A0A087YI02_POEFO Loading...

N-myc-interactor

AlphaFold DB , UniProt , Accession A0A087YI02, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 370 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
1M46.3Very low52.3Low249 Ų249122.5 Ų122.5100%1.22766%0.664SS**  080.50-62.7-170.7-144.800110.6
2S46.1Very low53.8Low94 Ų94119.3 Ų119.366%0.65765%0.646SS**  trans-168.226.4170.1-154.50000114.6
3S42.9Very low55.2Low86 Ų86114 Ų11460%0.60163%0.629SS**SBendtrans-121.5-11.4-177.1-55.10000114.3
4I47.4Very low56.6Low141 Ų141114.4 Ų114.472%0.72362%0.621SS**SBendtrans-82.2-40.6-177.9-62.5171.9000111K6 M7 D8I4-K6 PolarHBondContact O-N 3.28Å; I4-M7 PolarHBondContact O-N 3.37Å; I4-M7 VanDerWaalsContact O-N 3.13Å; I4-D8 PolarHBondContact O-N 3.49Å
5A46.9Very low58Low78 Ų78115.4 Ų115.465%0.64562%0.617SS**Hα-helixtrans-71.7-12.7176.100000114.2
6K51.2Low59.3Low155 Ų155116.4 Ų116.467%0.67462%0.617SS**Hα-helixtrans-86.8-20.6172.3-75.3-175.8177.4179.30112.4I4 L10I4-K6 PolarHBondContact O-N 3.28Å; K6-L10 WeakPolarHBondContact O-CB 3.47Å; K6-L10 PolarHBondContact O-N 2.88Å
7M50.8Low60.4Low120 Ų120115.2 Ų115.259%0.59161%0.611SS**Hα-helixtrans-83.1-43.8179.8-72.9176.979.900111.2I4 N9 L10 E11I4-M7 PolarHBondContact O-N 3.37Å; I4-M7 VanDerWaalsContact O-N 3.13Å; M7-N9 PolarHBondContact O-N 3.24Å; M7-L10 PolarHBondContact O-N 3.22Å; M7-E11 WeakPolarHBondContact O-CB 3.28Å; M7-E11 PolarHBondContact O-N 3.13Å
8D53.9Low61.6Low107 Ų107117.9 Ų117.957%0.57262%0.616SS**Hα-helixtrans-64.9-41.1176.2-72.7-22.3000112.7I4 L10 E11 D12I4-D8 PolarHBondContact O-N 3.49Å; D8-L10 VanDerWaalsContact C-N 3.28Å; D8-L10 PolarHBondContact O-N 3.48Å; D8-E11 PolarHBondContact O-N 3.13Å; D8-D12 PolarHBondContact O-N 3.33Å
9N60.3Low62.7Low125 Ų125116.6 Ų116.667%0.66861%0.606SS**Hα-helixtrans-66-28.6174.6-114.3-18.8000113.1M7 A13M7-N9 PolarHBondContact O-N 3.24Å; N9-A13 WeakPolarHBondContact O-CB 3.43Å; N9-A13 PolarHBondContact O-N 3.39Å
10L61.8Low63.6Low92 Ų92116 Ų11648%0.48260%0.604SS.*Hα-helixtrans-79.8-35.7176.1-169.683000111K6 M7 D8 K14K6-L10 WeakPolarHBondContact O-CB 3.47Å; K6-L10 PolarHBondContact O-N 2.88Å; M7-L10 PolarHBondContact O-N 3.22Å; D8-L10 VanDerWaalsContact C-N 3.28Å; D8-L10 PolarHBondContact O-N 3.48Å; L10-K14 HydrophobicContact CG-CD 4.48Å; L10-K14 VanDerWaalsContact O-CB 3.28Å; L10-K14 WeakPolarHBondContact O-CB 3.45Å; L10-K14 WeakPolarHBondContact O-CG 3.17Å; L10-K14 PolarHBondContact O-N 2.86Å
11E67.3Low64.4Low100 Ų100117.1 Ų117.147%0.46760%0.604SS.*Hα-helixtrans-66.3-44.8177.3-145.180.9-15200111M7 D8 K14 K15M7-E11 WeakPolarHBondContact O-CB 3.28Å; M7-E11 PolarHBondContact O-N 3.13Å; D8-E11 PolarHBondContact O-N 3.13Å; E11-K14 PolarHBondContact O-N 3.03Å; E11-K15 WeakPolarHBondContact O-CG 3.21Å; E11-K15 PolarHBondContact O-N 2.97Å
12D70.3Confident66.4Low84 Ų84110.9 Ų110.945%0.44957%0.567SS.*Hα-helixtrans-73.5-40.2178.5-73.9-22.3000112.1D8 K14 K15 E16D8-D12 PolarHBondContact O-N 3.33Å; D12-K14 VanDerWaalsContact C-N 3.27Å; D12-K14 PolarHBondContact O-N 2.99Å; D12-K15 PolarHBondContact O-N 3.19Å; D12-K15 VanDerWaalsContact O-N 3.13Å; D12-K15 IonicContact OD1-NZ 3.61Å; D12-E16 PolarHBondContact O-N 3.36Å
