicContact CG-CG1 3.85Å; L71-L79 HydrophobicContact CD1-CD1 3.64Å; L71-L79 HydrophobicContact CD2-CD1 4.06Å; L71-P91 HydrophobicContact CD2-CG 4.07Å
72T96.1Very high95.8Very high40 Ų4073.6 Ų73.625%0.24533%0.331CS..  trans-91.4165.3176.768.10000110.9G56 Y57 K59 E74 G75 I76G56-T72 PolarHBondContact O-OG1 2.96Å; G56-T72 VanDerWaalsContact O-OG1 3.06Å; Y57-T72 WeakPolarHBondContact CA-OG1 3.33Å; Y57-T72 PolarHBondContact O-N 2.95Å; Y57-T72 PolarHBondContact O-OG1 3.05Å; K59-T72 HydrophobicContact CB-CG2 4.38Å; T72-E74 VanDerWaalsContact C-N 3.27Å; T72-E74 PolarHBondContact O-N 2.95Å; T72-G75 WeakPolarHBondContact O-CA 3.49Å; T72-G75 PolarHBondContact O-N 3.46Å; T72-G75 PolarHBondContact OG1-N 2.86Å; T72-I76 WeakPolarHBondContact O-CG1 3.34Å; T72-I76 PolarHBondContact O-N 3.06Å
73N94.9Very high95.7Very high132 Ų13270.8 Ų70.871%0.70632%0.32SS*.Hα-helixtrans-58.4-38.6178.9-65.3-30.3000112.7I76 Q77N73-I76 WeakPolarHBondContact O-CB 3.4Å; N73-I76 PolarHBondContact O-N 2.86Å; N73-Q77 PolarHBondContact O-N 3.21Å
74E95.4Very high95.5Very high121 Ų12177.3 Ų77.357%0.56534%0.344SS*.Hα-helixtrans-66.6-40.3174.9-63.8175.8-176.300111.4Y57 T72 I76 Q77 Y78Y57-E74 HydrophobicContact CD1-CB 4.33Å; T72-E74 VanDerWaalsContact C-N 3.27Å; T72-E74 PolarHBondContact O-N 2.95Å; E74-I76 VanDerWaalsContact C-N 3.29Å; E74-I76 PolarHBondContact O-N 2.78Å; E74-Q77 PolarHBondContact O-N 3.14Å; E74-Y78 PolarHBondContact O-N 3.49Å
75G95.5Very high95.3Very high0 Ų068.6 Ų68.60%032%0.315CS..Hα-helixtrans-63.2-33.6175.200000113.5Y57 T72 Y78 L79Y57-G75 WeakPolarHBondContact O-CA 3.46Å; T72-G75 WeakPolarHBondContact O-CA 3.49Å; T72-G75 PolarHBondContact O-N 3.46Å; T72-G75 PolarHBondContact OG1-N 2.86Å; G75-Y78 PolarHBondContact O-N 3.05Å; G75-L79 WeakPolarHBondContact O-CB 3.47Å; G75-L79 VanDerWaalsContact O-CG 3.3Å; G75-L79 WeakPolarHBondContact O-CG 3.17Å; G75-L79 PolarHBondContact O-N 3.38Å
76I94.8Very high95.1Very high21 Ų2164.9 Ų64.911%0.10831%0.31CS..Hα-helixtrans-61.1-46.1173.8-66.2172.6000110.3F16 L71 T72 N73 E74 R80 P91F16-I76 HydrophobicContact CE2-CG2 3.92Å; L71-I76 HydrophobicContact CD2-CG1 3.6Å; L71-I76 HydrophobicContact CG-CG1 3.85Å; T72-I76 WeakPolarHBondContact O-CG1 3.34Å; T72-I76 PolarHBondContact O-N 3.06Å; N73-I76 WeakPolarHBondContact O-CB 3.4Å; N73-I76 PolarHBondContact O-N 2.86Å; E74-I76 VanDerWaalsContact C-N 3.29Å; E74-I76 PolarHBondContact O-N 2.78Å; I76-R80 VanDerWaalsContact O-CB 3.27Å; I76-R80 WeakPolarHBondContact O-CB 3.43Å; I76-R80 PolarHBondContact O-N 3.5Å; I76-P91 HydrophobicContact CD1-CG 4.07Å; I76-P91 HydrophobicContact CG1-CG 4.03Å
77Q94Very high94.6Very high127 Ų12766.6 Ų66.659%0.59333%0.327SS*.Hα-helixtrans-63.2-49178-66.6177.4-14.200111N73 E74 L79 R80 D81N73-Q77 PolarHBondContact O-N 3.21Å; E74-Q77 PolarHBondContact O-N 3.14Å; Q77-L79 PolarHBondContact O-N 3.42Å; Q77-R80 WeakPolarHBondContact O-CB 3.33Å; Q77-R80 PolarHBondContact O-N 3.31Å; Q77-D81 PolarHBondContact O-N 3.3Å
