A0A087WVP2_HUMAN Loading...

FERM domain containing 5

AlphaFold DB , UniProt , Accession A0A087WVP2, Species HUMAN (Homo sapiens, Human), Gene FRMD5, Length 336 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
1M53.3Low60.5Low100 Ų100100.3 Ų100.349%0.49347%0.472SS..  0-430-93.6-166-107.900112.9W3 I4 L5 L49 C52M1-W3 VanDerWaalsContact C-N 3.28Å; M1-W3 PolarHBondContact O-N 3.25Å; M1-I4 PolarHBondContact O-N 3.47Å; M1-I4 VanDerWaalsContact O-N 3.16Å; M1-L5 HydrophobicContact CB-CD1 4.38Å; M1-L5 PolarHBondContact O-N 3.41Å; M1-L5 VanDerWaalsContact O-N 3.17Å; M1-L49 HydrophobicContact CE-CB 3.9Å; M1-L49 HydrophobicContact CE-CD1 3.44Å; M1-L49 VanDerWaalsContact CE-CD1 3.44Å; M1-L49 HydrophobicContact CE-CG 4.26Å; M1-L49 HydrophobicContact CG-CD1 3.33Å; M1-L49 HydrophobicContact SD-CD1 3.27Å; M1-L49 WeakPolarHBondContact SD-CD1 3.46Å; M1-L49 HydrophobicContact SD-CG 4.5Å; M1-C52 HydrophobicContact CE-CB 3.99Å; M1-C52 HydrophobicContact SD-CB 3.69Å
2E48Very low62.8Low157 Ų15792.6 Ų92.673%0.73444%0.436SS*.Hα-helixtrans-52.6-40.6-179.2-73.9-168.3130.400114.1I4 L5 T6E2-I4 PolarHBondContact O-N 3.45Å; E2-L5 PolarHBondContact O-N 3.18Å; E2-T6 WeakPolarHBondContact O-CB 3.36Å; E2-T6 VanDerWaalsContact O-CG2 3.27Å; E2-T6 WeakPolarHBondContact O-CG2 3.5Å; E2-T6 PolarHBondContact O-N 3.23Å; E2-T6 PolarHBondContact O-OG1 2.91Å
3W52Low64.7Low201 Ų20191.1 Ų91.176%0.76144%0.437SS*.Hα-helixtrans-64.3-39.7178.9-66.192000114.2M1 T6 H7M1-W3 VanDerWaalsContact C-N 3.28Å; M1-W3 PolarHBondContact O-N 3.25Å; W3-T6 WeakPolarHBondContact CA-OG1 3.5Å; W3-T6 PolarHBondContact O-OG1 3.44Å; W3-T6 VanDerWaalsContact O-OG1 3.12Å; W3-H7 PolarHBondContact O-N 2.71Å
4I56.3Low66.5Low51 Ų5191.6 Ų91.626%0.26244%0.436SS..Hα-helixtrans-71.6-40.2180-65.6171.6000110.2M1 E2 V8 L24 Y38M1-I4 PolarHBondContact O-N 3.47Å; M1-I4 VanDerWaalsContact O-N 3.16Å; E2-I4 PolarHBondContact O-N 3.45Å; I4-V8 WeakPolarHBondContact O-CB 3.35Å; I4-V8 PolarHBondContact O-N 3.23Å; I4-L24 HydrophobicContact CG2-CD2 3.42Å; I4-L24 VanDerWaalsContact CG2-CD2 3.42Å; I4-Y38 HydrophobicContact CD1-CE1 3.95Å; I4-Y38 HydrophobicContact CD1-CE2 4.18Å
5L56.3Low68.1Low31 Ų3186.1 Ų86.116%0.16241%0.41CS..Hα-helixtrans-80.5-17.9-178.1-71.4160.3000113.3M1 E2 R9 N56M1-L5 HydrophobicContact CB-CD1 4.38Å; M1-L5 PolarHBondContact O-N 3.41Å; M1-L5 VanDerWaalsContact O-N 3.17Å; E2-L5 PolarHBondContact O-N 3.18Å; L5-R9 WeakPolarHBondContact O-CB 3.39Å; L5-R9 VanDerWaalsContact O-CG 3.27Å; L5-R9 WeakPolarHBondContact O-CG 3.25Å; L5-R9 PolarHBondContact O-NE 3.09Å; L5-N56 HydrophobicContact CD1-CB 4.12Å; L5-N56 WeakPolarHBondContact CD1-ND2 3.12Å; L5-N56 HydrophobicContact CD2-CB 4.17Å
6T58.9Low69.5Low72 Ų7283.4 Ų83.444%0.44240%0.397SS..Hα-helixtrans-83.6-44.8176.442.80000112.4E2 W3E2-T6 WeakPolarHBondContact O-CB 3.36Å; E2-T6 VanDerWaalsContact O-CG2 3.27Å; E2-T6 WeakPolarHBondContact O-CG2 3.5Å; E2-T6 PolarHBondContact O-N 3.23Å; E2-T6 PolarHBondContact O-OG1 2.91Å; W3-T6 WeakPolarHBondContact CA-OG1 3.5Å; W3-T6 PolarHBondContact O-OG1 3.44Å; W3-T6 VanDerWaalsContact O-OG1 3.12Å
7H58.4Low70.7Confident148 Ų14879.8 Ų79.869%0.68538%0.379SS*.Hα-helixtrans-87.2-33.2-174.9-79.671.7000114.2W3W3-H7 PolarHBondContact O-N 2.71Å
8V62.2Low71.8Confident31 Ų3181.3 Ų81.319%0.18839%0.386CS..SBendtrans-107.97.3-171.8-162.90000111.6I4 N10 E11 V12 V26I4-V8 WeakPolarHBondContact O-CB 3.35Å; I4-V8 PolarHBondContact O-N 3.23Å; V8-N10 VanDerWaalsContact C-N 3.3Å; V8-N10 PolarHBondContact O-N 3.48Å; V8-N10 VanDerWaalsContact O-N 3.07Å; V8-E11 HydrophobicContact CG1-CB 3.82Å; V8-E11 WeakPolarHBondContact O-CA 3.45Å; V8-E11 PolarHBondContact O-N 3.29Å; V8-V12 HydrophobicContact CB-CG2 4.49Å; V8-V12 HydrophobicContact CG1-CG2 4.27Å; V8-V12 WeakPolarHBondContact O-CG2 3.46Å; V8-V12 PolarHBondContact O-N 3.01Å; V8-V12 VanDerWaalsContact O-N 3.14Å; V8-V26 HydrophobicContact CG1-CB 4.24Å; V8-V26 HydrophobicContact CG1-CG1 3.37Å; V8-V26 HydrophobicContact CG1-CG2 3.76Å
9R67.1Low72.7Confident104 Ų10479.4 Ų79.439%0.39239%0.39SS..THydrogen-bonded Turntrans-47.5-46.5-167.8-154.8-179.1-48.216317.4114.7L5L5-R9 WeakPolarHBondContact O-CB 3.39Å; L5-R9 VanDerWaalsContact O-CG 3.27Å; L5-R9 WeakPolarHBondContact O-CG 3.25Å; L5-R9 PolarHBondContact O-NE 3.09Å
10N70.4Confident73.7Confident143 Ų14381 Ų8177%0.76539%0.394SS*.THydrogen-bonded Turntrans-83.3-16.6-175.8-71.1-14.3000112.8V8V8-N10 VanDerWaalsContact C-N 3.3Å; V8-N10 PolarHBondContact O-N 3.48Å; V8-N10 VanDerWaalsContact O-N 3.07Å
11E83.3Confident74.6Confident65 Ų6578.1 Ų78.130%0.30438%0.382SS..THydrogen-bonded Turntrans-93.6-14.7-176.5-57.9-177.3175.900111.6V8 T13 V26 S27V8-E11 HydrophobicContact CG1-CB 3.82Å; V8-E11 WeakPolarHBondContact O-CA 3.45Å; V8-E11 PolarHBondContact O-N 3.29Å; E11-T13 PolarHBondContact O-N 3.18Å; E11-V26 HydrophobicContact CB-CG1 3.55Å; E11-V26 CarbonylContact O-C 3.54Å; E11-V26 WeakPolarHBondContact O-CA 3.4Å; E11-S27 WeakPolarHBondContact CB-O 3.43Å; E11-S27 PolarHBondContact O-N 3.37Å
12V87.2Confident76.5Confident8 Ų873.8 Ų73.85%0.04836%0.36CS..EExtended strand (participates in β ladder)trans-68.7119.7175.8-177.30000111.4V8 L15 L24 Q57 K61V8-V12 HydrophobicContact CB-CG2 4.49Å; V8-V12 HydrophobicContact CG1-CG2 4.27Å; V8-V12 WeakPolarHBondContact O-CG2 3.46Å; V8-V12 PolarHBondContact O-N 3.01Å; V8-V12 VanDerWaalsContact O-N 3.14Å; V12-L15 HydrophobicContact CG1-CD2 3.77Å; V12-L15 HydrophobicContact CG1-CG 4.27Å; V12-L24 HydrophobicContact CB-CD1 4.26Å; V12-L24 HydrophobicContact CG1-CD1 3.52Å; V12-L24 HydrophobicContact CG2-CD1 3.74Å; V12-Q57 PolarHBondContact O-NE2 2.92Å; V12-K61 PolarHBondContact O-NZ 3.06Å
13T87.8Confident78.6Confident73 Ų7369.2 Ų69.245%0.44834%0.337SS..EExtended strand (participates in β ladder)trans-100.9-44.218054.80000112.9E11 Y25E11-T13 PolarHBondContact O-N 3.18Å; T13-Y25 PolarHBondContact N-O 2.79Å; T13-Y25 WeakPolarHBondContact OG1-CB 3.46Å; T13-Y25 PolarHBondContact OG1-O 2.79Å
14K89.4Confident80.5Confident98 Ų9859.9 Ų59.943%0.42630%0.302SS..EExtended strand (participates in β ladder)trans-147.4147.4-176.1-174.3175.4-178.3176.90111.3Y25K14-Y25 HydrophobicContact CB-CD2 3.83Å; K14-Y25 HydrophobicContact CB-CG 4.05Å; K14-Y25 HydrophobicContact CD-CD2 4.43Å; K14-Y25 HydrophobicContact CD-CE2 4.49Å; K14-Y25 HydrophobicContact CG-CD2 4.1Å; K14-Y25 HydrophobicContact CG-CE2 4.48Å; K14-Y25 PolarHBondContact N-O 2.86Å; K14-Y25 WeakPolarHBondContact O-CB 3.23Å; K14-Y25 WeakPolarHBondContact O-CD2 3.44Å; K14-Y25 PolarHBondContact O-N 2.86Å
15L90.5Very high82.1Confident9 Ų960.6 Ų60.65%0.04730%0.302CS..EExtended strand (participates in β ladder)trans-121.6128.9173.8-57.8-179.6000109.2V12 F22 L24 W50 I54V12-L15 HydrophobicContact CG1-CD2 3.77Å; V12-L15 HydrophobicContact CG1-CG 4.27Å; L15-F22 HydrophobicContact CB-CE2 4.34Å; L15-F22 HydrophobicContact CD2-CE2 4.36Å; L15-F22 HydrophobicContact CD2-CZ 3.75Å; L15-L24 HydrophobicContact CD2-CD1 3.22Å; L15-L24 HydrophobicContact CD2-CG 4.47Å; L15-W50 PolarHBondContact O-NE1 2.93Å; L15-I54 HydrophobicContact CB-CD1 4.04Å; L15-I54 HydrophobicContact CD1-CD1 3.95Å; L15-I54 HydrophobicContact CD1-CG1 4.33Å; L15-I54 HydrophobicContact CG-CD1 4.38Å
16K90.8Very high83.7Confident44 Ų4459.5 Ų59.519%0.19130%0.296CS..EExtended strand (participates in β ladder)trans-132.6151174.6-163.8-160.4178.6-155.10108.7E18 F22 Y23 Y25 S73K16-E18 IonicContact NZ-OE2 2.72Å; K16-E18 PolarHBondContact NZ-OE2 3.31Å; K16-F22 WeakPolarHBondContact O-CD2 3.43Å; K16-Y23 HydrophobicContact CB-CD2 4.4Å; K16-Y23 HydrophobicContact CD-CD2 4.4Å; K16-Y23 PolarHBondContact N-O 2.82Å; K16-Y23 PolarHBondContact O-N 2.78Å; K16-Y25 HydrophobicContact CB-CE2 4.14Å; K16-S73 VanDerWaalsContact CG-O 3.22Å; K16-S73 WeakPolarHBondContact CG-O 3.42Å
17F90.5Very high85.1Confident21 Ų2158 Ų589%0.09229%0.289CS..EExtended strand (participates in β ladder)trans-135.5149.8166.786.5-87.9000110.2T21 F22 K47 W50 S73F17-T21 CarbonylContact C-O 3.52Å; F17-T21 VanDerWaalsContact CA-O 3.28Å; F17-T21 WeakPolarHBondContact CA-O 3.44Å; F17-F22 HydrophobicContact CB-CD2 4.31Å; F17-K47 HydrophobicContact CE1-CB 4.34Å; F17-K47 HydrophobicContact CE1-CG 4.16Å; F17-K47 HydrophobicContact CE2-CB 3.95Å; F17-K47 HydrophobicContact CE2-CG 4.43Å; F17-K47 HydrophobicContact CZ-CB 3.82Å; F17-K47 HydrophobicContact CZ-CD 4.29Å; F17-K47 HydrophobicContact CZ-CG 3.8Å; F17-W50 HydrophobicContact CB-CB 4.1Å; F17-W50 HydrophobicContact CB-CG 4.38Å; F17-W50 HydrophobicContact CD1-CB 3.67Å; F17-W50 AromaticContact CD1-CD2 3.56Å; F17-W50 HydrophobicContact CD1-CD2 3.56Å; F17-W50 AromaticContact CD1-CE3 3.83Å; F17-W50 HydrophobicContact CD1-CE3 3.83Å; F17-W50 AromaticContact CD1-CG 3.49Å; F17-W50 HydrophobicContact CD1-CG 3.49Å; F17-W50 VanDerWaalsContact CD1-CG 3.49Å; F17-W50 HydrophobicContact CE1-CB 4.45Å; F17-W50 AromaticContact CE1-CD2 3.83Å; F17-W50 HydrophobicContact CE1-CD2 3.83Å; F17-W50 AromaticContact CE1-CE3 3.6Å; F17-W50 HydrophobicContact CE1-CE3 3.6Å; F17-W50 HydrophobicContact CE1-CG 4.22Å; F17-W50 HydrophobicContact CE1-CZ3 4.09Å; F17-W50 HydrophobicContact CG-CB 4.15Å; F17-W50 HydrophobicContact CG-CG 4.33Å; F17-S73 VanDerWaalsContact CD1-CB 3.46Å
18E90.2Very high86.3Confident107 Ų10754.9 Ų54.950%0.527%0.274SS..EExtended strand (participates in β ladder)trans-145.7110.7-179.7-165.7166.2157.500108.9K16 K20 T21 Y23K16-E18 IonicContact NZ-OE2 2.72Å; K16-E18 PolarHBondContact NZ-OE2 3.31Å; E18-K20 PolarHBondContact O-N 3.13Å; E18-K20 VanDerWaalsContact O-N 3.13Å; E18-T21 PolarHBondContact N-O 2.82Å; E18-T21 WeakPolarHBondContact O-CB 3.28Å; E18-T21 PolarHBondContact O-N 3.42Å; E18-Y23 HydrophobicContact CB-CE2 4.03Å
19G89.3Confident87Confident45 Ų4563 Ų6346%0.46431%0.307SS..THydrogen-bonded Turntrans55.4-118.7-172.300000111.6T21 P43 C46G19-T21 VanDerWaalsContact C-N 3.35Å; G19-P43 WeakPolarHBondContact O-CA 3.43Å; G19-C46 WeakPolarHBondContact O-CB 3.39Å
20K93Very high87.5Confident111 Ų11164.2 Ų64.248%0.48332%0.317SS..THydrogen-bonded Turntrans-88.3-0.3178.5-64.6-171.5-177.2-163.70113.8E18 F39 A40 P41 P43E18-K20 PolarHBondContact O-N 3.13Å; E18-K20 VanDerWaalsContact O-N 3.13Å; K20-F39 WeakPolarHBondContact O-CA 3.3Å; K20-A40 WeakPolarHBondContact CB-O 3.45Å; K20-A40 PolarHBondContact O-N 3.46Å; K20-P41 WeakPolarHBondContact CE-O 3.18Å; K20-P41 PolarHBondContact NZ-O 3.32Å; K20-P43 HydrophobicContact CG-CB 4.44Å
21T92.6Very high87.5Confident22 Ų2265.7 Ų65.714%0.13532%0.319CS..EExtended strand (participates in β ladder)trans-105.8129.7-172.1-48.40000110.8F17 E18 G19 Y23 T37 Y38 F39 C46F17-T21 CarbonylContact C-O 3.52Å; F17-T21 VanDerWaalsContact CA-O 3.28Å; F17-T21 WeakPolarHBondContact CA-O 3.44Å; E18-T21 PolarHBondContact N-O 2.82Å; E18-T21 WeakPolarHBondContact O-CB 3.28Å; E18-T21 PolarHBondContact O-N 3.42Å; G19-T21 VanDerWaalsContact C-N 3.35Å; T21-Y23 HydrophobicContact CG2-CD2 4.47Å; T21-Y23 HydrophobicContact CG2-CE1 4.03Å; T21-Y23 HydrophobicContact CG2-CE2 3.83Å; T21-T37 HydrophobicContact CG2-CG2 3.43Å; T21-T37 VanDerWaalsContact CG2-CG2 3.43Å; T21-Y38 CarbonylContact C-O 3.57Å; T21-Y38 WeakPolarHBondContact CA-O 3.25Å; T21-F39 HydrophobicContact CG2-CD1 4.13Å; T21-F39 HydrophobicContact CG2-CE1 3.77Å; T21-F39 HydrophobicContact CG2-CZ 4.28Å; T21-F39 WeakPolarHBondContact OG1-CE1 3.24Å; T21-C46 PolarHBondContact O-SG 3.13Å; T21-C46 VanDerWaalsContact O-SG 3.42Å
22F92.3Very high87.4Confident9 Ų968.3 Ų68.34%0.03933%0.33CS..EExtended strand (participates in β ladder)trans-110.8129.8176.3176.8-109.6000109.8L15 K16 F17 L24 T37 Y38 L49 W50L15-F22 HydrophobicContact CB-CE2 4.34Å; L15-F22 HydrophobicContact CD2-CE2 4.36Å; L15-F22 HydrophobicContact CD2-CZ 3.75Å; K16-F22 WeakPolarHBondContact O-CD2 3.43Å; F17-F22 HydrophobicContact CB-CD2 4.31Å; F22-L24 HydrophobicContact CE1-CB 4.08Å; F22-T37 WeakPolarHBondContact O-CA 3.5Å; F22-Y38 AromaticContact CD1-CD2 3.83Å; F22-Y38 HydrophobicContact CD1-CD2 3.83Å; F22-Y38 HydrophobicContact CD1-CG 4.47Å; F22-Y38 HydrophobicContact CE1-CD2 4.4Å; F22-Y38 PolarHBondContact N-O 2.84Å; F22-Y38 PolarHBondContact O-N 3.2Å; F22-L49 HydrophobicContact CB-CD2 3.93Å; F22-L49 HydrophobicContact CD1-CD2 3.79Å; F22-L49 HydrophobicContact CD1-CG 4.11Å; F22-L49 HydrophobicContact CD2-CD2 4.38Å; F22-L49 HydrophobicContact CD2-CG 4.18Å; F22-L49 HydrophobicContact CE1-CD1 4.32Å; F22-L49 HydrophobicContact CE1-CD2 4.35Å; F22-L49 HydrophobicContact CE1-CG 4.24Å; F22-L49 HydrophobicContact CE2-CG 4.32Å; F22-L49 HydrophobicContact CG-CD2 3.79Å; F22-L49 HydrophobicContact CG-CG 4.06Å; F22-L49 HydrophobicContact CZ-CD1 4.48Å; F22-L49 HydrophobicContact CZ-CG 4.32Å; F22-W50 HydrophobicContact CD2-CB 4.17Å; F22-W50 HydrophobicContact CE2-CB 4.02Å
23Y91.9Very high87.4Confident61 Ų6176.4 Ų76.424%0.23936%0.364CS..EExtended strand (participates in β ladder)trans-113.1123.5179.3-57.1-87.6000110.1K16 E18 T21 I35 T37K16-Y23 HydrophobicContact CB-CD2 4.4Å; K16-Y23 HydrophobicContact CD-CD2 4.4Å; K16-Y23 PolarHBondContact N-O 2.82Å; K16-Y23 PolarHBondContact O-N 2.78Å; E18-Y23 HydrophobicContact CB-CE2 4.03Å; T21-Y23 HydrophobicContact CG2-CD2 4.47Å; T21-Y23 HydrophobicContact CG2-CE1 4.03Å; T21-Y23 HydrophobicContact CG2-CE2 3.83Å; Y23-I35 HydrophobicContact CD1-CG2 4.19Å; Y23-T37 HydrophobicContact CD1-CG2 4.29Å; Y23-T37 HydrophobicContact CE1-CG2 4.04Å
24L91.8Very high87.5Confident4 Ų476.3 Ų76.32%0.02136%0.361CS..EExtended strand (participates in β ladder)trans-113.5112.4177.9172.566.4000108.7I4 V12 L15 F22 V26 L36 Y38I4-L24 HydrophobicContact CG2-CD2 3.42Å; I4-L24 VanDerWaalsContact CG2-CD2 3.42Å; V12-L24 HydrophobicContact CB-CD1 4.26Å; V12-L24 HydrophobicContact CG1-CD1 3.52Å; V12-L24 HydrophobicContact CG2-CD1 3.74Å; L15-L24 HydrophobicContact CD2-CD1 3.22Å; L15-L24 HydrophobicContact CD2-CG 4.47Å; F22-L24 HydrophobicContact CE1-CB 4.08Å; L24-V26 HydrophobicContact CD2-CG2 4.25Å; L24-V26 HydrophobicContact CG-CG2 3.88Å; L24-L36 HydrophobicContact CB-CB 4.13Å; L24-L36 HydrophobicContact CD2-CB 4.36Å; L24-L36 HydrophobicContact CD2-CD1 3.91Å; L24-L36 HydrophobicContact CG-CB 4.48Å; L24-L36 PolarHBondContact N-O 2.9Å; L24-L36 PolarHBondContact O-N 3.45Å; L24-Y38 HydrophobicContact CB-CE2 4.2Å; L24-Y38 HydrophobicContact CD2-CE2 4.05Å
25Y91Very high87.6Confident67 Ų6776 Ų7626%0.26336%0.363SS..EExtended strand (participates in β ladder)trans-92.7118.8178.4-62.9-99.9000109.2T13 K14 K16 I35T13-Y25 PolarHBondContact N-O 2.79Å; T13-Y25 WeakPolarHBondContact OG1-CB 3.46Å; T13-Y25 PolarHBondContact OG1-O 2.79Å; K14-Y25 HydrophobicContact CB-CD2 3.83Å; K14-Y25 HydrophobicContact CB-CG 4.05Å; K14-Y25 HydrophobicContact CD-CD2 4.43Å; K14-Y25 HydrophobicContact CD-CE2 4.49Å; K14-Y25 HydrophobicContact CG-CD2 4.1Å; K14-Y25 HydrophobicContact CG-CE2 4.48Å; K14-Y25 PolarHBondContact N-O 2.86Å; K14-Y25 WeakPolarHBondContact O-CB 3.23Å; K14-Y25 WeakPolarHBondContact O-CD2 3.44Å; K14-Y25 PolarHBondContact O-N 2.86Å; K16-Y25 HydrophobicContact CB-CE2 4.14Å; Y25-I35 HydrophobicContact CD1-CD1 4.05Å; Y25-I35 HydrophobicContact CD1-CG1 3.77Å; Y25-I35 HydrophobicContact CE1-CD1 3.62Å; Y25-I35 HydrophobicContact CE1-CG1 3.84Å; Y25-I35 HydrophobicContact CE1-CG2 4.41Å
26V89.9Confident87.6Confident7 Ų778.3 Ų78.34%0.04238%0.375CS..EExtended strand (participates in β ladder)trans-117131.6-177.7-175.40000109V8 E11 L24 K33 I34 L36V8-V26 HydrophobicContact CG1-CB 4.24Å; V8-V26 HydrophobicContact CG1-CG1 3.37Å; V8-V26 HydrophobicContact CG1-CG2 3.76Å; E11-V26 HydrophobicContact CB-CG1 3.55Å; E11-V26 CarbonylContact O-C 3.54Å; E11-V26 WeakPolarHBondContact O-CA 3.4Å; L24-V26 HydrophobicContact CD2-CG2 4.25Å; L24-V26 HydrophobicContact CG-CG2 3.88Å; V26-K33 WeakPolarHBondContact O-CA 3.47Å; V26-I34 PolarHBondContact N-O 3.06Å; V26-I34 PolarHBondContact O-N 2.86Å; V26-L36 HydrophobicContact CG2-CD1 4Å
27S87.7Confident87.7Confident41 Ų4179.3 Ų79.329%0.28739%0.385SS..EExtended strand (participates in β ladder)trans-104.4115.4171.4-171.30000108.8E11E11-S27 WeakPolarHBondContact CB-O 3.43Å; E11-S27 PolarHBondContact O-N 3.37Å
28Q83.4Confident87.8Confident83 Ų8382.2 Ų82.239%0.38840%0.396SS..  trans-84.6164.2173.8-155.5179.44700110.4E30 E31 K32Q28-E30 PolarHBondContact O-N 2.85Å; Q28-E30 VanDerWaalsContact O-N 3.1Å; Q28-E31 PolarHBondContact O-N 2.84Å; Q28-E31 VanDerWaalsContact O-N 3.17Å; Q28-K32 PolarHBondContact N-O 2.99Å
29K76.1Confident88Confident202 Ų20284.6 Ų84.688%0.87840%0.404SS*.THydrogen-bonded Turntrans-57.8-21.2-178.2-69.1-177.9179178.60115.1E31K29-E31 VanDerWaalsContact C-N 3.31Å; K29-E31 PolarHBondContact O-N 2.96Å
30E78.9Confident88.2Confident129 Ų12983.2 Ų83.260%0.60339%0.388SS*.THydrogen-bonded Turntrans-91.725.2177.7-62.1-179.6175.200113.2Q28 K32Q28-E30 PolarHBondContact O-N 2.85Å; Q28-E30 VanDerWaalsContact O-N 3.1Å; E30-K32 HydrophobicContact CB-CD 4.36Å; E30-K32 HydrophobicContact CB-CG 4.42Å; E30-K32 PolarHBondContact O-N 3.43Å; E30-K32 WeakPolarHBondContact OE2-CE 3.49Å; E30-K32 IonicContact OE2-NZ 2.71Å; E30-K32 PolarHBondContact OE2-NZ 3.23Å
31E69.4Low88.2Confident173 Ų17382.9 Ų82.981%0.80840%0.397SS*.SBendtrans56.72.6-172.9-63.1-167.1160.200116.1Q28 K29 K33Q28-E31 PolarHBondContact O-N 2.84Å; Q28-E31 VanDerWaalsContact O-N 3.17Å; K29-E31 VanDerWaalsContact C-N 3.31Å; K29-E31 PolarHBondContact O-N 2.96Å; E31-K33 PolarHBondContact O-N 3.06Å
32K81.4Confident88.3Confident121 Ų12184.6 Ų84.653%0.52641%0.408SS..  trans-66.5119.4174.2-69.8172.5-176.81600109.5Q28 E30Q28-K32 PolarHBondContact N-O 2.99Å; E30-K32 HydrophobicContact CB-CD 4.36Å; E30-K32 HydrophobicContact CB-CG 4.42Å; E30-K32 PolarHBondContact O-N 3.43Å; E30-K32 WeakPolarHBondContact OE2-CE 3.49Å; E30-K32 IonicContact OE2-NZ 2.71Å; E30-K32 PolarHBondContact OE2-NZ 3.23Å
33K87.8Confident88.3Confident177 Ų17786.5 Ų86.577%0.7742%0.421SS*.EExtended strand (participates in β ladder)trans-89.3114.8173.6-66.6175.7-175.6168.70108.8V26 E31V26-K33 WeakPolarHBondContact O-CA 3.47Å; E31-K33 PolarHBondContact O-N 3.06Å
34I90.1Very high88.3Confident72 Ų7289.8 Ų89.837%0.36944%0.439SS..EExtended strand (participates in β ladder)trans-102.6133.8176.4-57.7173.2000108V26 L36V26-I34 PolarHBondContact N-O 3.06Å; V26-I34 PolarHBondContact O-N 2.86Å; I34-L36 HydrophobicContact CG2-CD2 3.96Å; I34-L36 HydrophobicContact CG2-CG 4.21Å
35I91.3Very high88.4Confident92 Ų9291.4 Ų91.447%0.47245%0.453SS..EExtended strand (participates in β ladder)trans-108.5113.2173.3-54.5176.6000107.3Y23 Y25Y23-I35 HydrophobicContact CD1-CG2 4.19Å; Y25-I35 HydrophobicContact CD1-CD1 4.05Å; Y25-I35 HydrophobicContact CD1-CG1 3.77Å; Y25-I35 HydrophobicContact CE1-CD1 3.62Å; Y25-I35 HydrophobicContact CE1-CG1 3.84Å; Y25-I35 HydrophobicContact CE1-CG2 4.41Å
36L90.6Very high88.5Confident57 Ų5788.2 Ų88.230%0.29844%0.44SS..EExtended strand (participates in β ladder)trans-94.4123.3173.6-59.9172.7000108.4L24 V26 I34 Y38L24-L36 HydrophobicContact CB-CB 4.13Å; L24-L36 HydrophobicContact CD2-CB 4.36Å; L24-L36 HydrophobicContact CD2-CD1 3.91Å; L24-L36 HydrophobicContact CG-CB 4.48Å; L24-L36 PolarHBondContact N-O 2.9Å; L24-L36 PolarHBondContact O-N 3.45Å; V26-L36 HydrophobicContact CG2-CD1 4Å; I34-L36 HydrophobicContact CG2-CD2 3.96Å; I34-L36 HydrophobicContact CG2-CG 4.21Å; L36-Y38 HydrophobicContact CB-CD2 4.47Å; L36-Y38 HydrophobicContact CB-CE2 3.59Å
37T93.6Very high88.6Confident65 Ų6591.8 Ų91.840%0.39946%0.455SS..EExtended strand (participates in β ladder)trans-108.8127.1-179.2-58.90000109.7T21 F22 Y23 F39T21-T37 HydrophobicContact CG2-CG2 3.43Å; T21-T37 VanDerWaalsContact CG2-CG2 3.43Å; F22-T37 WeakPolarHBondContact O-CA 3.5Å; Y23-T37 HydrophobicContact CD1-CG2 4.29Å; Y23-T37 HydrophobicContact CE1-CG2 4.04Å; T37-F39 HydrophobicContact CG2-CE2 4.1Å; T37-F39 HydrophobicContact CG2-CZ 4.01Å
38Y92.3Very high88.8Confident82 Ų8295.3 Ų95.332%0.32247%0.467SS..EExtended strand (participates in β ladder)trans-123.9147.1178.8-59.4-85.5000109.9I4 T21 F22 L24 L36I4-Y38 HydrophobicContact CD1-CE1 3.95Å; I4-Y38 HydrophobicContact CD1-CE2 4.18Å; T21-Y38 CarbonylContact C-O 3.57Å; T21-Y38 WeakPolarHBondContact CA-O 3.25Å; F22-Y38 AromaticContact CD1-CD2 3.83Å; F22-Y38 HydrophobicContact CD1-CD2 3.83Å; F22-Y38 HydrophobicContact CD1-CG 4.47Å; F22-Y38 HydrophobicContact CE1-CD2 4.4Å; F22-Y38 PolarHBondContact N-O 2.84Å; F22-Y38 PolarHBondContact O-N 3.2Å; L24-Y38 HydrophobicContact CB-CE2 4.2Å; L24-Y38 HydrophobicContact CD2-CE2 4.05Å; L36-Y38 HydrophobicContact CB-CD2 4.47Å; L36-Y38 HydrophobicContact CB-CE2 3.59Å
39F94.4Very high89.3Confident157 Ų15793 Ų9369%0.68946%0.457SS*.EExtended strand (participates in β ladder)trans-113.3130.3176.8-62.9-83.3000109.6K20 T21 T37K20-F39 WeakPolarHBondContact O-CA 3.3Å; T21-F39 HydrophobicContact CG2-CD1 4.13Å; T21-F39 HydrophobicContact CG2-CE1 3.77Å; T21-F39 HydrophobicContact CG2-CZ 4.28Å; T21-F39 WeakPolarHBondContact OG1-CE1 3.24Å; T37-F39 HydrophobicContact CG2-CE2 4.1Å; T37-F39 HydrophobicContact CG2-CZ 4.01Å
40A93.8Very high90.1Very high15 Ų1583.4 Ų83.412%0.12442%0.416CS..  trans-100153.1173.900000110.2K20 T42 A45 C46K20-A40 WeakPolarHBondContact CB-O 3.45Å; K20-A40 PolarHBondContact O-N 3.46Å; A40-T42 VanDerWaalsContact C-N 3.29Å; A40-T42 PolarHBondContact O-N 3.47Å; A40-A45 HydrophobicContact CB-CB 4.36Å; A40-C46 HydrophobicContact CB-CB 3.73Å
41P93.1Very high90.7Very high104 Ų10480.6 Ų80.668%0.67540%0.401SS*.SBendtrans-64-35.1179.724.1-33.2000112.6K20K20-P41 WeakPolarHBondContact CE-O 3.18Å; K20-P41 PolarHBondContact NZ-O 3.32Å
42T94Very high91.7Very high59 Ų5973.8 Ų73.836%0.36237%0.372SS..SBendtrans-131.5151.7-179.566.60000111.2A40 E44 A45 C46A40-T42 VanDerWaalsContact C-N 3.29Å; A40-T42 PolarHBondContact O-N 3.47Å; T42-E44 WeakPolarHBondContact CB-OE2 3.47Å; T42-E44 PolarHBondContact O-N 3.05Å; T42-A45 PolarHBondContact O-N 3.09Å; T42-A45 VanDerWaalsContact OG1-CB 3.25Å; T42-A45 WeakPolarHBondContact OG1-CB 3.33Å; T42-A45 PolarHBondContact OG1-N 3.45Å; T42-C46 PolarHBondContact O-N 2.99Å
43P91.1Very high92.2Very high48 Ų4868.2 Ų68.231%0.31235%0.349SS..Hα-helixtrans-66.3-28.1176.926.6-32.6000112.3G19 K20 C46 K47G19-P43 WeakPolarHBondContact O-CA 3.43Å; K20-P43 HydrophobicContact CG-CB 4.44Å; P43-C46 WeakPolarHBondContact O-CB 3.27Å; P43-C46 PolarHBondContact O-N 3.14Å; P43-K47 WeakPolarHBondContact O-CB 3.46Å; P43-K47 PolarHBondContact O-N 3.25Å
44E92.3Very high92.3Very high130 Ų13060 Ų6061%0.60731%0.314SS*.Hα-helixtrans-65.2-44.4174-6270-148.300110.9T42 C46 K47 H48T42-E44 WeakPolarHBondContact CB-OE2 3.47Å; T42-E44 PolarHBondContact O-N 3.05Å; E44-C46 VanDerWaalsContact C-N 3.32Å; E44-C46 PolarHBondContact O-N 2.77Å; E44-K47 PolarHBondContact O-N 3.14Å; E44-H48 WeakPolarHBondContact O-CB 3.49Å; E44-H48 PolarHBondContact O-N 3.42Å
45A94.4Very high92.4Very high38 Ų3860.4 Ų60.431%0.31431%0.314SS..Hα-helixtrans-64.2-39.317500000111.4A40 T42 H48 L49A40-A45 HydrophobicContact CB-CB 4.36Å; T42-A45 PolarHBondContact O-N 3.09Å; T42-A45 VanDerWaalsContact OG1-CB 3.25Å; T42-A45 WeakPolarHBondContact OG1-CB 3.33Å; T42-A45 PolarHBondContact OG1-N 3.45Å; A45-H48 PolarHBondContact O-N 3.33Å; A45-L49 WeakPolarHBondContact O-CB 3.39Å; A45-L49 PolarHBondContact O-N 3.31Å
46C93.2Very high92.3Very high0 Ų058.2 Ų58.20%030%0.303CS..Hα-helixtrans-61.6-46174.6-1630000111.9G19 T21 A40 T42 P43 E44 H48 L49 W50G19-C46 WeakPolarHBondContact O-CB 3.39Å; T21-C46 PolarHBondContact O-SG 3.13Å; T21-C46 VanDerWaalsContact O-SG 3.42Å; A40-C46 HydrophobicContact CB-CB 3.73Å; T42-C46 PolarHBondContact O-N 2.99Å; P43-C46 WeakPolarHBondContact O-CB 3.27Å; P43-C46 PolarHBondContact O-N 3.14Å; E44-C46 VanDerWaalsContact C-N 3.32Å; E44-C46 PolarHBondContact O-N 2.77Å; C46-H48 VanDerWaalsContact C-N 3.34Å; C46-H48 PolarHBondContact O-N 2.89Å; C46-L49 WeakPolarHBondContact O-CB 3.34Å; C46-L49 PolarHBondContact O-N 2.88Å; C46-W50 PolarHBondContact O-N 3.36Å
47K92.3Very high92.2Very high82 Ų8257.7 Ų57.736%0.35730%0.3SS..Hα-helixtrans-61.6-41.6175.6-179.9179.1178.5179.10111.5F17 P43 E44 W50 K51 S81F17-K47 HydrophobicContact CE1-CB 4.34Å; F17-K47 HydrophobicContact CE1-CG 4.16Å; F17-K47 HydrophobicContact CE2-CB 3.95Å; F17-K47 HydrophobicContact CE2-CG 4.43Å; F17-K47 HydrophobicContact CZ-CB 3.82Å; F17-K47 HydrophobicContact CZ-CD 4.29Å; F17-K47 HydrophobicContact CZ-CG 3.8Å; P43-K47 WeakPolarHBondContact O-CB 3.46Å; P43-K47 PolarHBondContact O-N 3.25Å; E44-K47 PolarHBondContact O-N 3.14Å; K47-W50 PolarHBondContact O-N 3.36Å; K47-K51 WeakPolarHBondContact O-CG 3.37Å; K47-K51 PolarHBondContact O-N 3.34Å; K47-S81 VanDerWaalsContact CE-OG 3.3Å; K47-S81 WeakPolarHBondContact CE-OG 3.4Å
48H92.4Very high92Very high116 Ų11654.9 Ų54.954%0.53728%0.283SS..Hα-helixtrans-62.8-47.8175.8-175.8-98.1000111.4E44 A45 C46 W50 K51 C52E44-H48 WeakPolarHBondContact O-CB 3.49Å; E44-H48 PolarHBondContact O-N 3.42Å; A45-H48 PolarHBondContact O-N 3.33Å; C46-H48 VanDerWaalsContact C-N 3.34Å; C46-H48 PolarHBondContact O-N 2.89Å; H48-W50 VanDerWaalsContact C-N 3.28Å; H48-W50 PolarHBondContact O-N 3.33Å; H48-K51 WeakPolarHBondContact O-CB 3.27Å; H48-K51 PolarHBondContact O-N 2.89Å; H48-K51 VanDerWaalsContact O-N 3.09Å; H48-C52 PolarHBondContact CE1-SG 3.16Å; H48-C52 PolarHBondContact O-N 3.47Å; H48-C52 PolarHBondContact O-SG 3.17Å; H48-C52 VanDerWaalsContact O-SG 3.34Å
49L92.3Very high91.9Very high35 Ų3553.7 Ų53.718%0.18328%0.279CS..Hα-helixtrans-53.6-45.3173.4165.361.3000112.1M1 F22 A45 C46 G53M1-L49 HydrophobicContact CE-CB 3.9Å; M1-L49 HydrophobicContact CE-CD1 3.44Å; M1-L49 VanDerWaalsContact CE-CD1 3.44Å; M1-L49 HydrophobicContact CE-CG 4.26Å; M1-L49 HydrophobicContact CG-CD1 3.33Å; M1-L49 HydrophobicContact SD-CD1 3.27Å; M1-L49 WeakPolarHBondContact SD-CD1 3.46Å; M1-L49 HydrophobicContact SD-CG 4.5Å; F22-L49 HydrophobicContact CB-CD2 3.93Å; F22-L49 HydrophobicContact CD1-CD2 3.79Å; F22-L49 HydrophobicContact CD1-CG 4.11Å; F22-L49 HydrophobicContact CD2-CD2 4.38Å; F22-L49 HydrophobicContact CD2-CG 4.18Å; F22-L49 HydrophobicContact CE1-CD1 4.32Å; F22-L49 HydrophobicContact CE1-CD2 4.35Å; F22-L49 HydrophobicContact CE1-CG 4.24Å; F22-L49 HydrophobicContact CE2-CG 4.32Å; F22-L49 HydrophobicContact CG-CD2 3.79Å; F22-L49 HydrophobicContact CG-CG 4.06Å; F22-L49 HydrophobicContact CZ-CD1 4.48Å; F22-L49 HydrophobicContact CZ-CG 4.32Å; A45-L49 WeakPolarHBondContact O-CB 3.39Å; A45-L49 PolarHBondContact O-N 3.31Å; C46-L49 WeakPolarHBondContact O-CB 3.34Å; C46-L49 PolarHBondContact O-N 2.88Å; L49-G53 PolarHBondContact O-N 3.49Å
50W92.5Very high91.6Very high0 Ų051.5 Ų51.50%027%0.267CS..Hα-helixtrans-62.4-46.1175.2173.578.7000112.6L15 F17 F22 C46 K47 H48 G53 I54 V71 S81 F83L15-W50 PolarHBondContact O-NE1 2.93Å; F17-W50 HydrophobicContact CB-CB 4.1Å; F17-W50 HydrophobicContact CB-CG 4.38Å; F17-W50 HydrophobicContact CD1-CB 3.67Å; F17-W50 AromaticContact CD1-CD2 3.56Å; F17-W50 HydrophobicContact CD1-CD2 3.56Å; F17-W50 AromaticContact CD1-CE3 3.83Å; F17-W50 HydrophobicContact CD1-CE3 3.83Å; F17-W50 AromaticContact CD1-CG 3.49Å; F17-W50 HydrophobicContact CD1-CG 3.49Å; F17-W50 VanDerWaalsContact CD1-CG 3.49Å; F17-W50 HydrophobicContact CE1-CB 4.45Å; F17-W50 AromaticContact CE1-CD2 3.83Å; F17-W50 HydrophobicContact CE1-CD2 3.83Å; F17-W50 AromaticContact CE1-CE3 3.6Å; F17-W50 HydrophobicContact CE1-CE3 3.6Å; F17-W50 HydrophobicContact CE1-CG 4.22Å; F17-W50 HydrophobicContact CE1-CZ3 4.09Å; F17-W50 HydrophobicContact CG-CB 4.15Å; F17-W50 HydrophobicContact CG-CG 4.33Å; F22-W50 HydrophobicContact CD2-CB 4.17Å; F22-W50 HydrophobicContact CE2-CB 4.02Å; C46-W50 PolarHBondContact O-N 3.36Å; K47-W50 PolarHBondContact O-N 3.36Å; H48-W50 VanDerWaalsContact C-N 3.28Å; H48-W50 PolarHBondContact O-N 3.33Å; W50-G53 PolarHBondContact O-N 2.85Å; W50-I54 HydrophobicContact CD2-CG1 4.34Å; W50-I54 HydrophobicContact CZ2-CG1 4.28Å; W50-I54 WeakPolarHBondContact O-CG1 3.37Å; W50-I54 PolarHBondContact O-N 2.99Å; W50-V71 WeakPolarHBondContact CH2-O 3.46Å; W50-V71 HydrophobicContact CZ2-CB 4.23Å; W50-V71 HydrophobicContact CZ2-CG1 4.03Å; W50-S81 WeakPolarHBondContact CH2-O 3.49Å; W50-S81 WeakPolarHBondContact CZ3-OG 3.3Å; W50-F83 HydrophobicContact CE3-CB 4.48Å; W50-F83 HydrophobicContact CH2-CB 3.55Å; W50-F83 HydrophobicContact CZ3-CB 3.48Å; W50-F83 VanDerWaalsContact CZ3-CB 3.48Å; W50-F83 HydrophobicContact CZ3-CG 4.49Å
51K92.4Very high91.2Very high69 Ų6955.4 Ų55.430%0.328%0.282SS..Hα-helixtrans-58.2-51.5176.4-72.9-179.7178.8-174.90111.7K47 H48 G53 I54 E55 F83K47-K51 WeakPolarHBondContact O-CG 3.37Å; K47-K51 PolarHBondContact O-N 3.34Å; H48-K51 WeakPolarHBondContact O-CB 3.27Å; H48-K51 PolarHBondContact O-N 2.89Å; H48-K51 VanDerWaalsContact O-N 3.09Å; K51-G53 PolarHBondContact O-N 2.98Å; K51-I54 PolarHBondContact O-N 3.23Å; K51-E55 WeakPolarHBondContact O-CG 3.41Å; K51-E55 PolarHBondContact O-N 2.67Å; K51-F83 HydrophobicContact CB-CD2 4.47Å; K51-F83 HydrophobicContact CB-CE2 4.49Å; K51-F83 HydrophobicContact CD-CD2 4.02Å; K51-F83 HydrophobicContact CD-CE2 4.26Å; K51-F83 HydrophobicContact CG-CB 4.42Å; K51-F83 HydrophobicContact CG-CD2 3.85Å; K51-F83 HydrophobicContact CG-CE2 4.27Å; K51-F83 HydrophobicContact CG-CG 4.01Å
52C91.5Very high90.8Very high30 Ų3052.8 Ų52.820%0.20326%0.262CS..Hα-helixtrans-56.6-41.2177.4-650000111.6M1 H48 I54 E55 N56M1-C52 HydrophobicContact CE-CB 3.99Å; M1-C52 HydrophobicContact SD-CB 3.69Å; H48-C52 PolarHBondContact CE1-SG 3.16Å; H48-C52 PolarHBondContact O-N 3.47Å; H48-C52 PolarHBondContact O-SG 3.17Å; H48-C52 VanDerWaalsContact O-SG 3.34Å; C52-I54 PolarHBondContact O-N 2.95Å; C52-E55 PolarHBondContact O-N 3.45Å; C52-N56 WeakPolarHBondContact O-CB 3.39Å; C52-N56 PolarHBondContact O-N 3.49Å