78Y95.8Very high94Very high72 Ų7273.6 Ų73.628%0.28236%0.36SS..Hα-helixtrans-57.2-47.8178.5173.7-100.3000112.8Y12 L52 Y57 E74 G75 R80 D81 F82Y12-Y78 HydrophobicContact CE2-CE1 4.47Å; L52-Y78 HydrophobicContact CD2-CD1 4.22Å; L52-Y78 HydrophobicContact CD2-CE1 3.85Å; Y57-Y78 HydrophobicContact CD1-CG 4.42Å; Y57-Y78 AromaticContact CD2-CD1 3.7Å; Y57-Y78 HydrophobicContact CD2-CD1 3.7Å; Y57-Y78 HydrophobicContact CD2-CD2 4.4Å; Y57-Y78 HydrophobicContact CD2-CE1 4.14Å; Y57-Y78 AromaticContact CD2-CG 3.85Å; Y57-Y78 HydrophobicContact CD2-CG 3.85Å; Y57-Y78 HydrophobicContact CE1-CD2 4.42Å; Y57-Y78 HydrophobicContact CE1-CG 4.14Å; Y57-Y78 AromaticContact CE2-CD1 3.72Å; Y57-Y78 HydrophobicContact CE2-CD1 3.72Å; Y57-Y78 AromaticContact CE2-CD2 3.61Å; Y57-Y78 HydrophobicContact CE2-CD2 3.61Å; Y57-Y78 HydrophobicContact CE2-CE1 4.03Å; Y57-Y78 AromaticContact CE2-CE2 3.92Å; Y57-Y78 HydrophobicContact CE2-CE2 3.92Å; Y57-Y78 AromaticContact CE2-CG 3.5Å; Y57-Y78 HydrophobicContact CE2-CG 3.5Å; Y57-Y78 VanDerWaalsContact CE2-CG 3.5Å; Y57-Y78 HydrophobicContact CG-CD1 4.3Å; Y57-Y78 HydrophobicContact CG-CG 4.31Å; Y57-Y78 AromaticContact CZ-CD2 3.62Å; Y57-Y78 AromaticContact CZ-CG 3.66Å; E74-Y78 PolarHBondContact O-N 3.49Å; G75-Y78 PolarHBondContact O-N 3.05Å; Y78-R80 VanDerWaalsContact C-N 3.32Å; Y78-R80 PolarHBondContact O-N 3.08Å; Y78-D81 PolarHBondContact O-N 3.01Å; Y78-F82 VanDerWaalsContact O-CB 3.3Å; Y78-F82 WeakPolarHBondContact O-CB 3.17Å; Y78-F82 PolarHBondContact O-N 3.3Å
79L95Very high93.4Very high1 Ų173.7 Ų73.71%0.00537%0.365CS..Hα-helixtrans-68.2-33.3-179.6-70.3-177.8000112.2Y12 L15 F16 L71 G75 Q77 L83Y12-L79 HydrophobicContact CD1-CD2 4.22Å; Y12-L79 HydrophobicContact CD2-CD2 3.76Å; Y12-L79 HydrophobicContact CE2-CD2 4.31Å; Y12-L79 HydrophobicContact CG-CD2 3.71Å; L15-L79 HydrophobicContact CB-CD1 4.49Å; L15-L79 HydrophobicContact CD2-CD1 3.83Å; L15-L79 HydrophobicContact CG-CD1 4.12Å; F16-L79 HydrophobicContact CB-CD1 4.28Å; F16-L79 HydrophobicContact CD2-CB 3.83Å; F16-L79 HydrophobicContact CD2-CD1 4.36Å; F16-L79 HydrophobicContact CE2-CB 4.5Å; L71-L79 HydrophobicContact CD1-CD1 3.64Å; L71-L79 HydrophobicContact CD2-CD1 4.06Å; G75-L79 WeakPolarHBondContact O-CB 3.47Å; G75-L79 VanDerWaalsContact O-CG 3.3Å; G75-L79 WeakPolarHBondContact O-CG 3.17Å; G75-L79 PolarHBondContact O-N 3.38Å; Q77-L79 PolarHBondContact O-N 3.42Å; L79-L83 VanDerWaalsContact O-CB 3.23Å; L79-L83 WeakPolarHBondContact O-CB 3.44Å; L79-L83 VanDerWaalsContact O-CG 3.28Å; L79-L83 WeakPolarHBondContact O-CG 3.46Å; L79-L83 PolarHBondContact O-N 3.28Å
80R94.2Very high92.8Very high51 Ų5176 Ų7619%0.19238%0.379CS..Hα-helixtrans-63.5-47175.2-177.8-177.5-69.4175.4-8.9111.4F16 I76 Q77 Y78 H84 L85 P87 I89F16-R80 HydrophobicContact CE2-CB 4.43Å; I76-R80 VanDerWaalsContact O-CB 3.27Å; I76-R80 WeakPolarHBondContact O-CB 3.43Å; I76-R80 PolarHBondContact O-N 3.5Å; Q77-R80 WeakPolarHBondContact O-CB 3.33Å; Q77-R80 PolarHBondContact O-N 3.31Å; Y78-R80 VanDerWaalsContact C-N 3.32Å; Y78-R80 PolarHBondContact O-N 3.08Å; R80-H84 WeakPolarHBondContact O-CA 3.43Å; R80-H84 PolarHBondContact O-N 2.78Å; R80-L85 HydrophobicContact CG-CB 4.31Å; R80-L85 WeakPolarHBondContact CG-O 3.41Å; R80-L85 PolarHBondContact O-N 3.28Å; R80-P87 VanDerWaalsContact CZ-CA 3.5Å; R80-P87 VanDerWaalsContact CZ-O 3.29Å; R80-P87 PolarHBondContact NH1-O 2.76Å; R80-P87 PolarHBondContact NH2-O 2.76Å; R80-I89 PolarHBondContact NH2-O 2.78Å; R80-I89 VanDerWaalsContact NH2-O 3.12Å
81D95Very high92.5Very high113 Ų11370.9 Ų70.960%0.60436%0.359SS*.Hα-helixtrans-67.3-39.6178.6-65.8-18.8000111.4Q77 Y78 H84Q77-D81 PolarHBondContact O-N 3.3Å; Y78-D81 PolarHBondContact O-N 3.01Å; D81-H84 PolarHBondContact O-CE1 3.03Å; D81-H84 VanDerWaalsContact O-CE1 3.3Å; D81-H84 PolarHBondContact O-N 3.11Å; D81-H84 PolarHBondContact O-ND1 3.25Å
82F94.4Very high92.2Very high64 Ų6471.8 Ų71.828%0.28137%0.37SS..Hα-helixtrans-68.9-38.7179.3-175.6-87.3000113.3I9 Y12 Y78I9-F82 HydrophobicContact CG1-CE1 4.25Å; Y12-F82 AromaticContact CD2-CD1 3.53Å; Y12-F82 HydrophobicContact CD2-CD1 3.53Å; Y12-F82 AromaticContact CD2-CE1 3.48Å; Y12-F82 HydrophobicContact CD2-CE1 3.48Å; Y12-F82 VanDerWaalsContact CD2-CE1 3.48Å; Y12-F82 HydrophobicContact CD2-CG 4.26Å; Y12-F82 HydrophobicContact CD2-CZ 4.19Å; Y12-F82 AromaticContact CE2-CD1 3.95Å; Y12-F82 HydrophobicContact CE2-CD1 3.95Å; Y12-F82 AromaticContact CE2-CE1 3.74Å; Y12-F82 HydrophobicContact CE2-CE1 3.74Å; Y12-F82 HydrophobicContact CE2-CE2 4.38Å; Y12-F82 HydrophobicContact CE2-CG 4.36Å; Y12-F82 AromaticContact CE2-CZ 3.97Å; Y12-F82 HydrophobicContact CE2-CZ 3.97Å; Y78-F82 VanDerWaalsContact O-CB 3.3Å; Y78-F82 WeakPolarHBondContact O-CB 3.17Å; Y78-F82 PolarHBondContact O-N 3.3Å
83L94.6Very high91.7Very high29 Ų2974.2 Ų74.215%0.15239%0.385CS..Hα-helixtrans-89-5.2179.7-64.9169.1000112.6I9 E13 F16 L79 L85I9-L83 HydrophobicContact CG2-CD2 4.11Å; E13-L83 HydrophobicContact CG-CD2 4.05Å; F16-L83 HydrophobicContact CB-CD1 4.21Å; L79-L83 VanDerWaalsContact O-CB 3.23Å; L79-L83 WeakPolarHBondContact O-CB 3.44Å; L79-L83 VanDerWaalsContact O-CG 3.28Å; L79-L83 WeakPolarHBondContact O-CG 3.46Å; L79-L83 PolarHBondContact O-N 3.28Å; L83-L85 VanDerWaalsContact C-N 3.32Å; L83-L85 HydrophobicContact CB-CD1 3.67Å; L83-L85 HydrophobicContact CB-CG 3.76Å; L83-L85 HydrophobicContact CD1-CD1 3.82Å; L83-L85 HydrophobicContact CG-CD1 4.4Å; L83-L85 PolarHBondContact O-N 3.37Å
84H92.9Very high91.3Very high167 Ų16773.7 Ų73.777%0.77338%0.382SS*.THydrogen-bonded Turntrans54.745.3-176.3-53.2-58.4000112.9R80 D81R80-H84 WeakPolarHBondContact O-CA 3.43Å; R80-H84 PolarHBondContact O-N 2.78Å; D81-H84 PolarHBondContact O-CE1 3.03Å; D81-H84 VanDerWaalsContact O-CE1 3.3Å; D81-H84 PolarHBondContact O-N 3.11Å; D81-H84 PolarHBondContact O-ND1 3.25Å
85L92.2Very high90.7Very high55 Ų5576.7 Ų76.729%0.28839%0.388SS..  trans-91.1144.4179.6-64.8165.5000110.5F16 R80 L83 I89F16-L85 HydrophobicContact CD1-CD1 3.6Å; F16-L85 HydrophobicContact CE1-CD1 3.59Å; F16-L85 HydrophobicContact CG-CD1 4.28Å; F16-L85 HydrophobicContact CZ-CD1 4.26Å; R80-L85 HydrophobicContact CG-CB 4.31Å; R80-L85 WeakPolarHBondContact CG-O 3.41Å; R80-L85 PolarHBondContact O-N 3.28Å; L83-L85 VanDerWaalsContact C-N 3.32Å; L83-L85 HydrophobicContact CB-CD1 3.67Å; L83-L85 HydrophobicContact CB-CG 3.76Å; L83-L85 HydrophobicContact CD1-CD1 3.82Å; L83-L85 HydrophobicContact CG-CD1 4.4Å; L83-L85 PolarHBondContact O-N 3.37Å; L85-I89 HydrophobicContact CD2-CD1 4.11Å