53G90.7Very high90.4Very high4 Ų454.9 Ų54.94%0.04127%0.267CS..Hα-helixtrans-61.6-42175.500000113L49 W50 K51 Q57L49-G53 PolarHBondContact O-N 3.49Å; W50-G53 PolarHBondContact O-N 2.85Å; K51-G53 PolarHBondContact O-N 2.98Å; G53-Q57 WeakPolarHBondContact O-CB 3.34Å; G53-Q57 PolarHBondContact O-N 3.38Å
54I91.1Very high90.1Very high6 Ų658.1 Ų58.13%0.03128%0.276CS..Hα-helixtrans-67.6-43.4176.9-63.4-65000111.5L15 W50 K51 C52 N56 Q57 A58 V71 F83L15-I54 HydrophobicContact CB-CD1 4.04Å; L15-I54 HydrophobicContact CD1-CD1 3.95Å; L15-I54 HydrophobicContact CD1-CG1 4.33Å; L15-I54 HydrophobicContact CG-CD1 4.38Å; W50-I54 HydrophobicContact CD2-CG1 4.34Å; W50-I54 HydrophobicContact CZ2-CG1 4.28Å; W50-I54 WeakPolarHBondContact O-CG1 3.37Å; W50-I54 PolarHBondContact O-N 2.99Å; K51-I54 PolarHBondContact O-N 3.23Å; C52-I54 PolarHBondContact O-N 2.95Å; I54-N56 VanDerWaalsContact C-N 3.34Å; I54-N56 PolarHBondContact O-N 3.24Å; I54-Q57 PolarHBondContact O-N 2.97Å; I54-A58 WeakPolarHBondContact O-CB 3.4Å; I54-A58 PolarHBondContact O-N 2.91Å; I54-V71 HydrophobicContact CD1-CB 3.96Å; I54-V71 HydrophobicContact CD1-CG1 3.72Å; I54-V71 HydrophobicContact CD1-CG2 3.99Å; I54-V71 HydrophobicContact CG1-CB 4.45Å; I54-V71 HydrophobicContact CG2-CB 4.38Å; I54-V71 HydrophobicContact CG2-CG2 4Å; I54-F83 HydrophobicContact CB-CD1 3.93Å; I54-F83 HydrophobicContact CB-CE1 4.26Å; I54-F83 HydrophobicContact CG2-CD1 3.65Å; I54-F83 HydrophobicContact CG2-CE1 4.01Å
55E91.3Very high89.8Confident80 Ų8054.2 Ų54.237%0.37426%0.263SS..Hα-helixtrans-58.6-47.4176-67.7175.4168.400111K51 C52 Q57 A58 F59 F83 Y85K51-E55 WeakPolarHBondContact O-CG 3.41Å; K51-E55 PolarHBondContact O-N 2.67Å; C52-E55 PolarHBondContact O-N 3.45Å; E55-Q57 VanDerWaalsContact C-N 3.32Å; E55-Q57 PolarHBondContact O-N 2.83Å; E55-A58 PolarHBondContact O-N 3.48Å; E55-F59 WeakPolarHBondContact O-CB 3.49Å; E55-F59 PolarHBondContact O-N 3.12Å; E55-F83 HydrophobicContact CG-CE1 3.5Å; E55-F83 VanDerWaalsContact CG-CE1 3.5Å; E55-F83 HydrophobicContact CG-CZ 3.47Å; E55-F83 VanDerWaalsContact CG-CZ 3.47Å; E55-F83 WeakPolarHBondContact OE1-CZ 3.46Å; E55-Y85 HydrophobicContact CB-CD2 4.07Å; E55-Y85 HydrophobicContact CB-CE2 4.46Å; E55-Y85 HydrophobicContact CG-CD2 4.06Å
56N89.6Confident89.2Confident46 Ų4657 Ų5725%0.24628%0.281CS..Hα-helixtrans-66.3-37.4-179.6-138.242.5000111.8L5 C52 I54 Y60L5-N56 HydrophobicContact CD1-CB 4.12Å; L5-N56 WeakPolarHBondContact CD1-ND2 3.12Å; L5-N56 HydrophobicContact CD2-CB 4.17Å; C52-N56 WeakPolarHBondContact O-CB 3.39Å; C52-N56 PolarHBondContact O-N 3.49Å; I54-N56 VanDerWaalsContact C-N 3.34Å; I54-N56 PolarHBondContact O-N 3.24Å; N56-Y60 WeakPolarHBondContact O-CD2 3.47Å; N56-Y60 PolarHBondContact O-N 3.49Å; N56-Y60 VanDerWaalsContact O-N 3.11Å; N56-Y60 WeakPolarHBondContact OD1-CE2 3.44Å
57Q87.9Confident88.7Confident46 Ų4661.9 Ų61.922%0.21530%0.304CS..Hα-helixtrans-64.7-45.1174-169.2177.143.300111.1V12 G53 I54 E55 K61V12-Q57 PolarHBondContact O-NE2 2.92Å; G53-Q57 WeakPolarHBondContact O-CB 3.34Å; G53-Q57 PolarHBondContact O-N 3.38Å; I54-Q57 PolarHBondContact O-N 2.97Å; E55-Q57 VanDerWaalsContact C-N 3.32Å; E55-Q57 PolarHBondContact O-N 2.83Å; Q57-K61 HydrophobicContact CG-CB 4.23Å; Q57-K61 HydrophobicContact CG-CD 3.99Å; Q57-K61 WeakPolarHBondContact O-CA 3.06Å; Q57-K61 WeakPolarHBondContact O-CB 3.39Å; Q57-K61 PolarHBondContact O-N 3.3Å
58A89.9Confident88.3Confident6 Ų658.6 Ų58.65%0.0529%0.29CS..Hα-helixtrans-63.5-45.117800000111.8I54 E55 L62 V68 Y85 V89I54-A58 WeakPolarHBondContact O-CB 3.4Å; I54-A58 PolarHBondContact O-N 2.91Å; E55-A58 PolarHBondContact O-N 3.48Å; A58-L62 HydrophobicContact CB-CD1 4.23Å; A58-L62 WeakPolarHBondContact O-CB 3.38Å; A58-V68 HydrophobicContact CB-CG1 4.4Å; A58-V68 HydrophobicContact CB-CG2 4.31Å; A58-Y85 HydrophobicContact CB-CD1 3.66Å; A58-Y85 HydrophobicContact CB-CD2 4.09Å; A58-Y85 HydrophobicContact CB-CE1 4.31Å; A58-Y85 HydrophobicContact CB-CG 3.52Å; A58-V89 WeakPolarHBondContact O-CG1 3.49Å
59F89.9Confident87.9Confident56 Ų5663 Ų6325%0.24630%0.302CS..Hα-helixtrans-65-45.5-177.3-178-106.4000112.9E55 R88 A90 V93E55-F59 WeakPolarHBondContact O-CB 3.49Å; E55-F59 PolarHBondContact O-N 3.12Å; F59-R88 WeakPolarHBondContact CD2-O 3.21Å; F59-A90 HydrophobicContact CD1-CB 3.98Å; F59-A90 HydrophobicContact CD2-CB 4.44Å; F59-A90 HydrophobicContact CE1-CB 3.67Å; F59-A90 HydrophobicContact CE2-CB 4.14Å; F59-A90 HydrophobicContact CG-CB 4.37Å; F59-A90 HydrophobicContact CZ-CB 3.75Å; F59-A90 WeakPolarHBondContact O-CB 3.43Å; F59-A90 PolarHBondContact O-N 3.03Å; F59-V93 HydrophobicContact CE2-CG2 4.49Å
60Y87.6Confident87.6Confident112 Ų11262.9 Ų62.944%0.43930%0.303SS..Hα-helixtrans-96.4-28.5-173.4-69.3-65.4000114.9N56 A90N56-Y60 WeakPolarHBondContact O-CD2 3.47Å; N56-Y60 PolarHBondContact O-N 3.49Å; N56-Y60 VanDerWaalsContact O-N 3.11Å; N56-Y60 WeakPolarHBondContact OD1-CE2 3.44Å; Y60-A90 HydrophobicContact CD1-CB 4.04Å; Y60-A90 HydrophobicContact CE1-CB 4.39Å
61K85.6Confident87.3Confident97 Ų9764.6 Ų64.642%0.42231%0.313SS..Hα-helixtrans-91.7-30.2-172.5-160.6174.1-177.2176.60113V12 Q57V12-K61 PolarHBondContact O-NZ 3.06Å; Q57-K61 HydrophobicContact CG-CB 4.23Å; Q57-K61 HydrophobicContact CG-CD 3.99Å; Q57-K61 WeakPolarHBondContact O-CA 3.06Å; Q57-K61 WeakPolarHBondContact O-CB 3.39Å; Q57-K61 PolarHBondContact O-N 3.3Å
62L85.6Confident86.9Confident49 Ų4963.7 Ų63.726%0.25732%0.315SS..  trans-90.1149.9-176.2-60175.8000111.6A58 V68 V89A58-L62 HydrophobicContact CB-CD1 4.23Å; A58-L62 WeakPolarHBondContact O-CB 3.38Å; L62-V68 HydrophobicContact CD1-CB 4.08Å; L62-V68 HydrophobicContact CD1-CG2 3.44Å; L62-V68 VanDerWaalsContact CD1-CG2 3.44Å; L62-V89 HydrophobicContact CB-CG1 4.4Å
63E85.1Confident86.1Confident103 Ų10362.5 Ų62.548%0.48131%0.308SS..SBendtrans-86.5-33.2180-53.8-159.7133.700112.8V89 K91E63-V89 WeakPolarHBondContact O-CG2 3.22Å; E63-K91 HydrophobicContact CB-CD 4.17Å; E63-K91 HydrophobicContact CG-CD 4.11Å; E63-K91 IonicContact OE1-NZ 3.89Å; E63-K91 PolarHBondContact OE1-NZ 3.35Å
64K84.9Confident85.1Confident116 Ų11664.1 Ų64.150%0.50432%0.318SS..  trans-133.5143.1-179.6-62-177.3-178.6-179.90110.4S66 Q67 E92K64-S66 PolarHBondContact O-N 3.26Å; K64-Q67 HydrophobicContact CB-CG 4.3Å; K64-Q67 PolarHBondContact O-N 3.32Å; K64-Q67 VanDerWaalsContact O-N 3.14Å; K64-E92 WeakPolarHBondContact CA-OE1 3.27Å
65S85.4Confident83.6Confident47 Ų4770 Ų7033%0.32935%0.35SS..G310 helixtrans-59.9-28172.954.10000112.5Q67 V68 G87 E92S65-Q67 VanDerWaalsContact C-N 3.3Å; S65-Q67 PolarHBondContact O-N 3.49Å; S65-V68 VanDerWaalsContact O-CB 3.28Å; S65-V68 WeakPolarHBondContact O-CB 3.35Å; S65-V68 WeakPolarHBondContact O-CG2 3.29Å; S65-V68 PolarHBondContact O-N 3.29Å; S65-G87 VanDerWaalsContact CB-O 3.24Å; S65-G87 WeakPolarHBondContact CB-O 3.39Å; S65-E92 WeakPolarHBondContact CB-OE1 3.14Å; S65-E92 WeakPolarHBondContact CB-OE2 3.26Å; S65-E92 PolarHBondContact N-OE1 3.32Å; S65-E92 PolarHBondContact OG-OE1 2.94Å; S65-E92 PolarHBondContact OG-OE2 3.37Å
66S82Confident81.7Confident98 Ų9872.8 Ų72.869%0.68537%0.366SS*.G310 helixtrans-68.6-23.5176.560.60000114.3K64 V68K64-S66 PolarHBondContact O-N 3.26Å; S66-V68 PolarHBondContact O-N 2.81Å
67Q82.3Confident79.9Confident102 Ų10279.1 Ų79.148%0.47739%0.392SS..G310 helixtrans-81.2-6.8178.6-65.6172.6-900112.6K64 S65 R69K64-Q67 HydrophobicContact CB-CG 4.3Å; K64-Q67 PolarHBondContact O-N 3.32Å; K64-Q67 VanDerWaalsContact O-N 3.14Å; S65-Q67 VanDerWaalsContact C-N 3.3Å; S65-Q67 PolarHBondContact O-N 3.49Å; Q67-R69 PolarHBondContact O-N 3.14Å
68V84.3Confident78.2Confident12 Ų1287 Ų877%0.07343%0.426CS..  trans-69103.9-179.1178.80000109.6A58 L62 S65 S66 Y85A58-V68 HydrophobicContact CB-CG1 4.4Å; A58-V68 HydrophobicContact CB-CG2 4.31Å; L62-V68 HydrophobicContact CD1-CB 4.08Å; L62-V68 HydrophobicContact CD1-CG2 3.44Å; L62-V68 VanDerWaalsContact CD1-CG2 3.44Å; S65-V68 VanDerWaalsContact O-CB 3.28Å; S65-V68 WeakPolarHBondContact O-CB 3.35Å; S65-V68 WeakPolarHBondContact O-CG2 3.29Å; S65-V68 PolarHBondContact O-N 3.29Å; S66-V68 PolarHBondContact O-N 2.81Å; V68-Y85 HydrophobicContact CG1-CD1 4.21Å; V68-Y85 HydrophobicContact CG1-CG 4.45Å; V68-Y85 HydrophobicContact CG2-CD1 3.91Å
69R84.1Confident76.9Confident208 Ų20896 Ų9679%0.78546%0.464SS*.PPolyproline II helixtrans-77.6149.417063.2-177-69.6155.9-1.3111.3Q67 V71Q67-R69 PolarHBondContact O-N 3.14Å; R69-V71 PolarHBondContact O-N 3.07Å
70T85.2Confident75.8Confident33 Ų3395 Ų9520%0.20247%0.469CS..PPolyproline II helixtrans-68132.5169.4-51.60000109.7R82 F83 R84T70-R82 VanDerWaalsContact CB-NH2 3.26Å; T70-R82 HydrophobicContact CG2-CB 4.02Å; T70-R82 HydrophobicContact CG2-CG 3.93Å; T70-R82 VanDerWaalsContact CG2-CZ 3.46Å; T70-R82 PolarHBondContact OG1-NH2 2.87Å; T70-F83 WeakPolarHBondContact CG2-O 3.37Å; T70-R84 HydrophobicContact CG2-CB 4.08Å
71V86.1Confident75.3Confident37 Ų3790.5 Ų90.522%0.22445%0.454CS..EExtended strand (participates in β ladder)trans-103.5136.5179.4-167.60000109.1W50 I54 R69 R82 F83W50-V71 WeakPolarHBondContact CH2-O 3.46Å; W50-V71 HydrophobicContact CZ2-CB 4.23Å; W50-V71 HydrophobicContact CZ2-CG1 4.03Å; I54-V71 HydrophobicContact CD1-CB 3.96Å; I54-V71 HydrophobicContact CD1-CG1 3.72Å; I54-V71 HydrophobicContact CD1-CG2 3.99Å; I54-V71 HydrophobicContact CG1-CB 4.45Å; I54-V71 HydrophobicContact CG2-CB 4.38Å; I54-V71 HydrophobicContact CG2-CG2 4Å; R69-V71 PolarHBondContact O-N 3.07Å; V71-R82 WeakPolarHBondContact O-CA 3.44Å; V71-F83 PolarHBondContact N-O 3.45Å; V71-F83 PolarHBondContact O-N 3.17Å
72S84.3Confident75.3Confident49 Ų4994.1 Ų94.134%0.34347%0.465SS..EExtended strand (participates in β ladder)trans-108.6136.9176.7-176.20000109.6S74S72-S74 PolarHBondContact O-N 3.18Å; S72-S74 PolarHBondContact OG-N 2.89Å; S72-S74 PolarHBondContact OG-O 3.31Å
73S75.9Confident75.5Confident5 Ų593.4 Ų93.44%0.03546%0.46CS..SBendtrans-67.6-23.7173.468.40000113K16 F17 S81K16-S73 VanDerWaalsContact CG-O 3.22Å; K16-S73 WeakPolarHBondContact CG-O 3.42Å; F17-S73 VanDerWaalsContact CD1-CB 3.46Å; S73-S81 PolarHBondContact N-O 3.47Å; S73-S81 PolarHBondContact OG-N 3.14Å; S73-S81 PolarHBondContact OG-O 3.1Å
74S68.4Low75.7Confident38 Ų3896 Ų9627%0.26647%0.465SS..  trans-132.2147.9-170.8-51.20000111.2S72S72-S74 PolarHBondContact O-N 3.18Å; S72-S74 PolarHBondContact OG-N 2.89Å; S72-S74 PolarHBondContact OG-O 3.31Å
75N59.7Low75.9Confident129 Ų12992.1 Ų92.169%0.6945%0.448SS*.SBendtrans-84.9-9.2175.8-65.7-27.6000113
76L51.6Low76.1Confident139 Ų13995 Ų9573%0.72847%0.468SS*.SBendtrans-90.8120.8177.6-12779.7000109.8F78L76-F78 PolarHBondContact O-N 2.82Å
77F52.3Low76.4Confident179 Ų17992.4 Ų92.479%0.78546%0.457SS*.THydrogen-bonded Turntrans-50.6128.7174.6-54.4-90.5000109.3
78F52.1Low76.7Confident211 Ų21195.5 Ų95.593%0.92546%0.464SS*.THydrogen-bonded Turntrans86.6-19171.2-47.4-73.8000120.8L76L76-F78 PolarHBondContact O-N 2.82Å
79K62Low77.1Confident197 Ų19795 Ų9586%0.85746%0.461SS*.SBendtrans-116.338.8179.8-146.3173.9-177.6177.80113.9
80G67.4Low77.4Confident33 Ų3385.8 Ų85.834%0.3443%0.43SS..SBendtrans-129.4154.4-176.800000113.1R82G80-R82 PolarHBondContact O-N 3.13Å
81S77.4Confident77.5Confident19 Ų1989 Ų8913%0.13344%0.441CS..  trans-78.1115.9169.4174.60000108.9K47 W50 S73K47-S81 VanDerWaalsContact CE-OG 3.3Å; K47-S81 WeakPolarHBondContact CE-OG 3.4Å; W50-S81 WeakPolarHBondContact CH2-O 3.49Å; W50-S81 WeakPolarHBondContact CZ3-OG 3.3Å; S73-S81 PolarHBondContact N-O 3.47Å; S73-S81 PolarHBondContact OG-N 3.14Å; S73-S81 PolarHBondContact OG-O 3.1Å
82R85.1Confident77.7Confident173 Ų17389.2 Ų89.265%0.65344%0.439SS*.EExtended strand (participates in β ladder)trans-94.9140.5168-97.2175.475120.5-4.8110.2T70 V71 G80T70-R82 VanDerWaalsContact CB-NH2 3.26Å; T70-R82 HydrophobicContact CG2-CB 4.02Å; T70-R82 HydrophobicContact CG2-CG 3.93Å; T70-R82 VanDerWaalsContact CG2-CZ 3.46Å; T70-R82 PolarHBondContact OG1-NH2 2.87Å; V71-R82 WeakPolarHBondContact O-CA 3.44Å; G80-R82 PolarHBondContact O-N 3.13Å
83F88.8Confident78Confident33 Ų3389.2 Ų89.215%0.14544%0.437CS..EExtended strand (participates in β ladder)trans-138.8131.1174.9-179-102.6000110W50 K51 I54 E55 T70 V71W50-F83 HydrophobicContact CE3-CB 4.48Å; W50-F83 HydrophobicContact CH2-CB 3.55Å; W50-F83 HydrophobicContact CZ3-CB 3.48Å; W50-F83 VanDerWaalsContact CZ3-CB 3.48Å; W50-F83 HydrophobicContact CZ3-CG 4.49Å; K51-F83 HydrophobicContact CB-CD2 4.47Å; K51-F83 HydrophobicContact CB-CE2 4.49Å; K51-F83 HydrophobicContact CD-CD2 4.02Å; K51-F83 HydrophobicContact CD-CE2 4.26Å; K51-F83 HydrophobicContact CG-CB 4.42Å; K51-F83 HydrophobicContact CG-CD2 3.85Å; K51-F83 HydrophobicContact CG-CE2 4.27Å; K51-F83 HydrophobicContact CG-CG 4.01Å; I54-F83 HydrophobicContact CB-CD1 3.93Å; I54-F83 HydrophobicContact CB-CE1 4.26Å; I54-F83 HydrophobicContact CG2-CD1 3.65Å; I54-F83 HydrophobicContact CG2-CE1 4.01Å; E55-F83 HydrophobicContact CG-CE1 3.5Å; E55-F83 VanDerWaalsContact CG-CE1 3.5Å; E55-F83 HydrophobicContact CG-CZ 3.47Å; E55-F83 VanDerWaalsContact CG-CZ 3.47Å; E55-F83 WeakPolarHBondContact OE1-CZ 3.46Å; T70-F83 WeakPolarHBondContact CG2-O 3.37Å; V71-F83 PolarHBondContact N-O 3.45Å; V71-F83 PolarHBondContact O-N 3.17Å
84R89.6Confident78.6Confident158 Ų15895.6 Ų95.660%0.59647%0.468SS*.  trans-119.4124.2174.8-174.7180-176.8-175.1-0.9107.1T70T70-R84 HydrophobicContact CG2-CB 4.08Å
85Y90.4Very high79.6Confident34 Ų3499 Ų9913%0.13348%0.48CS..  trans-68.4134.8171.7169.4-94.2000109.7E55 A58 V68 G87 R88 V89E55-Y85 HydrophobicContact CB-CD2 4.07Å; E55-Y85 HydrophobicContact CB-CE2 4.46Å; E55-Y85 HydrophobicContact CG-CD2 4.06Å; A58-Y85 HydrophobicContact CB-CD1 3.66Å; A58-Y85 HydrophobicContact CB-CD2 4.09Å; A58-Y85 HydrophobicContact CB-CE1 4.31Å; A58-Y85 HydrophobicContact CB-CG 3.52Å; V68-Y85 HydrophobicContact CG1-CD1 4.21Å; V68-Y85 HydrophobicContact CG1-CG 4.45Å; V68-Y85 HydrophobicContact CG2-CD1 3.91Å; Y85-G87 WeakPolarHBondContact CE1-O 3.34Å; Y85-R88 PolarHBondContact OH-O 3.21Å; Y85-V89 HydrophobicContact CE1-CG1 4.18Å
86S88.2Confident80.9Confident108 Ų10895.1 Ų95.176%0.75546%0.463SS*.  trans-126.2117.2177.1-72.20000108.3
87G89.7Confident82.6Confident43 Ų4391.5 Ų91.544%0.44345%0.449SS..SBendtrans152.4174.6-179.200000112.2S65 Y85S65-G87 VanDerWaalsContact CB-O 3.24Å; S65-G87 WeakPolarHBondContact CB-O 3.39Å; Y85-G87 WeakPolarHBondContact CE1-O 3.34Å
88R88.9Confident84.2Confident168 Ų16887 Ų8763%0.63444%0.444SS*.  trans-75.6144.1172.5-66.7-173.3-67.1-141.3-0.3110.2F59 Y85 E92 V93F59-R88 WeakPolarHBondContact CD2-O 3.21Å; Y85-R88 PolarHBondContact OH-O 3.21Å; R88-E92 VanDerWaalsContact CA-OE2 3.31Å; R88-E92 WeakPolarHBondContact CA-OE2 3.25Å; R88-E92 HydrophobicContact CB-CB 4.49Å; R88-V93 HydrophobicContact CB-CG2 3.87Å