86P91.4Very high89.7Confident69 Ų6988.1 Ų88.145%0.44843%0.431SS..  trans-64153174.524.8-31.8000111.6E88 I89P86-E88 PolarHBondContact O-N 2.88Å; P86-E88 VanDerWaalsContact O-N 3.08Å; P86-I89 HydrophobicContact CG-CD1 3.82Å; P86-I89 HydrophobicContact CG-CG1 4.03Å; P86-I89 PolarHBondContact O-N 2.76Å
87P85.4Confident88.6Confident100 Ų10095.8 Ų95.865%0.64947%0.466SS*.THydrogen-bonded Turntrans-66.2-14.2-174.827.3-35.5000114.6R80R80-P87 VanDerWaalsContact CZ-CA 3.5Å; R80-P87 VanDerWaalsContact CZ-O 3.29Å; R80-P87 PolarHBondContact NH1-O 2.76Å; R80-P87 PolarHBondContact NH2-O 2.76Å
88E85.7Confident87.3Confident173 Ų17396.3 Ų96.381%0.80848%0.478SS*.THydrogen-bonded Turntrans-72.9-25.8177.7-168.7175.3-178.600113.1P86 V90P86-E88 PolarHBondContact O-N 2.88Å; P86-E88 VanDerWaalsContact O-N 3.08Å; E88-V90 WeakPolarHBondContact O-CG2 3.43Å; E88-V90 PolarHBondContact O-N 2.97Å
89I84.4Confident86.1Confident78 Ų78102.2 Ų102.240%0.450%0.5SS..  trans-79.3123.4-179.8-53.3174.3000108.7F16 R80 L85 P86F16-I89 HydrophobicContact CE1-CB 4.26Å; F16-I89 HydrophobicContact CE1-CG2 3.78Å; F16-I89 WeakPolarHBondContact CZ-O 3.46Å; R80-I89 PolarHBondContact NH2-O 2.78Å; R80-I89 VanDerWaalsContact NH2-O 3.12Å; L85-I89 HydrophobicContact CD2-CD1 4.11Å; P86-I89 HydrophobicContact CG-CD1 3.82Å; P86-I89 HydrophobicContact CG-CG1 4.03Å; P86-I89 PolarHBondContact O-N 2.76Å
90V85.3Confident84.7Confident49 Ų49107.4 Ų107.430%0.29753%0.534SS..  trans-121.5139.6-177.7-170.60000109E88 L94E88-V90 WeakPolarHBondContact O-CG2 3.43Å; E88-V90 PolarHBondContact O-N 2.97Å; V90-L94 HydrophobicContact CG1-CB 3.49Å; V90-L94 VanDerWaalsContact CG1-CB 3.49Å; V90-L94 HydrophobicContact CG1-CD2 3.42Å; V90-L94 VanDerWaalsContact CG1-CD2 3.42Å; V90-L94 HydrophobicContact CG1-CG 3.79Å
91P89.2Confident83.3Confident1 Ų1113.7 Ų113.71%0.00657%0.565CS.*  trans-52.7150.9172.6-25.732.8000113.4F16 L71 I76 T93 L94 R95F16-P91 HydrophobicContact CD2-CG 4.29Å; F16-P91 HydrophobicContact CE2-CG 4.23Å; F16-P91 VanDerWaalsContact O-CA 3.25Å; F16-P91 WeakPolarHBondContact O-CA 3.45Å; F16-P91 VanDerWaalsContact O-CB 3.24Å; F16-P91 WeakPolarHBondContact O-CB 3.46Å; F16-P91 WeakPolarHBondContact O-CG 3.45Å; L71-P91 HydrophobicContact CD2-CG 4.07Å; I76-P91 HydrophobicContact CD1-CG 4.07Å; I76-P91 HydrophobicContact CG1-CG 4.03Å; P91-T93 PolarHBondContact O-N 3.06Å; P91-T93 VanDerWaalsContact O-N 3.12Å; P91-L94 PolarHBondContact O-N 3.28Å; P91-R95 PolarHBondContact O-N 2.97Å
92A89Confident81.5Confident45 Ų45112.7 Ų112.737%0.37256%0.564SS.*THydrogen-bonded Turntrans-55.4-32.5-178.900000113.2K17 L94 R95K17-A92 VanDerWaalsContact O-CB 3.3Å; K17-A92 WeakPolarHBondContact O-CB 3.33Å; K17-A92 PolarHBondContact O-N 3.19Å; A92-L94 PolarHBondContact O-N 3.47Å; A92-R95 PolarHBondContact O-N 3.34Å
93T86.1Confident79.8Confident91 Ų91114.3 Ų114.356%0.55859%0.589SS**THydrogen-bonded Turntrans-59.8-28.5177.148.70000114.8E18 V20 P91E18-T93 WeakPolarHBondContact O-CG2 3.45Å; V20-T93 HydrophobicContact CG2-CG2 3.83Å; P91-T93 PolarHBondContact O-N 3.06Å; P91-T93 VanDerWaalsContact O-N 3.12Å