89V92.6Very high85.8Confident0 Ų083.8 Ų83.80%043%0.43CS..  trans-87.6162.2173.8-60.40000110.9A58 L62 E63 Y85 K91 E92 V93A58-V89 WeakPolarHBondContact O-CG1 3.49Å; L62-V89 HydrophobicContact CB-CG1 4.4Å; E63-V89 WeakPolarHBondContact O-CG2 3.22Å; Y85-V89 HydrophobicContact CE1-CG1 4.18Å; V89-K91 VanDerWaalsContact C-N 3.26Å; V89-K91 PolarHBondContact O-N 3.47Å; V89-E92 HydrophobicContact CG2-CB 4.17Å; V89-E92 HydrophobicContact CG2-CG 3.65Å; V89-E92 PolarHBondContact N-OE2 2.9Å; V89-E92 VanDerWaalsContact N-OE2 3.09Å; V89-E92 PolarHBondContact O-N 3.25Å; V89-E92 VanDerWaalsContact O-N 3.09Å; V89-V93 WeakPolarHBondContact O-CG2 3.41Å; V89-V93 PolarHBondContact O-N 3.46Å
90A89.6Confident86.8Confident16 Ų1678 Ų7813%0.13241%0.408CS..Hα-helixtrans-55-41-176.200000112.4F59 Y60 E92 V93 M94F59-A90 HydrophobicContact CD1-CB 3.98Å; F59-A90 HydrophobicContact CD2-CB 4.44Å; F59-A90 HydrophobicContact CE1-CB 3.67Å; F59-A90 HydrophobicContact CE2-CB 4.14Å; F59-A90 HydrophobicContact CG-CB 4.37Å; F59-A90 HydrophobicContact CZ-CB 3.75Å; F59-A90 WeakPolarHBondContact O-CB 3.43Å; F59-A90 PolarHBondContact O-N 3.03Å; Y60-A90 HydrophobicContact CD1-CB 4.04Å; Y60-A90 HydrophobicContact CE1-CB 4.39Å; A90-E92 PolarHBondContact O-N 3.16Å; A90-V93 PolarHBondContact O-N 3.28Å; A90-M94 VanDerWaalsContact O-CG 3.31Å; A90-M94 WeakPolarHBondContact O-CG 3.19Å; A90-M94 PolarHBondContact O-N 3.49Å
91K88.3Confident87.5Confident101 Ų10186.3 Ų86.344%0.43944%0.435SS..Hα-helixtrans-62.2-43.7178-67.2-154.2-171.2-176.10112.4E63 V89 V93 M94 E95E63-K91 HydrophobicContact CB-CD 4.17Å; E63-K91 HydrophobicContact CG-CD 4.11Å; E63-K91 IonicContact OE1-NZ 3.89Å; E63-K91 PolarHBondContact OE1-NZ 3.35Å; V89-K91 VanDerWaalsContact C-N 3.26Å; V89-K91 PolarHBondContact O-N 3.47Å; K91-V93 VanDerWaalsContact C-N 3.33Å; K91-V93 PolarHBondContact O-N 3.24Å; K91-M94 PolarHBondContact O-N 2.88Å; K91-E95 WeakPolarHBondContact O-CB 3.44Å; K91-E95 PolarHBondContact O-N 2.98Å
92E90Very high87.6Confident40 Ų4094.2 Ų94.219%0.18746%0.461CS..Hα-helixtrans-64.6-38.6176.2-67.6171.7168.500111.6K64 S65 R88 V89 A90 E95 S96K64-E92 WeakPolarHBondContact CA-OE1 3.27Å; S65-E92 WeakPolarHBondContact CB-OE1 3.14Å; S65-E92 WeakPolarHBondContact CB-OE2 3.26Å; S65-E92 PolarHBondContact N-OE1 3.32Å; S65-E92 PolarHBondContact OG-OE1 2.94Å; S65-E92 PolarHBondContact OG-OE2 3.37Å; R88-E92 VanDerWaalsContact CA-OE2 3.31Å; R88-E92 WeakPolarHBondContact CA-OE2 3.25Å; R88-E92 HydrophobicContact CB-CB 4.49Å; V89-E92 HydrophobicContact CG2-CB 4.17Å; V89-E92 HydrophobicContact CG2-CG 3.65Å; V89-E92 PolarHBondContact N-OE2 2.9Å; V89-E92 VanDerWaalsContact N-OE2 3.09Å; V89-E92 PolarHBondContact O-N 3.25Å; V89-E92 VanDerWaalsContact O-N 3.09Å; A90-E92 PolarHBondContact O-N 3.16Å; E92-E95 PolarHBondContact O-N 3.34Å; E92-S96 VanDerWaalsContact O-CB 3.3Å; E92-S96 WeakPolarHBondContact O-CB 3.36Å; E92-S96 PolarHBondContact O-N 2.89Å; E92-S96 PolarHBondContact O-OG 3.09Å
93V90.4Very high87.3Confident49 Ų4994.6 Ų94.630%0.29747%0.471SS..Hα-helixtrans-64.7-43.1175.6175.40000110.7F59 R88 V89 A90 K91 S96 S97F59-V93 HydrophobicContact CE2-CG2 4.49Å; R88-V93 HydrophobicContact CB-CG2 3.87Å; V89-V93 WeakPolarHBondContact O-CG2 3.41Å; V89-V93 PolarHBondContact O-N 3.46Å; A90-V93 PolarHBondContact O-N 3.28Å; K91-V93 VanDerWaalsContact C-N 3.33Å; K91-V93 PolarHBondContact O-N 3.24Å; V93-S96 WeakPolarHBondContact CA-OG 3.34Å; V93-S96 PolarHBondContact O-OG 3.43Å; V93-S97 VanDerWaalsContact O-CB 3.26Å; V93-S97 WeakPolarHBondContact O-CB 3.38Å; V93-S97 PolarHBondContact O-N 2.96Å; V93-S97 PolarHBondContact O-OG 3.34Å
94M88.1Confident86.8Confident140 Ų14098.6 Ų98.669%0.6950%0.5SS*.Hα-helixtrans-65.5-45176.2-71.7179.768.200111.9A90 K91 S97 A98A90-M94 VanDerWaalsContact O-CG 3.31Å; A90-M94 WeakPolarHBondContact O-CG 3.19Å; A90-M94 PolarHBondContact O-N 3.49Å; K91-M94 PolarHBondContact O-N 2.88Å; M94-S97 PolarHBondContact O-N 3.28Å; M94-A98 WeakPolarHBondContact O-CB 3.2Å; M94-A98 PolarHBondContact O-N 3.02Å
95E89.5Confident86.5Confident110 Ų11096.1 Ų96.151%0.51450%0.504SS..Hα-helixtrans-64.9-43.7179.6-166.2-165.4149.500111.8K91 E92 S97 A98 K99K91-E95 WeakPolarHBondContact O-CB 3.44Å; K91-E95 PolarHBondContact O-N 2.98Å; E92-E95 PolarHBondContact O-N 3.34Å; E95-S97 VanDerWaalsContact C-N 3.33Å; E95-S97 PolarHBondContact O-N 3.35Å; E95-A98 PolarHBondContact O-N 2.86Å; E95-K99 WeakPolarHBondContact O-CG 3.44Å; E95-K99 PolarHBondContact O-N 3.1Å; E95-K99 WeakPolarHBondContact OE1-CE 3.02Å; E95-K99 IonicContact OE1-NZ 2.72Å; E95-K99 PolarHBondContact OE1-NZ 2.89Å
96S86.8Confident85.8Confident47 Ų47102.1 Ų102.133%0.32953%0.534SS..Hα-helixtrans-64.3-38.2174.854.90000111.9E92 V93 K99 I100E92-S96 VanDerWaalsContact O-CB 3.3Å; E92-S96 WeakPolarHBondContact O-CB 3.36Å; E92-S96 PolarHBondContact O-N 2.89Å; E92-S96 PolarHBondContact O-OG 3.09Å; V93-S96 WeakPolarHBondContact CA-OG 3.34Å; V93-S96 PolarHBondContact O-OG 3.43Å; S96-K99 PolarHBondContact O-N 3.37Å; S96-I100 VanDerWaalsContact O-CG1 3.31Å; S96-I100 WeakPolarHBondContact O-CG1 3.41Å
97S86.9Confident85.3Confident62 Ų62102.5 Ų102.543%0.43453%0.526SS..Hα-helixtrans-66.6-37.8176.1-60.20000112.4V93 M94 E95 K99 I100V93-S97 VanDerWaalsContact O-CB 3.26Å; V93-S97 WeakPolarHBondContact O-CB 3.38Å; V93-S97 PolarHBondContact O-N 2.96Å; V93-S97 PolarHBondContact O-OG 3.34Å; M94-S97 PolarHBondContact O-N 3.28Å; E95-S97 VanDerWaalsContact C-N 3.33Å; E95-S97 PolarHBondContact O-N 3.35Å; S97-K99 PolarHBondContact O-N 3.42Å; S97-I100 WeakPolarHBondContact O-CB 3.33Å; S97-I100 WeakPolarHBondContact O-CG1 3.22Å; S97-I100 PolarHBondContact O-N 2.98Å; S97-I100 VanDerWaalsContact O-N 3.12Å
98A86.3Confident84.7Confident84 Ų84107.4 Ų107.469%0.69454%0.537SS*.Hα-helixtrans-66.2-25.417700000112.9M94 E95 I100M94-A98 WeakPolarHBondContact O-CB 3.2Å; M94-A98 PolarHBondContact O-N 3.02Å; E95-A98 PolarHBondContact O-N 2.86Å; A98-I100 VanDerWaalsContact C-N 3.26Å; A98-I100 PolarHBondContact O-N 2.93Å
99K84.8Confident84.1Confident144 Ų144109.3 Ų109.363%0.62654%0.544SS*.THydrogen-bonded Turntrans-77-12.2175.3-68.5169.9-171.81740112.9E95 S96 S97 K101E95-K99 WeakPolarHBondContact O-CG 3.44Å; E95-K99 PolarHBondContact O-N 3.1Å; E95-K99 WeakPolarHBondContact OE1-CE 3.02Å; E95-K99 IonicContact OE1-NZ 2.72Å; E95-K99 PolarHBondContact OE1-NZ 2.89Å; S96-K99 PolarHBondContact O-N 3.37Å; S97-K99 PolarHBondContact O-N 3.42Å; K99-K101 PolarHBondContact O-N 3.46Å
100I84.3Confident82.9Confident76 Ų76113.7 Ų113.739%0.3958%0.581SS.*  trans-82101-179.3-43.5178.5000109.1S96 S97 A98 R102S96-I100 VanDerWaalsContact O-CG1 3.31Å; S96-I100 WeakPolarHBondContact O-CG1 3.41Å; S97-I100 WeakPolarHBondContact O-CB 3.33Å; S97-I100 WeakPolarHBondContact O-CG1 3.22Å; S97-I100 PolarHBondContact O-N 2.98Å; S97-I100 VanDerWaalsContact O-N 3.12Å; A98-I100 VanDerWaalsContact C-N 3.26Å; A98-I100 PolarHBondContact O-N 2.93Å; I100-R102 VanDerWaalsContact CD1-NH2 3.27Å; I100-R102 HydrophobicContact CG2-CG 3.62Å; I100-R102 PolarHBondContact O-N 3.02Å
101K81.1Confident81.6Confident208 Ų208116.4 Ų116.490%0.90461%0.61SS**  trans-80.1100.5169.2-64.8-175.9179.9-177.10108.4K99K99-K101 PolarHBondContact O-N 3.46Å
102R79.4Confident80.2Confident184 Ų184119.9 Ų119.969%0.69463%0.63SS**  trans-107.8133.1168.5-50.7-167.8-179.899.2-5.9107.7I100I100-R102 VanDerWaalsContact CD1-NH2 3.27Å; I100-R102 HydrophobicContact CG2-CG 3.62Å; I100-R102 PolarHBondContact O-N 3.02Å
103E79.1Confident78.8Confident182 Ų182123.7 Ų123.785%0.8566%0.656SS**PPolyproline II helixtrans-62.9137.2167.8-70.8-170.7170.900108.8
104P79.8Confident77Confident117 Ų117126.8 Ų126.876%0.7668%0.677SS**PPolyproline II helixtrans-51.8131.6175.2-24.633.4000109.5E106P104-E106 PolarHBondContact O-N 2.79Å
105P81.3Confident75.3Confident106 Ų106124.5 Ų124.569%0.68867%0.674SS**PPolyproline II helixtrans-59.6133.6177.424.2-32.1000108.8I107P105-I107 VanDerWaalsContact C-N 3.32Å; P105-I107 WeakPolarHBondContact O-CG1 3.45Å; P105-I107 PolarHBondContact O-N 3.2Å
106E77Confident73.8Confident159 Ų159131.6 Ų131.674%0.74370%0.696SS**  trans-72.591.8176.6-161.5173.1-163.800108.7P104 H108P104-E106 PolarHBondContact O-N 2.79Å; E106-H108 VanDerWaalsContact C-N 3.32Å; E106-H108 VanDerWaalsContact CG-CE1 3.47Å; E106-H108 WeakPolarHBondContact CG-CE1 3.38Å; E106-H108 PolarHBondContact O-N 3.44Å; E106-H108 PolarHBondContact O-ND1 3.29Å; E106-H108 IonicContact OE1-CE1 3.85Å; E106-H108 IonicContact OE1-NE2 2.69Å; E106-H108 IonicContact OE2-CE1 3.7Å; E106-H108 PolarHBondContact OE2-CE1 2.84Å
107I78.1Confident72.1Confident116 Ų116133.8 Ų133.860%0.59571%0.712SS**  trans-76.291178.2-49.1179.4000107.7P105 R109P105-I107 VanDerWaalsContact C-N 3.32Å; P105-I107 WeakPolarHBondContact O-CG1 3.45Å; P105-I107 PolarHBondContact O-N 3.2Å; I107-R109 HydrophobicContact CG2-CG 3.56Å; I107-R109 PolarHBondContact O-N 2.83Å
108H76.1Confident70Confident146 Ų146135.9 Ų135.968%0.67673%0.725SS**  trans-69.782.5163.1-6991.9000108.6E106 A110E106-H108 VanDerWaalsContact C-N 3.32Å; E106-H108 VanDerWaalsContact CG-CE1 3.47Å; E106-H108 WeakPolarHBondContact CG-CE1 3.38Å; E106-H108 PolarHBondContact O-N 3.44Å; E106-H108 PolarHBondContact O-ND1 3.29Å; E106-H108 IonicContact OE1-CE1 3.85Å; E106-H108 IonicContact OE1-NE2 2.69Å; E106-H108 IonicContact OE2-CE1 3.7Å; E106-H108 PolarHBondContact OE2-CE1 2.84Å; H108-A110 VanDerWaalsContact C-N 3.3Å; H108-A110 PolarHBondContact O-N 3.39Å
109R76.6Confident68.2Low209 Ų209138.2 Ų138.279%0.78973%0.734SS**  trans-68.997.9163.8-61.1-171.6-178.51691.2105.7I107 G111I107-R109 HydrophobicContact CG2-CG 3.56Å; I107-R109 PolarHBondContact O-N 2.83Å; R109-G111 PolarHBondContact O-N 3.4Å
110A68.4Low66.3Low92 Ų92135.8 Ų135.876%0.7673%0.734SS**  trans-47.8120.4165.200000106.4H108 M112H108-A110 VanDerWaalsContact C-N 3.3Å; H108-A110 PolarHBondContact O-N 3.39Å; A110-M112 PolarHBondContact O-N 2.95Å
111G61.3Low65Low73 Ų73139.4 Ų139.475%0.75375%0.753SS**  trans-51.8104.8-171.500000109.2R109 V113R109-G111 PolarHBondContact O-N 3.4Å; G111-V113 VanDerWaalsContact C-N 3.34Å; G111-V113 PolarHBondContact O-N 2.95Å
112M59.5Low63.3Low173 Ų173135.4 Ų135.485%0.85275%0.746SS**  trans-58.6111.6161.6-94169.160.300104.4A110A110-M112 PolarHBondContact O-N 2.95Å
113V59Low61.5Low121 Ų121135.4 Ų135.473%0.73375%0.754SS**  trans-38.6127167.7177.10000106.8G111 S115G111-V113 VanDerWaalsContact C-N 3.34Å; G111-V113 PolarHBondContact O-N 2.95Å; V113-S115 PolarHBondContact O-N 3Å
114P54.1Low60.1Low114 Ų114129.3 Ų129.374%0.7474%0.74SS**  trans-51.8109177.3-25.933.3000108.4R116P114-R116 PolarHBondContact O-N 3Å; P114-R116 VanDerWaalsContact O-N 3.1Å
115S52.5Low58.6Low91 Ų91129.9 Ų129.964%0.63674%0.744SS**  trans-59.2120.4173.5-88.10000107V113 S117V113-S115 PolarHBondContact O-N 3Å; S115-S117 PolarHBondContact O-N 3.34Å
116R56.8Low56.6Low259 Ų259136.6 Ų136.698%0.97776%0.755SS**THydrogen-bonded Turntrans-70.430.6179.8-70.9-178.7169.1-118.32.1113.1P114P114-R116 PolarHBondContact O-N 3Å; P114-R116 VanDerWaalsContact O-N 3.1Å
117S52.4Low55Low94 Ų94136.9 Ų136.966%0.65776%0.761SS**THydrogen-bonded Turntrans-118.89.8-172.656.10000115.3S115S115-S117 PolarHBondContact O-N 3.34Å
118C42.9Very low53.5Low105 Ų105136.4 Ų136.471%0.70977%0.768SS**SBendtrans-134.6112.2173.5-56.90000110.1S120C118-S120 PolarHBondContact O-N 2.83Å
119P47.2Very low51.9Low134 Ų134135 Ų13587%0.8778%0.775SS**  trans-65.4106.916825.8-28.4000107.9I121P119-I121 PolarHBondContact O-N 2.88Å
120S45.6Very low50.5Low92 Ų92131.3 Ų131.364%0.64378%0.775SS**  trans-42.5124.1166.4163.80000110.2C118 T122C118-S120 PolarHBondContact O-N 2.83Å; S120-T122 VanDerWaalsContact C-N 3.27Å; S120-T122 PolarHBondContact O-N 2.83Å
121I55.7Low49.3Very low152 Ų152132.5 Ų132.578%0.77978%0.775SS**  trans-70.294.6161.9-131.6172.6000105.2P119 H123P119-I121 PolarHBondContact O-N 2.88Å; I121-H123 PolarHBondContact O-N 3.13Å; I121-H123 VanDerWaalsContact O-N 3.13Å
122T46.7Very low49Very low124 Ų124140 Ų14076%0.76178%0.781SS**  trans-63.4114.2171.517.20000107.5S120 G124S120-T122 VanDerWaalsContact C-N 3.27Å; S120-T122 PolarHBondContact O-N 2.83Å; T122-G124 PolarHBondContact O-N 2.93Å
123H42.1Very low48.5Very low184 Ų184138.2 Ų138.285%0.85278%0.78SS**  trans-63.787.2165.8-95-90.3000108.7I121I121-H123 PolarHBondContact O-N 3.13Å; I121-H123 VanDerWaalsContact O-N 3.13Å
124G48Very low47.9Very low55 Ų55142.9 Ų142.957%0.56778%0.784SS**  trans-83.5143.4156.500000109.2T122 R126T122-G124 PolarHBondContact O-N 2.93Å; G124-R126 PolarHBondContact O-N 3.33Å; G124-R126 VanDerWaalsContact O-N 3.13Å
125P48.7Very low47.7Very low129 Ų129149.6 Ų149.684%0.83880%0.795SS**  trans-82.995.7-178.732.3-28.9000108.4
126R40.4Very low47.6Very low247 Ų247156.4 Ų156.493%0.93281%0.806SS**  trans-142.9128.8162.2-75-157.8176.6-174.50.4113.7G124G124-R126 PolarHBondContact O-N 3.33Å; G124-R126 VanDerWaalsContact O-N 3.13Å
127L42.6Very low47.3Very low164 Ų164146.4 Ų146.486%0.85978%0.78SS**  trans-41.4142.9170-59.9158.3000113.6
128S47Very low47.2Very low107 Ų107146.9 Ų146.975%0.74878%0.778SS**  trans28.7114150.564.20000118.9
129S42.1Very low47.3Very low117 Ų117148.8 Ų148.882%0.81878%0.776SS**  165.9131.5119.347.80000110.6
130V46.7Very low47.5Very low131 Ų131148.5 Ų148.579%0.79477%0.766SS**  trans-71.8146.1171.3175.90000109
131P44.5Very low47.9Very low117 Ų117148 Ų14876%0.7676%0.762SS**  -133.6142.1124.714.46.8000114.5T133P131-T133 PolarHBondContact O-N 2.96Å
132R53.6Low47.9Very low229 Ų229145.7 Ų145.786%0.86475%0.751SS**  trans-53.7122164.5-79.5164.4143.578.9-4.1110.2
133T50.5Low48.1Very low136 Ų136145.7 Ų145.783%0.83474%0.743SS**  trans171.687.1143.7430000111.1P131P131-T133 PolarHBondContact O-N 2.96Å
134R46.5Very low48.6Very low219 Ų219143.6 Ų143.683%0.82673%0.734SS**  trans-154.538.5163.3-131.8-179.4-166.6-123.13.7115.3R136R134-R136 PolarHBondContact O-N 2.7Å
135R48.2Very low48.9Very low256 Ų256142.9 Ų142.997%0.96673%0.727SS**THydrogen-bonded Turntrans-78.723.6173.6-79.6-164.5178-137.31.8114.8
136R51.1Low49.2Very low233 Ų233142.2 Ų142.288%0.87972%0.715SS**THydrogen-bonded Turntrans-126-0.6-176.7-128.5-179.1-159.6169.85116.7R134R134-R136 PolarHBondContact O-N 2.7Å
137A51Low49.9Very low50 Ų50137.3 Ų137.341%0.41370%0.703SS.*SBendtrans-96.2-8.1-175.500000115
138V50.1Low50.3Low104 Ų104133.7 Ų133.763%0.6369%0.691SS**THydrogen-bonded Turntrans-84.9-20.8-173.2-175.10000112.7I142V138-I142 HydrophobicContact CG1-CD1 4.43Å
139H44.2Very low50.6Low144 Ų144134.6 Ų134.667%0.66769%0.687SS**THydrogen-bonded Turntrans-85.3-16-173.5-159.4-84.4000114.4
140I51.7Low51.3Low129 Ų129139.4 Ų139.466%0.66269%0.687SS**THydrogen-bonded Turntrans-84.5-34179.5-73.3173.5000111.6I142I140-I142 PolarHBondContact O-N 3.46Å
141S53.7Low51.5Low80 Ų80140.1 Ų140.156%0.55969%0.687SS**Hα-helixtrans-81.7-9.8-173.263.90000115.4