94L85.9Confident78.4Confident121 Ų121123.3 Ų123.363%0.63462%0.621SS**THydrogen-bonded Turntrans-99.8-11.5-179.6-170.167.2000112.1V90 P91 A92 R96V90-L94 HydrophobicContact CG1-CB 3.49Å; V90-L94 VanDerWaalsContact CG1-CB 3.49Å; V90-L94 HydrophobicContact CG1-CD2 3.42Å; V90-L94 VanDerWaalsContact CG1-CD2 3.42Å; V90-L94 HydrophobicContact CG1-CG 3.79Å; P91-L94 PolarHBondContact O-N 3.28Å; A92-L94 PolarHBondContact O-N 3.47Å; L94-R96 PolarHBondContact O-N 3.44Å
95R82.9Confident76.7Confident184 Ų184121.1 Ų121.169%0.69462%0.621SS**SBendtrans-72.5118.3171.3-66.4-174.669.2176.61.9109.1P91 A92 Q97P91-R95 PolarHBondContact O-N 2.97Å; A92-R95 PolarHBondContact O-N 3.34Å; R95-Q97 PolarHBondContact O-N 3.33Å; R95-Q97 VanDerWaalsContact O-N 3.15Å
96R76Confident75.2Confident240 Ų240129.6 Ų129.691%0.90665%0.649SS**  trans-64.7116173.2-164.7177.9-143.3-173.45.8108.9L94 T98L94-R96 PolarHBondContact O-N 3.44Å; R96-T98 PolarHBondContact O-N 3.29Å
97Q70.9Confident73.5Confident182 Ų182132.2 Ų132.285%0.8567%0.666SS**  trans-66.2121.4169.2-78.1-171.7-16.400109.1R95 R99R95-Q97 PolarHBondContact O-N 3.33Å; R95-Q97 VanDerWaalsContact O-N 3.15Å; Q97-R99 PolarHBondContact O-N 2.92Å
98T67.4Low71.7Confident137 Ų137137.2 Ų137.284%0.8468%0.678SS**  trans-7087.4166-480000106.9R96 P100R96-T98 PolarHBondContact O-N 3.29Å; T98-P100 VanDerWaalsContact O-CD 3.32Å; T98-P100 WeakPolarHBondContact O-CD 3.3Å
99R70.7Confident70Confident197 Ų197132.4 Ų132.474%0.74368%0.675SS**  trans-58.4119.3170.6176.7174.2164.6178.1-4.4106.5Q97 E101Q97-R99 PolarHBondContact O-N 2.92Å; R99-E101 PolarHBondContact O-N 3.04Å
100P65.6Low67.9Low110 Ų110137.8 Ų137.871%0.71470%0.701SS**  trans-58.6120.5169.324.1-30.3000105.9T98 T102T98-P100 VanDerWaalsContact O-CD 3.32Å; T98-P100 WeakPolarHBondContact O-CD 3.3Å; P100-T102 VanDerWaalsContact C-N 3.34Å; P100-T102 PolarHBondContact O-N 2.77Å
101E63.4Low66.1Low183 Ų183144.9 Ų144.986%0.85573%0.73SS**  trans-53.4107.1174-166.1173.8-173.500105.7R99 A103R99-E101 PolarHBondContact O-N 3.04Å; E101-A103 PolarHBondContact O-N 2.87Å
102T58.5Low64Low92 Ų92147.7 Ų147.756%0.56476%0.76SS**  trans-62.1111.2177.1-17.30000103.1P100 R104P100-T102 VanDerWaalsContact C-N 3.34Å; P100-T102 PolarHBondContact O-N 2.77Å; T102-R104 PolarHBondContact O-N 3.45Å
103A57.7Low61.6Low98 Ų98155 Ų15581%0.8179%0.787SS**  trans-59.571.3174.500000109E101 P105E101-A103 PolarHBondContact O-N 2.87Å; A103-P105 VanDerWaalsContact O-CD 3.29Å; A103-P105 WeakPolarHBondContact O-CD 3.39Å
104R65.1Low59.6Low217 Ų217162.2 Ų162.282%0.81980%0.804SS**  trans-75.6112.1155.7-76.9-171.5177-160-1.1103.5T102 R106T102-R104 PolarHBondContact O-N 3.45Å; R104-R106 VanDerWaalsContact C-N 3.34Å; R104-R106 PolarHBondContact O-N 3.03Å
105P57.3Low57.3Low121 Ų121162.3 Ų162.379%0.78681%0.811SS**  trans-59.1105.9174.424.4-31.1000106.8A103 P107A103-P105 VanDerWaalsContact O-CD 3.29Å; A103-P105 WeakPolarHBondContact O-CD 3.39Å; P105-P107 WeakPolarHBondContact O-CD 3.38Å
106R62.3Low55.9Low234 Ų234158.1 Ų158.188%0.88382%0.816SS**PPolyproline II helixtrans-64.2117.9164.6-157.9177.3-162.9163.12.4104.2R104 K108R104-R106 VanDerWaalsContact C-N 3.34Å; R104-R106 PolarHBondContact O-N 3.03Å; R106-K108 PolarHBondContact O-N 3.19Å
107P54.7Low54.2Low123 Ų123157.8 Ų157.880%0.79982%0.815SS**PPolyproline II helixtrans-59.1116-18021.8-29.7000107.7P105 G109P105-P107 WeakPolarHBondContact O-CD 3.38Å; P107-G109 PolarHBondContact O-N 2.97Å
108K46.9Very low53.2Low205 Ų205157 Ų15789%0.89182%0.815SS**PPolyproline II helixtrans-65.9121.4178-154.9173.4-175.8-178.70106.3R106 M110R106-K108 PolarHBondContact O-N 3.19Å; K108-M110 PolarHBondContact O-N 2.88Å
109G50.5Low51.9Low73 Ų73156.7 Ų156.775%0.75381%0.809SS**PPolyproline II helixtrans-53.4125.3170.100000108.9P107 E111P107-G109 PolarHBondContact O-N 2.97Å; G109-E111 PolarHBondContact O-N 3.23Å
110M41.1Very low50.9Low190 Ų190158 Ų15894%0.93681%0.814SS**  trans-76.4103.4174.3-166.9134.1146.600107.2K108K108-M110 PolarHBondContact O-N 2.88Å
111E46.8Very low50Low198 Ų198156.4 Ų156.493%0.92582%0.817SS**  trans-76115.5166.6-162.3177.3172.500107.3G109G109-E111 PolarHBondContact O-N 3.23Å
112G44.5Very low49.3Very low61 Ų61156 Ų15663%0.62982%0.815SS**  trans166.294.3177.900000114.3
113E39.7Very low49.1Very low199 Ų199155.3 Ų155.393%0.9382%0.818SS**  trans86.4114.8153.2-54.9-173120.400119.7
114R43.8Very low49Very low242 Ų242157.4 Ų157.491%0.91382%0.816SS**  trans-68.9156.8178.5-68.3171.8163.9176.1-3.3111.9
115P38Very low48.4Very low123 Ų123157.8 Ų157.880%0.79982%0.818SS**  -137.5140.891.131.1-15000113.4R117P115-R117 PolarHBondContact O-N 3.35Å
116A53.2Low48.2Very low96 Ų96155.8 Ų155.879%0.79380%0.8SS**  trans-68.1108.3171.300000110.5
117R41.2Very low48Very low232 Ų232148.9 Ų148.988%0.87578%0.784SS**  trans-151.5111.7153.3-73.8-159177.5155.71111.6P115P115-R117 PolarHBondContact O-N 3.35Å
118L49.8Very low47.8Very low165 Ų165152.4 Ų152.486%0.86478%0.783SS**  trans26107.4143.3-73.873.4000117.1
119N39Very low48.1Very low131 Ų131152.8 Ų152.870%0.70178%0.779SS**  trans-148.1112.4142.2-114.7-9.2000107.4
120R50.5Low48.2Very low225 Ų225159.2 Ų159.285%0.84978%0.781SS**  73.494.884.9-174.9177.1-65.4173.22.7109.4
121G46.6Very low48.6Very low76 Ų76154.5 Ų154.578%0.78477%0.766SS**  trans168.1-7.6173.300000116
122E49Very low48.9Very low176 Ų176149.3 Ų149.382%0.82276%0.757SS**SBendtrans-123.138.7-170.1-148.5-175.2165.900113.1
123A52.9Low49Very low76 Ų76150.4 Ų150.463%0.62876%0.76SS**SBendtrans-128.3-1817400000113.5T127A123-T127 PolarHBondContact O-OG1 3.46Å
124D55.3Low49.2Very low143 Ų143146.2 Ų146.277%0.76575%0.75SS**Hα-helixtrans-87.5-22.3-174.8-124.7-80.5000113.7T127D124-T127 PolarHBondContact O-OG1 3.35Å
125R53.4Low49.3Very low224 Ų224141.1 Ų141.185%0.84575%0.748SS**Hα-helixtrans-82.7-29.6-179.5-112.6-175.2-177.7173.71.9113.5
126D53.7Low49.9Very low79 Ų79139.2 Ų139.242%0.42275%0.751SS.*Hα-helixtrans-81.6-24-175.7-89.8-63.2000113.5R130D126-R130 PolarHBondContact O-N 3.2Å