142I56Low51.8Low105 Ų105139 Ų13954%0.53868%0.682SS.*Hα-helixtrans-86.9-31178.6-60.5175.2000110.8V138 I140V138-I142 HydrophobicContact CG1-CD1 4.43Å; I140-I142 PolarHBondContact O-N 3.46Å
143M51.4Low51.7Low123 Ų123132 Ų13261%0.60667%0.673SS**Hα-helixtrans-77.1-39.5-176.1-56.2-168.470.500111.5L146M143-L146 PolarHBondContact O-N 2.95Å
144E53.2Low51.6Low140 Ų140134 Ų13465%0.65467%0.673SS**Hα-helixtrans-73.4-26.8178.7-159.6165.1-166.200112.7L146E144-L146 VanDerWaalsContact C-N 3.34Å; E144-L146 PolarHBondContact O-N 3.19Å
145G54.4Low51.1Low40 Ų40129.5 Ų129.541%0.41267%0.674SS.*Hα-helixtrans-72.5-21.2176.100000114.7
146L53.3Low50.7Low115 Ų115123 Ų12360%0.60266%0.664SS**Hα-helixtrans-87.8-24.4178.5-70.2177.5000113M143 E144M143-L146 PolarHBondContact O-N 2.95Å; E144-L146 VanDerWaalsContact C-N 3.34Å; E144-L146 PolarHBondContact O-N 3.19Å
147E56.2Low50Low145 Ų145118 Ų11868%0.67866%0.661SS**Hα-helixtrans-71-34.3173.1-66.7-173.8155.500111.2L149 R150E147-L149 VanDerWaalsContact C-N 3.27Å; E147-L149 PolarHBondContact O-N 3.39Å; E147-R150 PolarHBondContact O-N 2.77Å
148S50.5Low49.3Very low87 Ų87121.4 Ų121.461%0.60868%0.677SS**THydrogen-bonded Turntrans-67-17.7176.4-177.50000115.1
149L52.6Low48.5Very low126 Ų126127.6 Ų127.666%0.6669%0.689SS**THydrogen-bonded Turntrans-90.5-11.5177.8-72.5171.7000112.9E147E147-L149 VanDerWaalsContact C-N 3.27Å; E147-L149 PolarHBondContact O-N 3.39Å
150R57.1Low47.9Very low218 Ų218126.5 Ų126.582%0.82370%0.697SS**THydrogen-bonded Turntrans-80.3-23.5-178.8-156.8175.3-162.91793.6113.3E147E147-R150 PolarHBondContact O-N 2.77Å
151D52.2Low47.1Very low147 Ų147126.2 Ų126.279%0.78670%0.702SS**SBendtrans-92.11-178.9-68.3-22.4000113.9A153D151-A153 PolarHBondContact O-N 3.35Å
152S49.9Very low46.1Very low93 Ų93128.2 Ų128.265%0.6572%0.716SS**  trans-86.956.6175.6-58.10000111.6H154S152-H154 PolarHBondContact O-N 3.27Å; S152-H154 VanDerWaalsContact O-N 3.09Å
153A51.5Low45.1Very low83 Ų83132.2 Ų132.269%0.68673%0.732SS**  trans-57.17176.600000119.3D151D151-A153 PolarHBondContact O-N 3.35Å
154H48.5Very low44.2Very low178 Ų178129.3 Ų129.382%0.82473%0.733SS**  trans-134.892.8-162.8-60.3-4000112.9S152S152-H154 PolarHBondContact O-N 3.27Å; S152-H154 VanDerWaalsContact O-N 3.09Å
155S36.6Very low43.2Very low123 Ų123129.7 Ų129.786%0.8674%0.74SS**  trans168.983.9135.8-74.10000110.4
156T38.9Very low42.1Very low120 Ų120132.6 Ų132.674%0.73675%0.75SS**PPolyproline II helixtrans-86131.816247.20000109.4V158T156-V158 PolarHBondContact O-N 3.07Å
157P37.5Very low41.1Very low128 Ų128136.4 Ų136.483%0.83176%0.762SS**PPolyproline II helixtrans-72.2116.6159.427.8-27.7000108.7
158V36.4Very low40.4Very low122 Ų122137.1 Ų137.174%0.73977%0.769SS**PPolyproline II helixtrans-61.1130.4175.2170.80000109.7T156 S160T156-V158 PolarHBondContact O-N 3.07Å; V158-S160 PolarHBondContact O-N 2.97Å
159R33.6Very low39.8Very low233 Ų233139.2 Ų139.288%0.87978%0.781SS**PPolyproline II helixtrans-70.1119.9163.3-84.7-178.5163.586.2-1.3108.3T161R159-T161 PolarHBondContact O-N 3.47Å
160S31.2Very low38.8Very low121 Ų121139.4 Ų139.485%0.84678%0.778SS**  trans-74.6106169.8-54.80000109.8V158V158-S160 PolarHBondContact O-N 2.97Å
161T34.4Very low37.6Very low124 Ų124136 Ų13676%0.76178%0.782SS**  trans-94.2119.2159.248.90000108.4R159R159-T161 PolarHBondContact O-N 3.47Å
162S32.5Very low36.6Very low121 Ų121138.6 Ų138.685%0.84678%0.78SS**  trans-123.7115.4155.361.20000108.5
163H34.4Very low35.6Very low190 Ų190139.6 Ų139.688%0.8879%0.787SS**  trans-107.8147.7175.6-108.5-79.9000109.6
164G33.1Very low34.5Very low62 Ų62141.1 Ų141.164%0.63979%0.793SS**  trans126.6125.4158.600000112.4
165D32Very low33.8Very low147 Ų147143.6 Ų143.679%0.78680%0.795SS**  cis-174.2151.2-0.2-113.4-22.3000108.7
166T31.6Very low33.6Very low101 Ų101144.5 Ų144.562%0.6280%0.795SS**  trans65.1124.4150.5-36.60000117.4
167F31.5Very low33.3Very low195 Ų195146.2 Ų146.286%0.85580%0.8SS**  -155.1140.761.8-75.6-91.5000112.1
168L41.8Very low33Very low160 Ų160145.9 Ų145.984%0.83880%0.801SS**  trans-75.9162.8163.8-67.4170.7000110.6
169P38Very low33Very low131 Ų131147.7 Ų147.785%0.85181%0.807SS**  -132.4151.5100.836.2-26.6000115
170H31.8Very low33Very low130 Ų130144.3 Ų144.360%0.60280%0.801SS**  trans-77135.3176.9173.788.8000112.3
171V31.3Very low33Very low148 Ų148148.7 Ų148.790%0.89780%0.799SS**  trans-141.7137143.6-178.60000110.1
172R31.6Very low33.1Very low200 Ų200148.5 Ų148.576%0.75580%0.797SS**  trans-90.4169.8-172.1-118.7172.1173.5158.3-4.7113.1
173S28.8Very low33.1Very low115 Ų115147.3 Ų147.380%0.80479%0.794SS**  trans99.2138.216190.80000114
174S29.7Very low33.1Very low115 Ų115144.2 Ų144.280%0.80479%0.788SS**  cis-160.6169.15.953.40000109.2
175R32.9Very low33.3Very low230 Ų230148.8 Ų148.887%0.86880%0.797SS**  trans-65.9149-175.9-58156.680.9165.84.5112.6
176T32.2Very low33.4Very low141 Ų141146 Ų14687%0.86579%0.794SS**  175.3143.511734.40000112.4
177D33.3Very low33.7Very low157 Ų157148.4 Ų148.484%0.8480%0.803SS**  trans-38145.3165.2-91.4-45.7000115.3
178S31.3Very low33.9Very low121 Ų121147 Ų14785%0.84680%0.799SS**  163.1149.411449.30000112.5
179N36.2Very low33.7Very low160 Ų160144.3 Ų144.386%0.85680%0.8SS**  trans-53.8160.7-177.5-112.9-1.2000115.7
180E33.6Very low33.8Very low162 Ų162147.7 Ų147.776%0.75780%0.797SS**  trans84.1102.8150.6-143.9-174162.600117.9
181R31.9Very low34Very low213 Ų213146.9 Ų146.980%0.80481%0.806SS**  158.9137.4120.2-89.1-174-87.9-135.6-1.1114
182V35Very low34.4Very low119 Ų119144.5 Ų144.572%0.72179%0.794SS**  trans54.1103.2137.1-174.80000117.3V184V182-V184 HydrophobicContact CG1-CG2 3.87Å
183A32Very low34.6Very low96 Ų96138.8 Ų138.879%0.79379%0.79SS**  trans-9298160.100000109.6
184V36Very low35Very low125 Ų125141.5 Ų141.576%0.75880%0.795SS**  trans-73.9122.9155.6175.20000106.4V182V182-V184 HydrophobicContact CG1-CG2 3.87Å
185I36.7Very low35.4Very low158 Ų158141.7 Ų141.781%0.8180%0.796SS**  trans-117.4113.5165.2-58.6178.2000106.4
186A33.6Very low35.6Very low88 Ų88137 Ų13773%0.72779%0.793SS**  trans-77.8160178.400000111.8
187D37.7Very low35.9Very low152 Ų152138.2 Ų138.281%0.81379%0.793SS**  trans-60.3166-174.8-104.1-30.9000117
188E36.2Very low36.1Very low166 Ų166136.1 Ų136.178%0.77679%0.788SS**  trans81.698.2154.8-74.8-58.2140.500120.4
189A38.3Very low36.3Very low103 Ų103136.3 Ų136.385%0.85178%0.784SS**  -174.486.912300000110
190Y39Very low36.6Very low202 Ų202134.8 Ų134.879%0.79278%0.783SS**  trans-119.7104.7164.9-172.2-100.3000109.7P192Y190-P192 HydrophobicContact CD1-CG 4.26Å; Y190-P192 HydrophobicContact CE1-CB 3.82Å; Y190-P192 HydrophobicContact CE1-CG 3.89Å
191S36.4Very low37Very low114 Ų114133.6 Ų133.680%0.79779%0.787SS**  trans-112.1107.6176.8-165.10000109A193S191-A193 PolarHBondContact O-N 3.5Å
192P40.2Very low37.5Very low98 Ų98127.8 Ų127.864%0.63678%0.784SS**  trans-96.386.3178.333.3-26.4000110.3Y190Y190-P192 HydrophobicContact CD1-CG 4.26Å; Y190-P192 HydrophobicContact CE1-CB 3.82Å; Y190-P192 HydrophobicContact CE1-CG 3.89Å
193A36Very low37.9Very low80 Ų80131.1 Ų131.166%0.66179%0.792SS**  trans-158.398.6165.400000110.7S191S191-A193 PolarHBondContact O-N 3.5Å
194D37.2Very low38.4Very low172 Ų172133.9 Ų133.992%0.9279%0.788SS**  trans-171.588.5144.1-106-17.8000111.2
195S37.3Very low38.7Very low118 Ų118132 Ų13283%0.82578%0.781SS**  trans-165.279.414771.10000109.3
196V37.9Very low39.1Very low132 Ų132131.2 Ų131.280%0.878%0.777SS**  trans-108.7106.3167.7-174.30000107.6
197L38.8Very low39.5Very low166 Ų166133.8 Ų133.887%0.86977%0.774SS**PPolyproline II helixtrans-90.5127.2155.5-73.1174.8000107.2
198P37.7Very low40Very low113 Ų113132.9 Ų132.973%0.73477%0.769SS**PPolyproline II helixtrans-82.8124.8-176.730-30.8000111.4
199T35.5Very low40.3Very low126 Ų126130.6 Ų130.677%0.77376%0.759SS**PPolyproline II helixtrans-99.1132.3157.244.80000108.9V201T199-V201 PolarHBondContact O-N 3.34Å
200P41.8Very low40.7Very low128 Ų128131.4 Ų131.483%0.83175%0.749SS**PPolyproline II helixtrans-78.3120.9-174.130.2-32.6000110.5
201V41.8Very low40.9Very low137 Ų137128 Ų12883%0.8374%0.744SS**  trans-129.3127.4165.5-179.80000108.4T199T199-V201 PolarHBondContact O-N 3.34Å
202A42.4Very low41.2Very low90 Ų90126.8 Ų126.874%0.74474%0.735SS**  trans-46.2138.7-169.400000115.5H204A202-H204 PolarHBondContact O-N 3.44Å
203E43.6Very low41.2Very low190 Ų190132.4 Ų132.489%0.88874%0.743SS**SBendtrans-65.395.5170.2-60.8-176.1163.200110.3
204H42.5Very low41.4Very low154 Ų154137 Ų13771%0.71375%0.751SS**  trans-151.15.1160.9-103.1-58.6000114.4A202A202-H204 PolarHBondContact O-N 3.44Å
205S41.8Very low41.3Very low86 Ų86135.1 Ų135.160%0.60174%0.74SS**SBendtrans-102.2-8.9-173.8-1630000115.2
206L45.7Very low41.1Very low140 Ų140137.3 Ų137.373%0.73374%0.742SS**SBendtrans-83-29.5-178.6-100.2153.9000112.7M209 L210L206-M209 PolarHBondContact O-N 3.19Å; L206-L210 PolarHBondContact O-N 3.34Å
207E42.1Very low40.7Very low143 Ų143135 Ų13567%0.66875%0.745SS**Hα-helixtrans-76.4-35-178.5-156172.3-171.800112.6M209 L210 L211E207-M209 VanDerWaalsContact C-N 3.3Å; E207-M209 PolarHBondContact O-N 2.78Å; E207-L210 PolarHBondContact O-N 2.77Å; E207-L211 PolarHBondContact O-N 2.75Å
208L47.1Very low40.1Very low133 Ų133131.5 Ų131.570%0.69674%0.74SS**Hα-helixtrans-72.2-19.8174.2-87.8157.8000113.8S212L208-S212 PolarHBondContact O-OG 2.94Å; L208-S212 VanDerWaalsContact O-OG 3.11Å
209M43.5Very low39.6Very low118 Ų118133 Ų13358%0.58175%0.748SS**Hα-helixtrans-86.7-22.8179-150-178-55.300112.6L206 E207 S212L206-M209 PolarHBondContact O-N 3.19Å; E207-M209 VanDerWaalsContact C-N 3.3Å; E207-M209 PolarHBondContact O-N 2.78Å; M209-S212 PolarHBondContact O-OG 3.47Å
210L46.3Very low39.3Very low120 Ų120133 Ų13363%0.62875%0.751SS**Hα-helixtrans-84-29.9176.5-69.1177.1000112.7L206 E207L206-L210 PolarHBondContact O-N 3.34Å; E207-L210 PolarHBondContact O-N 2.77Å
211L43Very low38.5Very low131 Ų131131.6 Ų131.669%0.68674%0.744SS**Hα-helixtrans-76.4-21.5174.3-72.6173.5000113.9E207E207-L211 PolarHBondContact O-N 2.75Å
212S42.3Very low37.9Very low87 Ų87132.2 Ų132.261%0.60874%0.741SS**THydrogen-bonded Turntrans-87.2-8.3179.752.40000114.4L208 M209L208-S212 PolarHBondContact O-OG 2.94Å; L208-S212 VanDerWaalsContact O-OG 3.11Å; M209-S212 PolarHBondContact O-OG 3.47Å
213R41.4Very low37.3Very low217 Ų217137.4 Ų137.482%0.81975%0.75SS**THydrogen-bonded Turntrans-98.25.1178.5-153.5166.184.3-171.45114.4
214Q39.7Very low36.7Very low177 Ų177136.4 Ų136.483%0.82775%0.745SS**SBendtrans-121.814.3-177.7-110.6-152.2-66.800116.7
215I35.6Very low36.1Very low132 Ų132138.7 Ų138.768%0.67776%0.757SS**SBendtrans-141.6129.2173.6-28173.6000109.4
216N32.7Very low35.6Very low164 Ų164143.6 Ų143.688%0.87777%0.767SS**  trans108.368.5170.6-52.8-20.6000116
217G28.4Very low34.7Very low84 Ų84146 Ų14687%0.86677%0.774SS**  trans-152.367.4154.100000109.9
218A27.3Very low34.2Very low92 Ų92143.9 Ų143.976%0.7678%0.775SS**  trans-153.4124.4163.500000110.5
219T26.9Very low33.5Very low145 Ų145146.4 Ų146.489%0.8978%0.783SS**  trans-68.2120169.4-50.50000108.8
220C29Very low32.7Very low124 Ų124145.1 Ų145.184%0.83879%0.792SS**  trans-113.9116.3163.4-68.20000108.4
221S25.4Very low31.9Very low100 Ų100145.1 Ų145.170%0.69980%0.802SS**  trans-74.9135.4165.954.80000110.1
222I29.5Very low31.1Very low149 Ų149145.2 Ų145.276%0.76481%0.808SS**  trans53.8108.5137.9-58.5168.3000116.5
223E28.7Very low31.4Very low199 Ų199145.9 Ų145.993%0.9381%0.81SS**  trans-128.2137134.6-74.3-170.3156.800109.5
224E31.9Very low30.7Very low169 Ų169142.1 Ų142.179%0.7981%0.811SS**  trans-68.5140.7-175.4-74.2167.712500111.9
225E29.5Very low30.2Very low203 Ų203137.5 Ų137.595%0.94980%0.804SS**  trans-108.1111.4145.9-70.9-171.3156.800107.4
226K32.2Very low29.9Very low189 Ų189136.8 Ų136.882%0.82281%0.805SS**  trans-133.2103.2162.7-170.4-179.6179.6-178.90108.1
227E27.1Very low29.7Very low190 Ų190136.9 Ų136.989%0.88880%0.801SS**  trans-95.9120.7165-162.4173.9-165.600107.6
228S30.8Very low29.8Very low98 Ų98138.5 Ų138.569%0.68579%0.793SS**  trans166.2113.6141.6-86.40000111.6
229E31.6Very low30Very low186 Ų186142.9 Ų142.987%0.86980%0.798SS**  trans86.6119.7139.9-60-174169.200122.1
230A27.4Very low30.5Very low91 Ų91140.5 Ų140.575%0.75279%0.793SS**  trans89.2104.1135.600000121.1
231S29Very low30.9Very low120 Ų120143.4 Ų143.484%0.83980%0.8SS**  73.9125.5129.7-54.80000122.1
232T27.4Very low31.3Very low133 Ų133142.7 Ų142.782%0.81681%0.808SS**  trans-59.3-179165110000115.5
233P47.6Very low31.5Very low102 Ų102138.9 Ų138.966%0.66281%0.806SS**  cis-139.4-165.8-34.833.8-12.2000114.7
234T26.7Very low31.9Very low137 Ų137138.5 Ų138.584%0.8480%0.804SS**  trans102138.1158.474.90000115.8
235A28.7Very low32.2Very low80 Ų80138.1 Ų138.166%0.66181%0.806SS**  cis-162.4154.414.300000110.7
236T30.5Very low32.5Very low117 Ų117139.6 Ų139.672%0.71880%0.803SS**  trans23.1139.6134.747.20000118.6
237E27.7Very low32.8Very low167 Ų167134.8 Ų134.878%0.7880%0.798SS**  cis172.7163.122.8-126178.2162.500108.7
238V30.3Very low33.5Very low117 Ų117133 Ų13371%0.70979%0.794SS**  trans51.8115154.6-126.40000121.7
239E32.2Very low34.1Very low184 Ų184134.4 Ų134.486%0.8680%0.803SS**  162.1108.898.5-96-162.1152.200110.8
240A37.9Very low34.4Very low95 Ų95135 Ų13579%0.78581%0.805SS**  trans-80.7109.5161.200000108.3
241L36.9Very low34.8Very low186 Ų186134 Ų13497%0.97480%0.804SS**  trans175.579.4147.1-114.6117.6000109.4
242G34.5Very low35.3Very low85 Ų85137.6 Ų137.688%0.87681%0.807SS**SBendtrans-179.712.8178.500000117.8
243G32.7Very low36Very low69 Ų69135 Ų13571%0.71180%0.795SS**SBendtrans-112.8-9.7-173.300000116L245G243-L245 PolarHBondContact O-N 2.93Å
244E37.1Very low35.8Very low190 Ų190131.4 Ų131.489%0.88878%0.776SS**THydrogen-bonded Turntrans-94.66.3-165.8-154.9144176.800114.4
245L37.7Very low37.3Very low162 Ų162130.5 Ų130.585%0.84877%0.773SS**THydrogen-bonded Turntrans-132.429.5-177.9-128.7155.4000113.5G243G243-L245 PolarHBondContact O-N 2.93Å
246R36.6Very low38.6Very low234 Ų234134.2 Ų134.288%0.88378%0.776SS**  trans-124.723.2163-150.7173.9-87.5-1290.9112.6L248R246-L248 VanDerWaalsContact C-N 3.29Å; R246-L248 PolarHBondContact O-N 2.88Å
247A38.8Very low39.9Very low87 Ų87134.5 Ų134.572%0.71977%0.769SS**SBendtrans-85.319.5172.400000114
248L41.2Very low41.8Very low154 Ų154132.2 Ų132.281%0.80676%0.759SS**SBendtrans-127.613.9-172.7-79.1178000116.6R246R246-L248 VanDerWaalsContact C-N 3.29Å; R246-L248 PolarHBondContact O-N 2.88Å
249C43.6Very low43.7Very low127 Ų127133.4 Ų133.486%0.85876%0.757SS**SBendtrans-152.130-179.3-87.60000116.7
250Q38.3Very low46Very low198 Ų198128.8 Ų128.893%0.92574%0.741SS**SBendtrans-125.5116.7159.5-93.4178.28.700110.5
251G34.8Very low48.1Very low71 Ų71129.5 Ų129.573%0.73273%0.731SS**  trans-59.6144.2-169.900000112.9S253G251-S253 PolarHBondContact O-N 2.89Å
252H40.8Very low50.5Low194 Ų194126.8 Ų126.890%0.89871%0.712SS**  trans-6387.8172.6-166.186.7000110.7
253S42Very low53Low79 Ų79129.6 Ų129.655%0.55270%0.7SS**  trans-102.1111.1156.853.10000107.2G251 E257G251-S253 PolarHBondContact O-N 2.89Å; S253-E257 WeakPolarHBondContact CB-OE2 3.39Å
254G43.1Very low55.8Low26 Ų26130.3 Ų130.327%0.26869%0.69SS.*  trans-61.1160.6-172.200000113.6E256 E257G254-E256 PolarHBondContact O-N 2.75Å; G254-E257 PolarHBondContact O-N 3.24Å
255P57.3Low58.2Low119 Ų119124.9 Ų124.977%0.77367%0.667SS**Hα-helixtrans-59.1-14178.423.1-32.8000114
256E56.9Low60.7Low157 Ų157120.7 Ų120.773%0.73465%0.651SS**Hα-helixtrans-72.7-34.5173.4-60-164.4149.300112.9G254 Q259 V260G254-E256 PolarHBondContact O-N 2.75Å; E256-Q259 PolarHBondContact O-N 2.81Å; E256-V260 WeakPolarHBondContact O-CG2 3.28Å; E256-V260 PolarHBondContact O-N 3.11Å
257E57.9Low63.4Low123 Ų123112.3 Ų112.358%0.57563%0.626SS**Hα-helixtrans-70.3-33.7-177.9-68.9-167.4164.400112.4S253 G254 V260 N261S253-E257 WeakPolarHBondContact CB-OE2 3.39Å; G254-E257 PolarHBondContact O-N 3.24Å; E257-V260 WeakPolarHBondContact O-CG2 3.37Å; E257-N261 WeakPolarHBondContact O-CB 3.19Å; E257-N261 PolarHBondContact O-N 2.84Å; E257-N261 VanDerWaalsContact O-N 3.13Å
258E66.3Low66.1Low119 Ų119112.3 Ų112.356%0.55661%0.613SS**Hα-helixtrans-75.1-33.9179.2-150.4-168.9139.800112K262E258-K262 WeakPolarHBondContact O-CG 3.34Å; E258-K262 PolarHBondContact O-N 3.47Å; E258-K262 VanDerWaalsContact O-N 3.11Å; E258-K262 VanDerWaalsContact OE1-CE 3.3Å; E258-K262 WeakPolarHBondContact OE1-CE 3.31Å; E258-K262 IonicContact OE1-NZ 3.4Å; E258-K262 PolarHBondContact OE1-NZ 3.23Å
259Q70.6Confident68.6Low143 Ų143112.5 Ų112.567%0.66860%0.603SS**Hα-helixtrans-71-41.6177.5-166.9177.930.400111.6E256 N261 K262 F263E256-Q259 PolarHBondContact O-N 2.81Å; Q259-N261 VanDerWaalsContact C-N 3.34Å; Q259-K262 PolarHBondContact O-N 2.88Å; Q259-F263 PolarHBondContact O-N 3.42Å
260V80.1Confident71Confident87 Ų87111.8 Ų111.853%0.52759%0.59SS.*Hα-helixtrans-66.6-36.8174.9-62.70000111.4E256 E257 K262 F263 V264E256-V260 WeakPolarHBondContact O-CG2 3.28Å; E256-V260 PolarHBondContact O-N 3.11Å; E257-V260 WeakPolarHBondContact O-CG2 3.37Å; V260-K262 PolarHBondContact O-N 3.31Å; V260-F263 PolarHBondContact O-N 3.48Å; V260-V264 WeakPolarHBondContact O-CB 3.38Å; V260-V264 WeakPolarHBondContact O-CG2 3.22Å; V260-V264 PolarHBondContact O-N 2.84Å
261N82.4Confident73.7Confident109 Ų109107 Ų10758%0.58357%0.571SS**Hα-helixtrans-64.6-40.3176.5-166.415.4000111.8E257 Q259 V264 L265E257-N261 WeakPolarHBondContact O-CB 3.19Å; E257-N261 PolarHBondContact O-N 2.84Å; E257-N261 VanDerWaalsContact O-N 3.13Å; Q259-N261 VanDerWaalsContact C-N 3.34Å; N261-V264 PolarHBondContact O-N 3.28Å; N261-L265 VanDerWaalsContact O-CB 3.25Å; N261-L265 WeakPolarHBondContact O-CB 3.35Å; N261-L265 PolarHBondContact O-N 2.8Å
262K87.3Confident76.5Confident130 Ų130109.2 Ų109.257%0.56557%0.565SS**Hα-helixtrans-63.3-41.6173.2-72.2168.4-172.81660112.1E258 Q259 V260 S266E258-K262 WeakPolarHBondContact O-CG 3.34Å; E258-K262 PolarHBondContact O-N 3.47Å; E258-K262 VanDerWaalsContact O-N 3.11Å; E258-K262 VanDerWaalsContact OE1-CE 3.3Å; E258-K262 WeakPolarHBondContact OE1-CE 3.31Å; E258-K262 IonicContact OE1-NZ 3.4Å; E258-K262 PolarHBondContact OE1-NZ 3.23Å; Q259-K262 PolarHBondContact O-N 2.88Å; V260-K262 PolarHBondContact O-N 3.31Å; K262-S266 WeakPolarHBondContact O-CB 3.49Å; K262-S266 PolarHBondContact O-N 3.41Å
263F87.3Confident79.1Confident144 Ų144104.8 Ų104.863%0.63255%0.551SS**Hα-helixtrans-65.2-48175.5178-100.3000111.9Q259 V260 L265 S266 V267Q259-F263 PolarHBondContact O-N 3.42Å; V260-F263 PolarHBondContact O-N 3.48Å; F263-L265 VanDerWaalsContact C-N 3.32Å; F263-L265 PolarHBondContact O-N 2.92Å; F263-S266 WeakPolarHBondContact O-CB 3.01Å; F263-S266 PolarHBondContact O-N 3.25Å; F263-S266 VanDerWaalsContact O-N 3.15Å; F263-V267 HydrophobicContact CD1-CG2 4.22Å; F263-V267 HydrophobicContact CE1-CG2 3.81Å; F263-V267 HydrophobicContact CE2-CG2 4.14Å; F263-V267 HydrophobicContact CZ-CG2 3.76Å; F263-V267 WeakPolarHBondContact O-CG2 3.33Å; F263-V267 PolarHBondContact O-N 3.06Å
264V91.4Very high81.5Confident84 Ų84104.1 Ų104.151%0.50954%0.544SS..Hα-helixtrans-60.7-42.4178.1170.20000110.8V260 N261 S266 V267 L268V260-V264 WeakPolarHBondContact O-CB 3.38Å; V260-V264 WeakPolarHBondContact O-CG2 3.22Å; V260-V264 PolarHBondContact O-N 2.84Å; N261-V264 PolarHBondContact O-N 3.28Å; V264-S266 PolarHBondContact O-N 3.46Å; V264-V267 PolarHBondContact O-N 2.93Å; V264-L268 VanDerWaalsContact O-CB 3.29Å; V264-L268 WeakPolarHBondContact O-CB 3.45Å; V264-L268 PolarHBondContact O-N 3.37Å
265L87.7Confident83.9Confident76 Ų76109 Ų10940%0.39856%0.561SS.*Hα-helixtrans-65.1-38.6176.1-17364.6000112.1N261 F263 L268 R269N261-L265 VanDerWaalsContact O-CB 3.25Å; N261-L265 WeakPolarHBondContact O-CB 3.35Å; N261-L265 PolarHBondContact O-N 2.8Å; F263-L265 VanDerWaalsContact C-N 3.32Å; F263-L265 PolarHBondContact O-N 2.92Å; L265-L268 PolarHBondContact O-N 2.84Å; L265-R269 WeakPolarHBondContact O-CB 3.5Å; L265-R269 VanDerWaalsContact O-CG 3.25Å; L265-R269 WeakPolarHBondContact O-CG 3.31Å; L265-R269 PolarHBondContact O-N 3.49Å
266S90.6Very high85.5Confident74 Ų74105 Ų10552%0.51754%0.541SS..Hα-helixtrans-63.6-44.9174.4-173.90000111.8K262 F263 V264 R269 L270K262-S266 WeakPolarHBondContact O-CB 3.49Å; K262-S266 PolarHBondContact O-N 3.41Å; F263-S266 WeakPolarHBondContact O-CB 3.01Å; F263-S266 PolarHBondContact O-N 3.25Å; F263-S266 VanDerWaalsContact O-N 3.15Å; V264-S266 PolarHBondContact O-N 3.46Å; S266-R269 PolarHBondContact O-N 2.9Å; S266-L270 PolarHBondContact O-N 3.33Å
267V94.2Very high87.2Confident57 Ų57103.4 Ų103.435%0.34554%0.537SS..Hα-helixtrans-63.7-44175.3173.70000110.8F263 V264 R269 L270 L271F263-V267 HydrophobicContact CD1-CG2 4.22Å; F263-V267 HydrophobicContact CE1-CG2 3.81Å; F263-V267 HydrophobicContact CE2-CG2 4.14Å; F263-V267 HydrophobicContact CZ-CG2 3.76Å; F263-V267 WeakPolarHBondContact O-CG2 3.33Å; F263-V267 PolarHBondContact O-N 3.06Å; V264-V267 PolarHBondContact O-N 2.93Å; V267-R269 VanDerWaalsContact C-N 3.34Å; V267-R269 PolarHBondContact O-N 3.31Å; V267-L270 PolarHBondContact O-N 2.91Å; V267-L271 HydrophobicContact CG1-CD1 4.08Å; V267-L271 HydrophobicContact CG1-CG 4.34Å; V267-L271 VanDerWaalsContact O-CG 3.3Å; V267-L271 WeakPolarHBondContact O-CG 3.23Å; V267-L271 PolarHBondContact O-N 3.3Å
268L94.1Very high88.8Confident87 Ų87102.6 Ų102.646%0.45554%0.537SS..Hα-helixtrans-61.6-42.6177.3-177.164.4000111.4V264 L265 L271 L272V264-L268 VanDerWaalsContact O-CB 3.29Å; V264-L268 WeakPolarHBondContact O-CB 3.45Å; V264-L268 PolarHBondContact O-N 3.37Å; L265-L268 PolarHBondContact O-N 2.84Å; L268-L271 PolarHBondContact O-N 2.81Å; L268-L272 HydrophobicContact CG-CD1 4.28Å; L268-L272 WeakPolarHBondContact O-CB 3.33Å; L268-L272 VanDerWaalsContact O-CG 3.31Å; L268-L272 WeakPolarHBondContact O-CG 3.39Å; L268-L272 PolarHBondContact O-N 3.35Å
269R93.6Very high89.8Confident159 Ų159101 Ų10160%0.653%0.528SS*.Hα-helixtrans-60.5-45.3174-76.2173.5-178.5179.61.3111.4L265 S266 V267 L271 L272 V273L265-R269 WeakPolarHBondContact O-CB 3.5Å; L265-R269 VanDerWaalsContact O-CG 3.25Å; L265-R269 WeakPolarHBondContact O-CG 3.31Å; L265-R269 PolarHBondContact O-N 3.49Å; S266-R269 PolarHBondContact O-N 2.9Å; V267-R269 VanDerWaalsContact C-N 3.34Å; V267-R269 PolarHBondContact O-N 3.31Å; R269-L271 VanDerWaalsContact C-N 3.33Å; R269-L271 PolarHBondContact O-N 3.24Å; R269-L272 PolarHBondContact O-N 3.13Å; R269-V273 VanDerWaalsContact O-CG2 3.29Å; R269-V273 WeakPolarHBondContact O-CG2 3.26Å; R269-V273 PolarHBondContact O-N 3.23Å
270L94.7Very high90.6Very high112 Ų11298.2 Ų98.259%0.58652%0.52SS*.Hα-helixtrans-62-41.6176.1-177.263.7000111.6S266 V267 V273 T274S266-L270 PolarHBondContact O-N 3.33Å; V267-L270 PolarHBondContact O-N 2.91Å; L270-V273 PolarHBondContact O-N 2.87Å; L270-T274 HydrophobicContact CD1-CG2 4.34Å; L270-T274 WeakPolarHBondContact O-CB 3.25Å; L270-T274 VanDerWaalsContact O-CG2 3.25Å; L270-T274 WeakPolarHBondContact O-CG2 3.5Å; L270-T274 PolarHBondContact O-N 2.79Å; L270-T274 PolarHBondContact O-OG1 2.82Å
271L94.1Very high91Very high98 Ų9898.8 Ų98.851%0.51352%0.52SS..Hα-helixtrans-63.5-42.8175.4-70.8175.9000111.8V267 L268 R269 T274 M275V267-L271 HydrophobicContact CG1-CD1 4.08Å; V267-L271 HydrophobicContact CG1-CG 4.34Å; V267-L271 VanDerWaalsContact O-CG 3.3Å; V267-L271 WeakPolarHBondContact O-CG 3.23Å; V267-L271 PolarHBondContact O-N 3.3Å; L268-L271 PolarHBondContact O-N 2.81Å; R269-L271 VanDerWaalsContact C-N 3.33Å; R269-L271 PolarHBondContact O-N 3.24Å; L271-T274 VanDerWaalsContact CA-OG1 3.32Å; L271-T274 WeakPolarHBondContact CA-OG1 3.36Å; L271-T274 PolarHBondContact O-N 3.04Å; L271-T274 PolarHBondContact O-OG1 3.03Å; L271-M275 VanDerWaalsContact O-CB 3.31Å; L271-M275 WeakPolarHBondContact O-CB 3.17Å; L271-M275 WeakPolarHBondContact O-CG 3.46Å; L271-M275 PolarHBondContact O-N 2.91Å
272L93.2Very high91.1Very high117 Ų11795.6 Ų95.661%0.61350%0.503SS*.Hα-helixtrans-63.8-42.8176.3-72.5171.1000111.9L268 R269 G276L268-L272 HydrophobicContact CG-CD1 4.28Å; L268-L272 WeakPolarHBondContact O-CB 3.33Å; L268-L272 VanDerWaalsContact O-CG 3.31Å; L268-L272 WeakPolarHBondContact O-CG 3.39Å; L268-L272 PolarHBondContact O-N 3.35Å; R269-L272 PolarHBondContact O-N 3.13Å; L272-G276 PolarHBondContact O-N 2.62Å
273V96Very high90.9Very high100 Ų10092.4 Ų92.461%0.60649%0.492SS*.Hα-helixtrans-63.7-45176.8171.20000111.1R269 L270 G276 L277R269-V273 VanDerWaalsContact O-CG2 3.29Å; R269-V273 WeakPolarHBondContact O-CG2 3.26Å; R269-V273 PolarHBondContact O-N 3.23Å; L270-V273 PolarHBondContact O-N 2.87Å; V273-G276 PolarHBondContact O-N 2.91Å; V273-L277 WeakPolarHBondContact O-CB 3.13Å; V273-L277 PolarHBondContact O-N 2.96Å
274T92.9Very high90.7Very high66 Ų6689.8 Ų89.841%0.40548%0.484SS..Hα-helixtrans-66.8-41.7179.351.80000112.1L270 L271 L277 L278L270-T274 HydrophobicContact CD1-CG2 4.34Å; L270-T274 WeakPolarHBondContact O-CB 3.25Å; L270-T274 VanDerWaalsContact O-CG2 3.25Å; L270-T274 WeakPolarHBondContact O-CG2 3.5Å; L270-T274 PolarHBondContact O-N 2.79Å; L270-T274 PolarHBondContact O-OG1 2.82Å; L271-T274 VanDerWaalsContact CA-OG1 3.32Å; L271-T274 WeakPolarHBondContact CA-OG1 3.36Å; L271-T274 PolarHBondContact O-N 3.04Å; L271-T274 PolarHBondContact O-OG1 3.03Å; T274-L277 PolarHBondContact O-N 2.69Å; T274-L278 WeakPolarHBondContact O-CB 3.5Å; T274-L278 PolarHBondContact O-N 3.28Å
275M92.3Very high90.3Very high128 Ų12890 Ų9063%0.63148%0.481SS*.Hα-helixtrans-65.1-39.2174.4-68.9-65.8-88.100111.7L271 L278 F279L271-M275 VanDerWaalsContact O-CB 3.31Å; L271-M275 WeakPolarHBondContact O-CB 3.17Å; L271-M275 WeakPolarHBondContact O-CG 3.46Å; L271-M275 PolarHBondContact O-N 2.91Å; M275-L278 PolarHBondContact O-N 3.3Å; M275-F279 WeakPolarHBondContact O-CB 3.3Å; M275-F279 PolarHBondContact O-N 3.45Å
276G91.8Very high89.8Confident34 Ų3487.4 Ų87.435%0.35147%0.468SS..Hα-helixtrans-62.9-46.517400000112.6L272 V273 L278 F279 V280L272-G276 PolarHBondContact O-N 2.62Å; V273-G276 PolarHBondContact O-N 2.91Å; G276-L278 VanDerWaalsContact C-N 3.33Å; G276-L278 PolarHBondContact O-N 3.23Å; G276-F279 WeakPolarHBondContact O-CB 3.2Å; G276-F279 PolarHBondContact O-N 3.29Å; G276-V280 WeakPolarHBondContact O-CG2 3.33Å; G276-V280 PolarHBondContact O-N 2.88Å
277L93.1Very high89.2Confident124 Ų12488.6 Ų88.665%0.64947%0.468SS*.Hα-helixtrans-61.3-42.1175.9-176.866.8000111.7V273 T274 F279 V280 L281V273-L277 WeakPolarHBondContact O-CB 3.13Å; V273-L277 PolarHBondContact O-N 2.96Å; T274-L277 PolarHBondContact O-N 2.69Å; L277-F279 VanDerWaalsContact C-N 3.32Å; L277-F279 PolarHBondContact O-N 3.44Å; L277-V280 PolarHBondContact O-N 3.09Å; L277-L281 WeakPolarHBondContact O-CB 3.28Å; L277-L281 PolarHBondContact O-N 3.42Å
278L90.4Very high88.4Confident107 Ų10788.7 Ų88.756%0.5647%0.466SS*.Hα-helixtrans-64.5-38.4176.7-171.9143.4000111.6T274 M275 G276 L281 L282T274-L278 WeakPolarHBondContact O-CB 3.5Å; T274-L278 PolarHBondContact O-N 3.28Å; M275-L278 PolarHBondContact O-N 3.3Å; G276-L278 VanDerWaalsContact C-N 3.33Å; G276-L278 PolarHBondContact O-N 3.23Å; L278-L281 PolarHBondContact O-N 3.02Å; L278-L282 WeakPolarHBondContact O-CB 3.32Å; L278-L282 PolarHBondContact O-N 3.21Å
279F87.3Confident87.2Confident84 Ų8486.1 Ų86.137%0.36845%0.453SS..Hα-helixtrans-66.1-42.7174.7-175.3-102.6000112.1M275 G276 L277 L282 L283 F322M275-F279 WeakPolarHBondContact O-CB 3.3Å; M275-F279 PolarHBondContact O-N 3.45Å; G276-F279 WeakPolarHBondContact O-CB 3.2Å; G276-F279 PolarHBondContact O-N 3.29Å; L277-F279 VanDerWaalsContact C-N 3.32Å; L277-F279 PolarHBondContact O-N 3.44Å; F279-L282 WeakPolarHBondContact O-CB 3.44Å; F279-L282 PolarHBondContact O-N 2.92Å; F279-L283 HydrophobicContact CD1-CD1 3.95Å; F279-L283 HydrophobicContact CD1-CG 4.36Å; F279-L283 HydrophobicContact CE1-CD1 3.44Å; F279-L283 VanDerWaalsContact CE1-CD1 3.44Å; F279-L283 HydrophobicContact CE1-CG 4.02Å; F279-L283 HydrophobicContact CZ-CD1 3.98Å; F279-L283 HydrophobicContact CZ-CD2 4.32Å; F279-L283 HydrophobicContact CZ-CG 4.19Å; F279-L283 WeakPolarHBondContact O-CG 3.45Å; F279-L283 PolarHBondContact O-N 2.91Å; F279-F322 HydrophobicContact CD2-CE1 4.38Å; F279-F322 HydrophobicContact CE2-CD1 4.28Å; F279-F322 AromaticContact CE2-CE1 3.86Å; F279-F322 HydrophobicContact CE2-CE1 3.86Å
280V89.3Confident86.2Confident85 Ų8585.1 Ų85.152%0.51546%0.456SS..Hα-helixtrans-62-44.8174.1171.80000111.1G276 L277 L282 L283 L284G276-V280 WeakPolarHBondContact O-CG2 3.33Å; G276-V280 PolarHBondContact O-N 2.88Å; L277-V280 PolarHBondContact O-N 3.09Å; V280-L282 VanDerWaalsContact C-N 3.28Å; V280-L282 PolarHBondContact O-N 3.5Å; V280-L283 PolarHBondContact O-N 3.36Å; V280-L284 WeakPolarHBondContact O-CB 3.44Å; V280-L284 PolarHBondContact O-N 2.92Å
281L87.6Confident84.8Confident100 Ų10081.8 Ų81.852%0.52444%0.442SS..Hα-helixtrans-60.1-41.1175.8-179.764.2000111.3L277 L278 L284 L285L277-L281 WeakPolarHBondContact O-CB 3.28Å; L277-L281 PolarHBondContact O-N 3.42Å; L278-L281 PolarHBondContact O-N 3.02Å; L281-L284 PolarHBondContact O-N 2.95Å; L281-L285 HydrophobicContact CG-CD1 4.39Å; L281-L285 VanDerWaalsContact O-CG 3.31Å; L281-L285 WeakPolarHBondContact O-CG 3.31Å; L281-L285 PolarHBondContact O-N 3.35Å
282L85.2Confident83Confident42 Ų4283.9 Ų83.922%0.2245%0.454CS..Hα-helixtrans-66.1-43.1177.5-177.761000112.4L278 F279 V280 L284 L285 I286 F322L278-L282 WeakPolarHBondContact O-CB 3.32Å; L278-L282 PolarHBondContact O-N 3.21Å; F279-L282 WeakPolarHBondContact O-CB 3.44Å; F279-L282 PolarHBondContact O-N 2.92Å; V280-L282 VanDerWaalsContact C-N 3.28Å; V280-L282 PolarHBondContact O-N 3.5Å; L282-L284 VanDerWaalsContact C-N 3.32Å; L282-L285 PolarHBondContact O-N 3.44Å; L282-I286 HydrophobicContact CG-CD1 4.24Å; L282-I286 VanDerWaalsContact O-CG1 3.26Å; L282-I286 WeakPolarHBondContact O-CG1 3.15Å; L282-I286 PolarHBondContact O-N 3.42Å; L282-F322 HydrophobicContact CD2-CE1 4.12Å; L282-F322 HydrophobicContact CD2-CE2 3.49Å; L282-F322 VanDerWaalsContact CD2-CE2 3.49Å; L282-F322 HydrophobicContact CD2-CZ 3.17Å; L282-F322 HydrophobicContact CG-CE2 4.29Å; L282-F322 HydrophobicContact CG-CZ 4.31Å