127T58.4Low49.4Very low89 Ų89138.3 Ų138.355%0.54674%0.744SS.*Hα-helixtrans-69.9-37.9175.230.10000112.4A123 D124 R129 R130 S131A123-T127 PolarHBondContact O-OG1 3.46Å; D124-T127 PolarHBondContact O-OG1 3.35Å; T127-R129 VanDerWaalsContact C-N 3.32Å; T127-R129 PolarHBondContact O-N 2.77Å; T127-R130 PolarHBondContact O-N 3.36Å; T127-S131 PolarHBondContact O-N 3.36Å; T127-S131 PolarHBondContact O-OG 3.38Å
128Y49.1Very low50Low198 Ų198135.3 Ų135.378%0.77675%0.745SS**Hα-helixtrans-69.8-29.3178.6-138.6-89.1000113.1
129R54.3Low49.9Very low213 Ų213136.3 Ų136.380%0.80474%0.742SS**Hα-helixtrans-77.3-27.1178.4-158-179.4-147.1153.55.1112.4T127T127-R129 VanDerWaalsContact C-N 3.32Å; T127-R129 PolarHBondContact O-N 2.77Å
130R53Low50.4Low208 Ų208140.3 Ų140.379%0.78575%0.753SS**Hα-helixtrans-96.5-12.7-173.9-154.7177.4-70179.1-0113.9D126 T127D126-R130 PolarHBondContact O-N 3.2Å; T127-R130 PolarHBondContact O-N 3.36Å
131S49Very low50Low91 Ų91133.7 Ų133.764%0.63675%0.747SS**SBendtrans-90.60.3-179.758.10000115.3T127 A133T127-S131 PolarHBondContact O-N 3.36Å; T127-S131 PolarHBondContact O-OG 3.38Å; S131-A133 PolarHBondContact O-N 3.11Å
132A53.4Low50.2Low89 Ų89139.6 Ų139.674%0.73675%0.754SS**SBendtrans-99.762.1177.100000112.3
133A45.4Very low49.9Very low83 Ų83135.6 Ų135.669%0.68675%0.751SS**  trans164.5118.1145.800000111.6S131S131-A133 PolarHBondContact O-N 3.11Å
134P44.3Very low49.2Very low111 Ų111135.9 Ų135.972%0.72176%0.762SS**  trans-77.9146.4148.47.79.6000109.7
135P45.4Very low48.5Very low135 Ų135134.5 Ų134.588%0.87777%0.77SS**SBendtrans-77.1131.7174.432.4-30.3000109.6
136G51.6Low48.2Very low83 Ų83127.4 Ų127.486%0.85677%0.767SS**  trans92.554.3166.200000116.9
137A41.2Very low48.2Very low77 Ų77128.7 Ų128.764%0.63679%0.789SS**  trans-12995.6163.300000110.4K139A137-K139 PolarHBondContact O-N 3.49Å
138D53.8Low47.5Very low170 Ų170128.4 Ų128.491%0.90980%0.795SS**  trans-51.4103.5157.4-67-77.7000109.3
139K47.9Very low47.8Very low186 Ų186126 Ų12681%0.80980%0.801SS**  trans-116.384.1168.3-103.8170.5176.1171.90108.8A137 A141A137-K139 PolarHBondContact O-N 3.49Å; K139-A141 PolarHBondContact O-N 3.04Å; K139-A141 VanDerWaalsContact O-N 3.13Å
140K50.5Low47.6Very low214 Ų214123.7 Ų123.793%0.9380%0.8SS**  trans-48112.1145.2-76.8-177.5174-176.70107.2
141A42.4Very low47.5Very low87 Ų87123.1 Ų123.172%0.71980%0.803SS**  trans-128.978.9166.400000107.4K139 A143K139-A141 PolarHBondContact O-N 3.04Å; K139-A141 VanDerWaalsContact O-N 3.13Å; A141-A143 PolarHBondContact O-N 2.74Å
142E50.5Low47.6Very low200 Ų200127.3 Ų127.394%0.93581%0.813SS**  trans-57109.6149.1-177.7-175.2146.700107.7
143A43.2Very low47.3Very low91 Ų91132.7 Ų132.775%0.75282%0.82SS**  trans-150.8108.9163.200000107.5A141A141-A143 PolarHBondContact O-N 2.74Å
144G36.9Very low47.8Very low83 Ų83140.6 Ų140.686%0.85683%0.832SS**  trans-62.5179-178.900000114.4
145A40.1Very low47.7Very low113 Ų113138.7 Ų138.793%0.93483%0.832SS**SBendcis-133.5125.3900000109.7
146G47.1Very low47.8Very low76 Ų76135.8 Ų135.878%0.78483%0.827SS**  trans-174.210.5176.500000113.4A148G146-A148 VanDerWaalsContact C-N 3.28Å; G146-A148 PolarHBondContact O-N 3.17Å; G146-A148 VanDerWaalsContact O-N 3.17Å