283L82.6Confident81.4Confident62 Ų6281.6 Ų81.633%0.32544%0.441SS..Hα-helixtrans-62.3-40.3172.8-72.3-179.3000111.5F279 V280 I286 I287F279-L283 HydrophobicContact CD1-CD1 3.95Å; F279-L283 HydrophobicContact CD1-CG 4.36Å; F279-L283 HydrophobicContact CE1-CD1 3.44Å; F279-L283 VanDerWaalsContact CE1-CD1 3.44Å; F279-L283 HydrophobicContact CE1-CG 4.02Å; F279-L283 HydrophobicContact CZ-CD1 3.98Å; F279-L283 HydrophobicContact CZ-CD2 4.32Å; F279-L283 HydrophobicContact CZ-CG 4.19Å; F279-L283 WeakPolarHBondContact O-CG 3.45Å; F279-L283 PolarHBondContact O-N 2.91Å; V280-L283 PolarHBondContact O-N 3.36Å; L283-I286 HydrophobicContact CD2-CD1 4.39Å; L283-I286 WeakPolarHBondContact O-CB 3.36Å; L283-I286 PolarHBondContact O-N 3.43Å; L283-I287 WeakPolarHBondContact O-CB 3.31Å; L283-I287 VanDerWaalsContact O-CG1 3.25Å; L283-I287 WeakPolarHBondContact O-CG1 3.39Å; L283-I287 PolarHBondContact O-N 2.85Å
284L83.8Confident79.5Confident90 Ų9084.3 Ų84.347%0.47145%0.453SS..Hα-helixtrans-63.6-42175.4-171146.9000111.1V280 L281 L282 I286 I287 L288V280-L284 WeakPolarHBondContact O-CB 3.44Å; V280-L284 PolarHBondContact O-N 2.92Å; L281-L284 PolarHBondContact O-N 2.95Å; L282-L284 VanDerWaalsContact C-N 3.32Å; L284-I286 VanDerWaalsContact C-N 3.34Å; L284-I286 PolarHBondContact O-N 2.69Å; L284-I287 PolarHBondContact O-N 2.89Å; L284-L288 HydrophobicContact CD2-CD1 3.49Å; L284-L288 VanDerWaalsContact CD2-CD1 3.49Å; L284-L288 HydrophobicContact CD2-CG 3.96Å; L284-L288 WeakPolarHBondContact O-CB 3.45Å; L284-L288 VanDerWaalsContact O-CG 3.23Å; L284-L288 WeakPolarHBondContact O-CG 3.24Å; L284-L288 PolarHBondContact O-N 2.86Å
285L81Confident78.2Confident87 Ų8785.4 Ų85.446%0.45546%0.455SS..Hα-helixtrans-61.8-41.2173.2-74.1170.2000112L281 L282 L288 T289L281-L285 HydrophobicContact CG-CD1 4.39Å; L281-L285 VanDerWaalsContact O-CG 3.31Å; L281-L285 WeakPolarHBondContact O-CG 3.31Å; L281-L285 PolarHBondContact O-N 3.35Å; L282-L285 PolarHBondContact O-N 3.44Å; L285-L288 PolarHBondContact O-N 2.98Å; L285-T289 PolarHBondContact O-N 2.86Å; L285-T289 PolarHBondContact O-OG1 2.96Å
286I78.5Confident76.9Confident23 Ų2381.8 Ų81.812%0.11845%0.445CS..Hα-helixtrans-61.6-48.4175.8-70.2162.8000110.4L282 L283 L284 L288 T289 E290 F315 F322L282-I286 HydrophobicContact CG-CD1 4.24Å; L282-I286 VanDerWaalsContact O-CG1 3.26Å; L282-I286 WeakPolarHBondContact O-CG1 3.15Å; L282-I286 PolarHBondContact O-N 3.42Å; L283-I286 HydrophobicContact CD2-CD1 4.39Å; L283-I286 WeakPolarHBondContact O-CB 3.36Å; L283-I286 PolarHBondContact O-N 3.43Å; L284-I286 VanDerWaalsContact C-N 3.34Å; L284-I286 PolarHBondContact O-N 2.69Å; I286-L288 VanDerWaalsContact C-N 3.34Å; I286-L288 PolarHBondContact O-N 3.21Å; I286-T289 WeakPolarHBondContact CA-OG1 3.41Å; I286-T289 PolarHBondContact O-N 2.85Å; I286-T289 PolarHBondContact O-OG1 2.89Å; I286-E290 WeakPolarHBondContact O-CB 3.39Å; I286-E290 PolarHBondContact O-N 3.45Å; I286-F315 HydrophobicContact CB-CE2 4.46Å; I286-F315 HydrophobicContact CB-CZ 4.13Å; I286-F315 HydrophobicContact CG1-CE2 3.8Å; I286-F315 HydrophobicContact CG1-CZ 3.82Å; I286-F315 HydrophobicContact CG2-CZ 4.09Å; I286-F322 HydrophobicContact CD1-CD2 4.4Å
287I78.4Confident76Confident99 Ų9986.6 Ų86.651%0.50846%0.457SS..Hα-helixtrans-60.9-43.7176.6-68.1164.6000110.3L283 L284 T289 E290 S291L283-I287 WeakPolarHBondContact O-CB 3.31Å; L283-I287 VanDerWaalsContact O-CG1 3.25Å; L283-I287 WeakPolarHBondContact O-CG1 3.39Å; L283-I287 PolarHBondContact O-N 2.85Å; L284-I287 PolarHBondContact O-N 2.89Å; I287-T289 VanDerWaalsContact C-N 3.3Å; I287-T289 PolarHBondContact O-N 3.28Å; I287-E290 PolarHBondContact O-N 2.69Å; I287-S291 WeakPolarHBondContact CG2-OG 3.35Å; I287-S291 WeakPolarHBondContact O-CB 3.49Å; I287-S291 PolarHBondContact O-N 2.96Å; I287-S291 PolarHBondContact O-OG 3.26Å
288L76.6Confident74.8Confident59 Ų5984.6 Ų84.631%0.30944%0.443SS..Hα-helixtrans-62.5-35.8177.1-75178.2000112.5L284 L285 I286 L293L284-L288 HydrophobicContact CD2-CD1 3.49Å; L284-L288 VanDerWaalsContact CD2-CD1 3.49Å; L284-L288 HydrophobicContact CD2-CG 3.96Å; L284-L288 WeakPolarHBondContact O-CB 3.45Å; L284-L288 VanDerWaalsContact O-CG 3.23Å; L284-L288 WeakPolarHBondContact O-CG 3.24Å; L284-L288 PolarHBondContact O-N 2.86Å; L285-L288 PolarHBondContact O-N 2.98Å; I286-L288 VanDerWaalsContact C-N 3.34Å; I286-L288 PolarHBondContact O-N 3.21Å; L288-L293 HydrophobicContact CD2-CD1 3.51Å
289T69.6Low73.6Confident32 Ų3285.3 Ų85.320%0.19644%0.439CS..Hα-helixtrans-73.3-34.3176.1420000113.3L285 I286 I287 R302 F307 F315L285-T289 PolarHBondContact O-N 2.86Å; L285-T289 PolarHBondContact O-OG1 2.96Å; I286-T289 WeakPolarHBondContact CA-OG1 3.41Å; I286-T289 PolarHBondContact O-N 2.85Å; I286-T289 PolarHBondContact O-OG1 2.89Å; I287-T289 VanDerWaalsContact C-N 3.3Å; I287-T289 PolarHBondContact O-N 3.28Å; T289-R302 PolarHBondContact O-NH1 2.96Å; T289-R302 VanDerWaalsContact O-NH1 3.07Å; T289-F307 HydrophobicContact CG2-CZ 4.04Å; T289-F315 HydrophobicContact CG2-CE2 4.34Å; T289-F315 WeakPolarHBondContact OG1-CE2 3.45Å; T289-F315 WeakPolarHBondContact OG1-CZ 3.39Å
290E71.6Confident72.9Confident138 Ų13885.8 Ų85.865%0.64545%0.445SS*.Hα-helixtrans-88-33.1-176.2-174.2170.7-174.600113I286 I287 D292I286-E290 WeakPolarHBondContact O-CB 3.39Å; I286-E290 PolarHBondContact O-N 3.45Å; I287-E290 PolarHBondContact O-N 2.69Å; E290-D292 PolarHBondContact O-N 2.97Å
291S66.4Low72.1Confident42 Ų4284.7 Ų84.729%0.29444%0.435SS..SBendtrans-71.3124.3-179.9-52.10000109.2I287 L293 R302I287-S291 WeakPolarHBondContact CG2-OG 3.35Å; I287-S291 WeakPolarHBondContact O-CB 3.49Å; I287-S291 PolarHBondContact O-N 2.96Å; I287-S291 PolarHBondContact O-OG 3.26Å; S291-L293 PolarHBondContact O-N 3.48Å; S291-R302 PolarHBondContact O-NH1 2.91Å; S291-R302 PolarHBondContact O-NH2 3.41Å
292D56.4Low71.2Confident143 Ų14382.5 Ų82.577%0.76542%0.42SS*.  trans-68.464.5161.4-88.7-42000109.6E290 D294 R302E290-D292 PolarHBondContact O-N 2.97Å; D292-D294 PolarHBondContact O-N 2.76Å; D292-R302 IonicContact OD1-NH2 2.79Å
293L58.8Low70.6Confident68 Ų6887.2 Ų87.236%0.35644%0.441SS..  trans-66.6117.7168.6-75.3160000107L288 S291 I295L288-L293 HydrophobicContact CD2-CD1 3.51Å; S291-L293 PolarHBondContact O-N 3.48Å; L293-I295 PolarHBondContact O-N 3.01Å
294D56.6Low70.4Confident157 Ų15786.9 Ų86.984%0.8444%0.442SS*.  trans-63.619.5179.7-86.9-35.9000114.6D292 A296D292-D294 PolarHBondContact O-N 2.76Å; D294-A296 PolarHBondContact O-N 2.89Å
295I65.2Low69.9Low89 Ų8987.4 Ų87.446%0.45645%0.45SS..  trans-79102.9172.7-55.9170.2000106.9L293 F297 F298L293-I295 PolarHBondContact O-N 3.01Å; I295-F297 HydrophobicContact CG2-CB 4.24Å; I295-F297 PolarHBondContact O-N 3.49Å; I295-F298 HydrophobicContact CB-CD2 4Å; I295-F298 HydrophobicContact CD1-CD2 4.29Å; I295-F298 HydrophobicContact CD1-CE2 4.37Å; I295-F298 HydrophobicContact CG2-CD2 3.86Å; I295-F298 HydrophobicContact CG2-CE2 4.33Å; I295-F298 PolarHBondContact O-N 3.26Å
296A65.8Low69.8Low52 Ų5290.7 Ų90.743%0.4346%0.464SS..Hα-helixtrans-45.3-35.8-175.800000114.2D294 F298 R299 D300D294-A296 PolarHBondContact O-N 2.89Å; A296-F298 PolarHBondContact O-N 3.09Å; A296-R299 PolarHBondContact O-N 3.22Å; A296-D300 PolarHBondContact O-N 2.82Å; A296-D300 VanDerWaalsContact O-N 3.16Å
297F71.5Confident69.7Low135 Ų13592.1 Ų92.159%0.59247%0.469SS*.Hα-helixtrans-59.3-43.9177.9-178.1-106.3000114.4I295 R299 D300 I301I295-F297 HydrophobicContact CG2-CB 4.24Å; I295-F297 PolarHBondContact O-N 3.49Å; F297-R299 VanDerWaalsContact C-N 3.35Å; F297-D300 PolarHBondContact O-N 3.09Å; F297-I301 HydrophobicContact CD1-CD1 3.71Å; F297-I301 HydrophobicContact CD2-CD1 4.4Å; F297-I301 HydrophobicContact CE1-CD1 3.28Å; F297-I301 HydrophobicContact CE2-CD1 4.04Å; F297-I301 HydrophobicContact CG-CD1 4.26Å; F297-I301 HydrophobicContact CZ-CD1 3.48Å; F297-I301 VanDerWaalsContact CZ-CD1 3.48Å; F297-I301 WeakPolarHBondContact O-CG1 3.48Å; F297-I301 PolarHBondContact O-N 2.77Å
298F69.1Low69.4Low83 Ų8392.5 Ų92.536%0.36447%0.469SS..Hα-helixtrans-76.4-26.7-178.8-73.6-72.5000112.3I295 A296 R302I295-F298 HydrophobicContact CB-CD2 4Å; I295-F298 HydrophobicContact CD1-CD2 4.29Å; I295-F298 HydrophobicContact CD1-CE2 4.37Å; I295-F298 HydrophobicContact CG2-CD2 3.86Å; I295-F298 HydrophobicContact CG2-CE2 4.33Å; I295-F298 PolarHBondContact O-N 3.26Å; A296-F298 PolarHBondContact O-N 3.09Å; F298-R302 WeakPolarHBondContact O-CB 3.19Å; F298-R302 VanDerWaalsContact O-CG 3.29Å; F298-R302 WeakPolarHBondContact O-CG 3.36Å; F298-R302 PolarHBondContact O-N 3.46Å; F298-R302 PolarHBondContact O-NE 3.39Å
299R65.3Low69.6Low122 Ų12295.9 Ų95.946%0.4648%0.483SS..Hα-helixtrans-65.3-45.4172.7-173.8177.164.1-155.6-0.5111A296 F297 I301 R302 Q303A296-R299 PolarHBondContact O-N 3.22Å; F297-R299 VanDerWaalsContact C-N 3.35Å; R299-I301 VanDerWaalsContact C-N 3.34Å; R299-I301 PolarHBondContact O-N 3.27Å; R299-R302 PolarHBondContact O-N 3.3Å; R299-Q303 WeakPolarHBondContact O-CG 3.24Å; R299-Q303 PolarHBondContact O-N 3.47Å; R299-Q303 VanDerWaalsContact O-N 3.14Å
300D71.3Confident70.1Confident94 Ų9499.7 Ų99.750%0.50350%0.497SS..Hα-helixtrans-66.3-38.1179.7-67.7-4.8000111.5A296 F297 Q303A296-D300 PolarHBondContact O-N 2.82Å; A296-D300 VanDerWaalsContact O-N 3.16Å; F297-D300 PolarHBondContact O-N 3.09Å; D300-Q303 PolarHBondContact O-N 3.41Å
301I73.7Confident70.3Confident61 Ų6195.2 Ų95.231%0.31348%0.476SS..Hα-helixtrans-65-40.9174.7-67.8167.8000111.4F297 R299 Q303 T304 F307F297-I301 HydrophobicContact CD1-CD1 3.71Å; F297-I301 HydrophobicContact CD2-CD1 4.4Å; F297-I301 HydrophobicContact CE1-CD1 3.28Å; F297-I301 HydrophobicContact CE2-CD1 4.04Å; F297-I301 HydrophobicContact CG-CD1 4.26Å; F297-I301 HydrophobicContact CZ-CD1 3.48Å; F297-I301 VanDerWaalsContact CZ-CD1 3.48Å; F297-I301 WeakPolarHBondContact O-CG1 3.48Å; F297-I301 PolarHBondContact O-N 2.77Å; R299-I301 VanDerWaalsContact C-N 3.34Å; R299-I301 PolarHBondContact O-N 3.27Å; I301-Q303 VanDerWaalsContact C-N 3.26Å; I301-Q303 PolarHBondContact O-N 2.93Å; I301-T304 PolarHBondContact O-N 2.86Å; I301-T304 PolarHBondContact O-OG1 3.29Å; I301-F307 HydrophobicContact CG2-CD2 4.18Å; I301-F307 WeakPolarHBondContact O-CB 3.31Å
302R68.4Low70.8Confident54 Ų54100.5 Ų100.520%0.20449%0.49CS..Hα-helixtrans-64.9-28.1177.8-79.4-172.7-75.5-157.91.4113.6T289 S291 D292 F298 R299 T304 F307T289-R302 PolarHBondContact O-NH1 2.96Å; T289-R302 VanDerWaalsContact O-NH1 3.07Å; S291-R302 PolarHBondContact O-NH1 2.91Å; S291-R302 PolarHBondContact O-NH2 3.41Å; D292-R302 IonicContact OD1-NH2 2.79Å; F298-R302 WeakPolarHBondContact O-CB 3.19Å; F298-R302 VanDerWaalsContact O-CG 3.29Å; F298-R302 WeakPolarHBondContact O-CG 3.36Å; F298-R302 PolarHBondContact O-N 3.46Å; F298-R302 PolarHBondContact O-NE 3.39Å; R299-R302 PolarHBondContact O-N 3.3Å; R302-T304 VanDerWaalsContact C-N 3.31Å; R302-F307 HydrophobicContact CB-CD1 4.4Å; R302-F307 HydrophobicContact CB-CE1 4.41Å; R302-F307 HydrophobicContact CG-CD1 4.2Å; R302-F307 HydrophobicContact CG-CE1 3.75Å; R302-F307 HydrophobicContact CG-CZ 4.38Å
303Q71.3Confident72.1Confident141 Ų14198.8 Ų98.866%0.65948%0.478SS*.THydrogen-bonded Turntrans-83.3-4.4179.3-72-179.94.200113.7R299 D300 I301R299-Q303 WeakPolarHBondContact O-CG 3.24Å; R299-Q303 PolarHBondContact O-N 3.47Å; R299-Q303 VanDerWaalsContact O-N 3.14Å; D300-Q303 PolarHBondContact O-N 3.41Å; I301-Q303 VanDerWaalsContact C-N 3.26Å; I301-Q303 PolarHBondContact O-N 2.93Å
304T78.9Confident73.1Confident56 Ų56101.7 Ų101.734%0.34449%0.485SS..SBendtrans-70.8133.6174.561.80000110.4I301 R302 E306 F307 E308I301-T304 PolarHBondContact O-N 2.86Å; I301-T304 PolarHBondContact O-OG1 3.29Å; R302-T304 VanDerWaalsContact C-N 3.31Å; T304-E306 PolarHBondContact O-N 2.9Å; T304-E306 VanDerWaalsContact O-N 3.14Å; T304-F307 PolarHBondContact O-N 3.29Å; T304-F307 WeakPolarHBondContact OG1-CB 3.5Å; T304-F307 PolarHBondContact OG1-N 2.87Å; T304-E308 PolarHBondContact O-N 3.5Å; T304-E308 VanDerWaalsContact O-N 3.13Å
305P72.7Confident74.1Confident100 Ų10095.5 Ų95.565%0.64945%0.451SS*.Hα-helixtrans-62.1-25.3-179.124.7-34000112.4Q309P305-Q309 WeakPolarHBondContact O-CB 3.42Å; P305-Q309 PolarHBondContact O-N 2.87Å; P305-Q309 VanDerWaalsContact O-N 3.09Å
306E79.5Confident74.6Confident157 Ų15792 Ų9273%0.73443%0.434SS*.Hα-helixtrans-69.1-40.5175.4-59.9178.6-178.800112.2T304 F310T304-E306 PolarHBondContact O-N 2.9Å; T304-E306 VanDerWaalsContact O-N 3.14Å; E306-F310 WeakPolarHBondContact O-CB 3.37Å; E306-F310 PolarHBondContact O-N 2.86Å
307F76.4Confident75.4Confident53 Ų5392.7 Ų92.723%0.23243%0.434CS..Hα-helixtrans-71.3-38.9177.5-174.4-91.4000111.4T289 I301 R302 T304 F310 H311T289-F307 HydrophobicContact CG2-CZ 4.04Å; I301-F307 HydrophobicContact CG2-CD2 4.18Å; I301-F307 WeakPolarHBondContact O-CB 3.31Å; R302-F307 HydrophobicContact CB-CD1 4.4Å; R302-F307 HydrophobicContact CB-CE1 4.41Å; R302-F307 HydrophobicContact CG-CD1 4.2Å; R302-F307 HydrophobicContact CG-CE1 3.75Å; R302-F307 HydrophobicContact CG-CZ 4.38Å; T304-F307 PolarHBondContact O-N 3.29Å; T304-F307 WeakPolarHBondContact OG1-CB 3.5Å; T304-F307 PolarHBondContact OG1-N 2.87Å; F307-F310 PolarHBondContact O-N 3.47Å; F307-H311 VanDerWaalsContact O-CB 3.3Å; F307-H311 WeakPolarHBondContact O-CB 3.49Å; F307-H311 PolarHBondContact O-N 3.25Å
308E73.3Confident75.7Confident106 Ų10689.5 Ų89.550%0.49542%0.423SS..Hα-helixtrans-61.2-44.9174.9-172.4174.5-16600111.2T304 F310 H311 Y312T304-E308 PolarHBondContact O-N 3.5Å; T304-E308 VanDerWaalsContact O-N 3.13Å; E308-F310 PolarHBondContact O-N 2.79Å; E308-H311 WeakPolarHBondContact O-CB 3.26Å; E308-H311 PolarHBondContact O-N 3.49Å; E308-Y312 HydrophobicContact CG-CD2 3.81Å; E308-Y312 HydrophobicContact CG-CE2 3.64Å; E308-Y312 VanDerWaalsContact O-CD2 3.25Å; E308-Y312 WeakPolarHBondContact O-CD2 3.43Å; E308-Y312 PolarHBondContact O-N 3.14Å
309Q79.8Confident76.2Confident131 Ų13191.1 Ų91.161%0.61243%0.427SS*.Hα-helixtrans-61.1-45175.8-173175.20.100111.9P305 H311 Y312 Q313P305-Q309 WeakPolarHBondContact O-CB 3.42Å; P305-Q309 PolarHBondContact O-N 2.87Å; P305-Q309 VanDerWaalsContact O-N 3.09Å; Q309-H311 VanDerWaalsContact C-N 3.32Å; Q309-H311 PolarHBondContact O-N 3.15Å; Q309-Y312 PolarHBondContact O-N 3.42Å; Q309-Q313 VanDerWaalsContact O-CB 3.23Å; Q309-Q313 WeakPolarHBondContact O-CB 3.47Å; Q309-Q313 PolarHBondContact O-N 3Å