147A53.9Low47.2Very low106 Ų106142.6 Ų142.688%0.87683%0.833SS**  trans-89.255.1-177.300000111.4
148A45.1Very low47.5Very low83 Ų83142.2 Ų142.269%0.68684%0.837SS**  trans-126.7103.8171.600000109.6G146 E150G146-A148 VanDerWaalsContact C-N 3.28Å; G146-A148 PolarHBondContact O-N 3.17Å; G146-A148 VanDerWaalsContact O-N 3.17Å; A148-E150 PolarHBondContact O-N 3.02Å
149T54.9Low47.4Very low146 Ų146146 Ų14690%0.89684%0.838SS**  trans-78.954.1-176.2-24.20000111.6
150E50.8Low47.3Very low166 Ų166141.1 Ų141.178%0.77684%0.842SS**  trans-139.389.7175-73.8-164.1159.200112.1A148A148-E150 PolarHBondContact O-N 3.02Å
151F49.7Very low47Very low196 Ų196142.9 Ų142.986%0.8684%0.842SS**  trans-88.4102.7161.8-82.4-88.5000108.9F153F151-F153 PolarHBondContact O-N 3.23Å
152Q50.7Low47Very low178 Ų178142.4 Ų142.483%0.83285%0.846SS**  trans-76.5103170.2-77.5-177.3-10.200110.6R154Q152-R154 PolarHBondContact O-N 3.27Å
153F48.3Very low46.7Very low202 Ų202142.2 Ų142.289%0.88685%0.845SS**  trans-78.396.6167-115.2-98.7000109.3F151 G155F151-F153 PolarHBondContact O-N 3.23Å; F153-G155 VanDerWaalsContact C-N 3.34Å; F153-G155 PolarHBondContact O-N 3.01Å
154R55Low46.6Very low250 Ų250146.8 Ų146.894%0.94385%0.851SS**  trans-78.286.2172.1-128.2-177.6-171.7168.93109.4Q152Q152-R154 PolarHBondContact O-N 3.27Å
155G42.5Very low47.8Very low70 Ų70148.8 Ų148.872%0.72285%0.849SS**  trans-75.3142.6172.700000112.8F153F153-G155 VanDerWaalsContact C-N 3.34Å; F153-G155 PolarHBondContact O-N 3.01Å
156G47.3Very low48.1Very low74 Ų74156.3 Ų156.376%0.76387%0.865SS**  trans96.296.8147.700000117.5G158G156-G158 PolarHBondContact O-N 3.47Å
157F39.9Very low48.2Very low226 Ų226160.4 Ų160.499%0.99187%0.869SS**  trans-88.790.2150.7-91.4-92.2000108.7
158G47.8Very low47.9Very low70 Ų70163.2 Ų163.272%0.72287%0.868SS**PPolyproline II helixtrans-70.2145.6175.200000112.5G156 G160G156-G158 PolarHBondContact O-N 3.47Å; G158-G160 PolarHBondContact O-N 3.42Å
159R51Low48Very low248 Ų248167.7 Ų167.794%0.93688%0.879SS**PPolyproline II helixtrans-62.8123.4177.3-64.9171178.1-178.2-0.9110R161R159-R161 PolarHBondContact O-N 3.38Å
160G44.8Very low47.6Very low85 Ų85168.9 Ų168.988%0.87688%0.878SS**PPolyproline II helixtrans-61.7123.4177.700000112.2G158G158-G160 PolarHBondContact O-N 3.42Å
161R44.5Very low47.4Very low250 Ų250169.1 Ų169.194%0.94388%0.884SS**PPolyproline II helixtrans-90.1133.1172-162179.7-175.4-170.10.7108.3R159R159-R161 PolarHBondContact O-N 3.38Å
162G43.1Very low47.3Very low78 Ų78167.3 Ų167.380%0.80489%0.886SS**PPolyproline II helixtrans-67158.7-169.900000116.4
163Q43.3Very low47Very low196 Ų196166.6 Ų166.692%0.91689%0.889SS**PPolyproline II helixtrans-102.1132.7177.3-166.8125.533.800109.6
164Q41.9Very low46.9Very low187 Ų187163.8 Ų163.887%0.87489%0.89SS**PPolyproline II helixtrans-87.2143.1172.5-80.4175.3-25.900110.9
165P61.8Low46.2Very low124 Ų124156.7 Ų156.781%0.80589%0.885SS**PPolyproline II helixtrans-88.5154.7171.933.2-27.8000112.5
166Q46.9Very low46.6Very low272 Ų272164.5 Ų164.5100%1.27190%0.9SS**  trans-66.70169.5-79.4-174.211.300112.1

Retrieved 166 of 166 residues in 27.7 ms (Link to these results)