310F79.6Confident77Confident112 Ų11293.4 Ų93.449%0.49144%0.435SS..Hα-helixtrans-61.2-41.2175.2176.6-99.4000112.1E306 F307 E308 Q313 Y314E306-F310 WeakPolarHBondContact O-CB 3.37Å; E306-F310 PolarHBondContact O-N 2.86Å; F307-F310 PolarHBondContact O-N 3.47Å; E308-F310 PolarHBondContact O-N 2.79Å; F310-Q313 PolarHBondContact O-N 3.42Å; F310-Y314 AromaticContact CD2-CD2 3.6Å; F310-Y314 HydrophobicContact CD2-CD2 3.6Å; F310-Y314 HydrophobicContact CD2-CE2 4.26Å; F310-Y314 HydrophobicContact CD2-CG 4.35Å; F310-Y314 AromaticContact CE2-CD2 3.82Å; F310-Y314 HydrophobicContact CE2-CD2 3.82Å; F310-Y314 HydrophobicContact CE2-CG 4.15Å; F310-Y314 HydrophobicContact CG-CD2 4.45Å; F310-Y314 PolarHBondContact O-N 2.88Å
311H75.8Confident77.5Confident43 Ų4396 Ų9620%0.19944%0.438CS..Iπ-helixtrans-64.3-44.1-179.5-166.290.7000111.9F307 E308 Q309 F315 C316F307-H311 VanDerWaalsContact O-CB 3.3Å; F307-H311 WeakPolarHBondContact O-CB 3.49Å; F307-H311 PolarHBondContact O-N 3.25Å; E308-H311 WeakPolarHBondContact O-CB 3.26Å; E308-H311 PolarHBondContact O-N 3.49Å; Q309-H311 VanDerWaalsContact C-N 3.32Å; Q309-H311 PolarHBondContact O-N 3.15Å; H311-F315 AromaticContact CE1-CD1 3.06Å; H311-F315 WeakPolarHBondContact CE1-CD1 3.25Å; H311-F315 AromaticContact CE1-CE1 3.39Å; H311-F315 WeakPolarHBondContact CE1-CE1 3.31Å; H311-F315 AromaticContact CE1-CG 3.73Å; H311-F315 AromaticContact ND1-CD1 3.55Å; H311-F315 AromaticContact ND1-CG 3.73Å; H311-F315 AromaticContact NE2-CD1 3.44Å; H311-F315 WeakPolarHBondContact NE2-CD1 3.29Å; H311-F315 AromaticContact NE2-CE1 3.93Å; H311-F315 CarbonylContact O-C 3.56Å; H311-F315 WeakPolarHBondContact O-CA 3.47Å; H311-F315 VanDerWaalsContact O-CB 3.24Å; H311-F315 WeakPolarHBondContact O-CB 3.3Å; H311-F315 PolarHBondContact O-N 3.34Å; H311-F315 VanDerWaalsContact O-N 3.13Å; H311-C316 PolarHBondContact O-N 3.45Å
312Y78.6Confident77.8Confident153 Ų15394.3 Ų94.360%0.643%0.428SS*.Iπ-helixtrans-71.7-37.9176.7-78.5-70000113E308 Q309 P317E308-Y312 HydrophobicContact CG-CD2 3.81Å; E308-Y312 HydrophobicContact CG-CE2 3.64Å; E308-Y312 VanDerWaalsContact O-CD2 3.25Å; E308-Y312 WeakPolarHBondContact O-CD2 3.43Å; E308-Y312 PolarHBondContact O-N 3.14Å; Q309-Y312 PolarHBondContact O-N 3.42Å; Y312-P317 WeakPolarHBondContact O-CD 3.35Å
313Q83.4Confident78.4Confident107 Ų10794.6 Ų94.650%0.544%0.443SS..Iπ-helixtrans-76.6-37.5-174.5-171173.83.500113.3Q309 F310Q309-Q313 VanDerWaalsContact O-CB 3.23Å; Q309-Q313 WeakPolarHBondContact O-CB 3.47Å; Q309-Q313 PolarHBondContact O-N 3Å; F310-Q313 PolarHBondContact O-N 3.42Å
314Y78.2Confident78.8Confident129 Ų12992.1 Ų92.151%0.50644%0.44SS..Iπ-helixtrans-117.8-43.7-173.3-64.1-80000112.7F310 L318F310-Y314 AromaticContact CD2-CD2 3.6Å; F310-Y314 HydrophobicContact CD2-CD2 3.6Å; F310-Y314 HydrophobicContact CD2-CE2 4.26Å; F310-Y314 HydrophobicContact CD2-CG 4.35Å; F310-Y314 AromaticContact CE2-CD2 3.82Å; F310-Y314 HydrophobicContact CE2-CD2 3.82Å; F310-Y314 HydrophobicContact CE2-CG 4.15Å; F310-Y314 HydrophobicContact CG-CD2 4.45Å; F310-Y314 PolarHBondContact O-N 2.88Å; Y314-L318 WeakPolarHBondContact O-CB 3.43Å; Y314-L318 PolarHBondContact O-N 3.42Å
315F77.6Confident78.9Confident27 Ų2794.6 Ų94.612%0.11845%0.446CS..Iπ-helixtrans-75.1-41.6-172.5-169.6-89.4000112.7I286 T289 H311 L318 R319I286-F315 HydrophobicContact CB-CE2 4.46Å; I286-F315 HydrophobicContact CB-CZ 4.13Å; I286-F315 HydrophobicContact CG1-CE2 3.8Å; I286-F315 HydrophobicContact CG1-CZ 3.82Å; I286-F315 HydrophobicContact CG2-CZ 4.09Å; T289-F315 HydrophobicContact CG2-CE2 4.34Å; T289-F315 WeakPolarHBondContact OG1-CE2 3.45Å; T289-F315 WeakPolarHBondContact OG1-CZ 3.39Å; H311-F315 AromaticContact CE1-CD1 3.06Å; H311-F315 WeakPolarHBondContact CE1-CD1 3.25Å; H311-F315 AromaticContact CE1-CE1 3.39Å; H311-F315 WeakPolarHBondContact CE1-CE1 3.31Å; H311-F315 AromaticContact CE1-CG 3.73Å; H311-F315 AromaticContact ND1-CD1 3.55Å; H311-F315 AromaticContact ND1-CG 3.73Å; H311-F315 AromaticContact NE2-CD1 3.44Å; H311-F315 WeakPolarHBondContact NE2-CD1 3.29Å; H311-F315 AromaticContact NE2-CE1 3.93Å; H311-F315 CarbonylContact O-C 3.56Å; H311-F315 WeakPolarHBondContact O-CA 3.47Å; H311-F315 VanDerWaalsContact O-CB 3.24Å; H311-F315 WeakPolarHBondContact O-CB 3.3Å; H311-F315 PolarHBondContact O-N 3.34Å; H311-F315 VanDerWaalsContact O-N 3.13Å; F315-L318 PolarHBondContact O-N 2.96Å; F315-R319 WeakPolarHBondContact O-CB 3.35Å; F315-R319 PolarHBondContact O-N 2.8Å
316C76.4Confident79.2Confident15 Ų1593.5 Ų93.510%0.10143%0.434CS..Hα-helixtrans-62.2-47.1178.1-76.20000113.8H311 L318 R319 R320H311-C316 PolarHBondContact O-N 3.45Å; C316-L318 VanDerWaalsContact C-N 3.35Å; C316-R319 PolarHBondContact O-N 3.36Å; C316-R320 WeakPolarHBondContact O-CG 3.42Å; C316-R320 PolarHBondContact O-N 2.89Å; C316-R320 VanDerWaalsContact O-N 3.14Å
317P82.8Confident79.3Confident68 Ų6895.6 Ų95.644%0.44244%0.435SS..Hα-helixtrans-62.2-41.7172.9-24.434.8000112.5Y312 R319 R320 W321Y312-P317 WeakPolarHBondContact O-CD 3.35Å; P317-R319 PolarHBondContact O-N 2.88Å; P317-R320 PolarHBondContact O-N 3.4Å; P317-W321 WeakPolarHBondContact O-CB 3.36Å; P317-W321 PolarHBondContact O-N 3.12Å
318L78.3Confident79.4Confident67 Ų6796.2 Ų96.235%0.35145%0.446SS..Hα-helixtrans-62.6-42.9178.9-17364.1000111.4Y314 F315 C316 W321 F322Y314-L318 WeakPolarHBondContact O-CB 3.43Å; Y314-L318 PolarHBondContact O-N 3.42Å; F315-L318 PolarHBondContact O-N 2.96Å; C316-L318 VanDerWaalsContact C-N 3.35Å; L318-W321 PolarHBondContact O-N 3.48Å; L318-F322 HydrophobicContact CD1-CD2 3.98Å; L318-F322 HydrophobicContact CD1-CE2 3.47Å; L318-F322 VanDerWaalsContact CD1-CE2 3.47Å; L318-F322 HydrophobicContact CD1-CZ 4.36Å; L318-F322 HydrophobicContact CD2-CE2 4.12Å; L318-F322 HydrophobicContact CG-CD2 3.78Å; L318-F322 HydrophobicContact CG-CE2 3.54Å; L318-F322 WeakPolarHBondContact O-CD2 3.4Å; L318-F322 PolarHBondContact O-N 3.31Å
319R79.3Confident79.6Confident118 Ų11894.6 Ų94.645%0.44544%0.443SS..Hα-helixtrans-60.1-47.3174.8-173.6-175.274.6-171.82.3112.1F315 C316 P317 W321 F322 A323F315-R319 WeakPolarHBondContact O-CB 3.35Å; F315-R319 PolarHBondContact O-N 2.8Å; C316-R319 PolarHBondContact O-N 3.36Å; P317-R319 PolarHBondContact O-N 2.88Å; R319-W321 VanDerWaalsContact C-N 3.31Å; R319-W321 PolarHBondContact O-N 3.35Å; R319-F322 PolarHBondContact O-N 3.29Å; R319-A323 WeakPolarHBondContact O-CB 3.1Å; R319-A323 PolarHBondContact O-N 3.47Å
320R82.3Confident79.7Confident170 Ų17091.8 Ų91.864%0.64243%0.434SS*.Hα-helixtrans-61.3-43.6177.3-72177.9-176.3160.52.9110.9C316 P317 A323 C324C316-R320 WeakPolarHBondContact O-CG 3.42Å; C316-R320 PolarHBondContact O-N 2.89Å; C316-R320 VanDerWaalsContact O-N 3.14Å; P317-R320 PolarHBondContact O-N 3.4Å; R320-A323 PolarHBondContact O-N 3.29Å; R320-C324 WeakPolarHBondContact O-CB 3.16Å; R320-C324 PolarHBondContact O-N 3.26Å; R320-C324 PolarHBondContact O-SG 3.13Å
321W82.2Confident79.7Confident147 Ų14789.3 Ų89.356%0.55743%0.431SS*.Hα-helixtrans-61.3-45175.9-176.589.3000111.9P317 L318 R319 C324 K325P317-W321 WeakPolarHBondContact O-CB 3.36Å; P317-W321 PolarHBondContact O-N 3.12Å; L318-W321 PolarHBondContact O-N 3.48Å; R319-W321 VanDerWaalsContact C-N 3.31Å; R319-W321 PolarHBondContact O-N 3.35Å; W321-C324 PolarHBondContact O-N 3.29Å; W321-K325 HydrophobicContact CH2-CG 4.31Å; W321-K325 HydrophobicContact CZ2-CD 4.45Å; W321-K325 HydrophobicContact CZ2-CG 4.42Å; W321-K325 VanDerWaalsContact O-CB 3.26Å; W321-K325 WeakPolarHBondContact O-CB 3.47Å; W321-K325 PolarHBondContact O-N 3.5Å
322F79.1Confident79.8Confident26 Ų2693.1 Ų93.111%0.11445%0.453CS..Hα-helixtrans-62.4-45.8175.5-87.3-64.3000112.5F279 L282 I286 L318 R319 C324 K325 I326F279-F322 HydrophobicContact CD2-CE1 4.38Å; F279-F322 HydrophobicContact CE2-CD1 4.28Å; F279-F322 AromaticContact CE2-CE1 3.86Å; F279-F322 HydrophobicContact CE2-CE1 3.86Å; L282-F322 HydrophobicContact CD2-CE1 4.12Å; L282-F322 HydrophobicContact CD2-CE2 3.49Å; L282-F322 VanDerWaalsContact CD2-CE2 3.49Å; L282-F322 HydrophobicContact CD2-CZ 3.17Å; L282-F322 HydrophobicContact CG-CE2 4.29Å; L282-F322 HydrophobicContact CG-CZ 4.31Å; I286-F322 HydrophobicContact CD1-CD2 4.4Å; L318-F322 HydrophobicContact CD1-CD2 3.98Å; L318-F322 HydrophobicContact CD1-CE2 3.47Å; L318-F322 VanDerWaalsContact CD1-CE2 3.47Å; L318-F322 HydrophobicContact CD1-CZ 4.36Å; L318-F322 HydrophobicContact CD2-CE2 4.12Å; L318-F322 HydrophobicContact CG-CD2 3.78Å; L318-F322 HydrophobicContact CG-CE2 3.54Å; L318-F322 WeakPolarHBondContact O-CD2 3.4Å; L318-F322 PolarHBondContact O-N 3.31Å; R319-F322 PolarHBondContact O-N 3.29Å; F322-C324 VanDerWaalsContact C-N 3.34Å; F322-C324 PolarHBondContact O-N 3.36Å; F322-K325 PolarHBondContact O-N 2.72Å; F322-I326 WeakPolarHBondContact O-CB 3.29Å; F322-I326 VanDerWaalsContact O-CG1 3.25Å; F322-I326 WeakPolarHBondContact O-CG1 3.4Å; F322-I326 PolarHBondContact O-N 3Å
323A80.3Confident79.7Confident61 Ų6191.7 Ų91.750%0.50446%0.455SS..Hα-helixtrans-60.7-43.9177.600000111.6R319 R320 R327R319-A323 WeakPolarHBondContact O-CB 3.1Å; R319-A323 PolarHBondContact O-N 3.47Å; R320-A323 PolarHBondContact O-N 3.29Å; A323-R327 WeakPolarHBondContact O-CB 3.25Å; A323-R327 PolarHBondContact O-N 3.18Å
324C80.6Confident79.4Confident89 Ų8992.7 Ų92.760%0.60146%0.462SS*.Hα-helixtrans-64-41.8174.8-70.40000112.1R320 W321 F322 S328R320-C324 WeakPolarHBondContact O-CB 3.16Å; R320-C324 PolarHBondContact O-N 3.26Å; R320-C324 PolarHBondContact O-SG 3.13Å; W321-C324 PolarHBondContact O-N 3.29Å; F322-C324 VanDerWaalsContact C-N 3.34Å; F322-C324 PolarHBondContact O-N 3.36Å; C324-S328 WeakPolarHBondContact O-CB 3.47Å; C324-S328 PolarHBondContact O-N 2.97Å
325K81Confident78.8Confident107 Ų10793 Ų9347%0.46547%0.472SS..Hα-helixtrans-71.9-43.9-177.2-165.668.4-178.51760112W321 F322 S328 V329W321-K325 HydrophobicContact CH2-CG 4.31Å; W321-K325 HydrophobicContact CZ2-CD 4.45Å; W321-K325 HydrophobicContact CZ2-CG 4.42Å; W321-K325 VanDerWaalsContact O-CB 3.26Å; W321-K325 WeakPolarHBondContact O-CB 3.47Å; W321-K325 PolarHBondContact O-N 3.5Å; F322-K325 PolarHBondContact O-N 2.72Å; K325-S328 PolarHBondContact O-N 2.98Å; K325-V329 WeakPolarHBondContact O-CB 3.25Å; K325-V329 VanDerWaalsContact O-CG2 3.28Å; K325-V329 WeakPolarHBondContact O-CG2 3.43Å; K325-V329 PolarHBondContact O-N 3.17Å
326I78.9Confident77.7Confident77 Ų7799.7 Ų99.740%0.39552%0.516SS..Hα-helixtrans-61.5-46.2174.4-67.9169.6000109.5F322 S328 V329 V330F322-I326 WeakPolarHBondContact O-CB 3.29Å; F322-I326 VanDerWaalsContact O-CG1 3.25Å; F322-I326 WeakPolarHBondContact O-CG1 3.4Å; F322-I326 PolarHBondContact O-N 3Å; I326-S328 VanDerWaalsContact C-N 3.31Å; I326-S328 PolarHBondContact O-N 3.11Å; I326-V329 PolarHBondContact O-N 3.06Å; I326-V330 HydrophobicContact CG2-CG2 4.04Å; I326-V330 WeakPolarHBondContact O-CB 3.42Å; I326-V330 WeakPolarHBondContact O-CG2 3.47Å; I326-V330 PolarHBondContact O-N 3.39Å
327R81.8Confident77.8Confident201 Ų201104 Ų10476%0.75854%0.537SS*.Hα-helixtrans-59.5-41.3176.2-175.8175.4178.2166.40.3112.5A323 S331A323-R327 WeakPolarHBondContact O-CB 3.25Å; A323-R327 PolarHBondContact O-N 3.18Å; R327-S331 VanDerWaalsContact O-CB 3.31Å; R327-S331 WeakPolarHBondContact O-CB 3.3Å; R327-S331 PolarHBondContact O-N 3.48Å
328S77.9Confident77.5Confident66 Ų66105.8 Ų105.846%0.46254%0.542SS..Hα-helixtrans-66.4-41.7176.6175.70000112.4C324 K325 I326 L332C324-S328 WeakPolarHBondContact O-CB 3.47Å; C324-S328 PolarHBondContact O-N 2.97Å; K325-S328 PolarHBondContact O-N 2.98Å; I326-S328 VanDerWaalsContact C-N 3.31Å; I326-S328 PolarHBondContact O-N 3.11Å; S328-L332 WeakPolarHBondContact O-CB 3.31Å; S328-L332 PolarHBondContact O-N 3Å
329V78.8Confident77.5Confident72 Ų72108 Ų10844%0.43655%0.552SS.*Hα-helixtrans-68.8-42.1177.7170.80000111.2K325 I326 L332 L333K325-V329 WeakPolarHBondContact O-CB 3.25Å; K325-V329 VanDerWaalsContact O-CG2 3.28Å; K325-V329 WeakPolarHBondContact O-CG2 3.43Å; K325-V329 PolarHBondContact O-N 3.17Å; I326-V329 PolarHBondContact O-N 3.06Å; V329-L332 PolarHBondContact O-N 3.41Å; V329-L333 HydrophobicContact CG1-CD1 4.1Å; V329-L333 WeakPolarHBondContact O-CB 3.41Å; V329-L333 PolarHBondContact O-N 3.47Å
330V81.6Confident77.3Confident72 Ų72107.4 Ų107.444%0.43656%0.558SS.*Hα-helixtrans-64.7-42.3176.2170.60000110.9I326 L332 L333 I334I326-V330 HydrophobicContact CG2-CG2 4.04Å; I326-V330 WeakPolarHBondContact O-CB 3.42Å; I326-V330 WeakPolarHBondContact O-CG2 3.47Å; I326-V330 PolarHBondContact O-N 3.39Å; V330-L332 VanDerWaalsContact C-N 3.32Å; V330-L332 PolarHBondContact O-N 3.48Å; V330-L333 PolarHBondContact O-N 3.33Å; V330-I334 HydrophobicContact CG1-CD1 3.67Å; V330-I334 HydrophobicContact CG1-CG1 4.46Å; V330-I334 WeakPolarHBondContact O-CD1 3.33Å; V330-I334 VanDerWaalsContact O-CG1 3.24Å; V330-I334 WeakPolarHBondContact O-CG1 3.4Å; V330-I334 PolarHBondContact O-N 2.72Å
331S79.1Confident77Confident61 Ų61103.5 Ų103.543%0.42755%0.553SS.*Hα-helixtrans-59.3-43.7173.7-168.30000111.5R327 L333 I334 D335R327-S331 VanDerWaalsContact O-CB 3.31Å; R327-S331 WeakPolarHBondContact O-CB 3.3Å; R327-S331 PolarHBondContact O-N 3.48Å; S331-L333 VanDerWaalsContact C-N 3.32Å; S331-L333 PolarHBondContact O-N 3.11Å; S331-I334 PolarHBondContact O-N 3.44Å; S331-D335 PolarHBondContact O-N 3.49Å; S331-D335 VanDerWaalsContact O-N 3.09Å
332L78.9Confident76.7Confident123 Ų123100.6 Ų100.664%0.64455%0.553SS**Hα-helixtrans-69.5-29.6-179.4-162.8133.6000112.8S328 V329 V330 T336S328-L332 WeakPolarHBondContact O-CB 3.31Å; S328-L332 PolarHBondContact O-N 3Å; V329-L332 PolarHBondContact O-N 3.41Å; V330-L332 VanDerWaalsContact C-N 3.32Å; V330-L332 PolarHBondContact O-N 3.48Å; L332-T336 PolarHBondContact O-OG1 3.5Å
333L76.1Confident76.5Confident123 Ų123105.9 Ų105.964%0.64458%0.584SS**Hα-helixtrans-76.1-25.2173.1-106.1149.2000113.6V329 V330 S331V329-L333 HydrophobicContact CG1-CD1 4.1Å; V329-L333 WeakPolarHBondContact O-CB 3.41Å; V329-L333 PolarHBondContact O-N 3.47Å; V330-L333 PolarHBondContact O-N 3.33Å; S331-L333 VanDerWaalsContact C-N 3.32Å; S331-L333 PolarHBondContact O-N 3.11Å
334I76.8Confident76.2Confident127 Ų127109.4 Ų109.465%0.65159%0.591SS**Hα-helixtrans-83.1-27.1176.3-68.6164.7000110.9V330 S331V330-I334 HydrophobicContact CG1-CD1 3.67Å; V330-I334 HydrophobicContact CG1-CG1 4.46Å; V330-I334 WeakPolarHBondContact O-CD1 3.33Å; V330-I334 VanDerWaalsContact O-CG1 3.24Å; V330-I334 WeakPolarHBondContact O-CG1 3.4Å; V330-I334 PolarHBondContact O-N 2.72Å; S331-I334 PolarHBondContact O-N 3.44Å
335D65.9Low75.9Confident136 Ų136111.1 Ų111.173%0.72759%0.59SS**  trans-86.54178.1-74.9-32.8000114.3S331S331-D335 PolarHBondContact O-N 3.49Å; S331-D335 VanDerWaalsContact O-N 3.09Å
336T53.9Low75.4Confident168 Ų168111.5 Ų111.5100%1.03160%0.601SS**  trans-108.60175.8-50.80000111.1L332L332-T336 PolarHBondContact O-OG1 3.5Å

Retrieved 336 of 336 residues in 270 ms (Link to these results)