13A72.1Confident68.3Low51 Ų51111.8 Ų111.842%0.42156%0.559SS.*Hα-helixtrans-61.7-34.1171.100000112.4N9 L17N9-A13 WeakPolarHBondContact O-CB 3.43Å; N9-A13 PolarHBondContact O-N 3.39Å; A13-L17 WeakPolarHBondContact O-CB 3.38Å; A13-L17 PolarHBondContact O-N 2.89Å
14K74.6Confident70.4Confident119 Ų119111.8 Ų111.852%0.51756%0.555SS.*Hα-helixtrans-69.1-37.9173.3-81.9172.5-178.7174.60112.4L10 E11 D12 K18L10-K14 HydrophobicContact CG-CD 4.48Å; L10-K14 VanDerWaalsContact O-CB 3.28Å; L10-K14 WeakPolarHBondContact O-CB 3.45Å; L10-K14 WeakPolarHBondContact O-CG 3.17Å; L10-K14 PolarHBondContact O-N 2.86Å; E11-K14 PolarHBondContact O-N 3.03Å; D12-K14 VanDerWaalsContact C-N 3.27Å; D12-K14 PolarHBondContact O-N 2.99Å; K14-K18 VanDerWaalsContact O-CB 3.29Å; K14-K18 WeakPolarHBondContact O-CB 3.29Å; K14-K18 PolarHBondContact O-N 2.77Å
15K78.4Confident72.3Confident130 Ų130110.9 Ų110.957%0.56555%0.547SS*.Hα-helixtrans-66.9-45.8174.4-74.5174.6-170.4160.40111.5E11 D12 K18 E19E11-K15 WeakPolarHBondContact O-CG 3.21Å; E11-K15 PolarHBondContact O-N 2.97Å; D12-K15 PolarHBondContact O-N 3.19Å; D12-K15 VanDerWaalsContact O-N 3.13Å; D12-K15 IonicContact OD1-NZ 3.61Å; K15-K18 WeakPolarHBondContact O-CB 3.15Å; K15-K18 PolarHBondContact O-N 2.88Å; K15-E19 PolarHBondContact O-N 3.18Å
16E79.3Confident74.3Confident132 Ų132112.5 Ų112.562%0.61754%0.54SS*.Hα-helixtrans-62.4-43175.6-75.2-173.1168.800111.8D12 K18 E19 L20D12-E16 PolarHBondContact O-N 3.36Å; E16-K18 VanDerWaalsContact C-N 3.31Å; E16-K18 PolarHBondContact O-N 3.2Å; E16-E19 PolarHBondContact O-N 3.43Å; E16-L20 WeakPolarHBondContact O-CB 3.37Å; E16-L20 WeakPolarHBondContact O-CG 3.36Å; E16-L20 PolarHBondContact O-N 2.9Å
17L77.8Confident76Confident96 Ų96107.8 Ų107.850%0.50353%0.53SS..Hα-helixtrans-64.3-36.6175.9-171.2124.1000111.8A13 K21A13-L17 WeakPolarHBondContact O-CB 3.38Å; A13-L17 PolarHBondContact O-N 2.89Å; L17-K21 HydrophobicContact CD2-CD 4.1Å; L17-K21 VanDerWaalsContact O-CB 3.31Å; L17-K21 WeakPolarHBondContact O-CB 3.25Å; L17-K21 VanDerWaalsContact O-CG 3.25Å; L17-K21 WeakPolarHBondContact O-CG 3.31Å; L17-K21 PolarHBondContact O-N 3.32Å
18K80.9Confident77.7Confident164 Ų164106.4 Ų106.471%0.71353%0.525SS*.Hα-helixtrans-67.4-38.5173.9-169.3176-177.7179.60111.6K14 K15 E16 R22K14-K18 VanDerWaalsContact O-CB 3.29Å; K14-K18 WeakPolarHBondContact O-CB 3.29Å; K14-K18 PolarHBondContact O-N 2.77Å; K15-K18 WeakPolarHBondContact O-CB 3.15Å; K15-K18 PolarHBondContact O-N 2.88Å; E16-K18 VanDerWaalsContact C-N 3.31Å; E16-K18 PolarHBondContact O-N 3.2Å; K18-R22 PolarHBondContact O-N 3.07Å
19E83.2Confident79.4Confident92 Ų92105.6 Ų105.643%0.4352%0.52SS..Hα-helixtrans-72.8-39.7177.2-176.7155.4-170.900112.9K15 E16 R22 K23K15-E19 PolarHBondContact O-N 3.18Å; E16-E19 PolarHBondContact O-N 3.43Å; E19-R22 PolarHBondContact O-N 2.97Å; E19-R22 IonicContact OE1-NH2 3.78Å; E19-K23 HydrophobicContact CG-CD 4.46Å; E19-K23 WeakPolarHBondContact O-CG 3.14Å; E19-K23 PolarHBondContact O-N 2.93Å; E19-K23 IonicContact OE1-NZ 2.79Å
20L80.5Confident80.9Confident105 Ų105101.3 Ų101.355%0.5550%0.502SS..Hα-helixtrans-64.3-42.4172.7-76.1169.1000111.2E16 R22 K23 V24E16-L20 WeakPolarHBondContact O-CB 3.37Å; E16-L20 WeakPolarHBondContact O-CG 3.36Å; E16-L20 PolarHBondContact O-N 2.9Å; L20-R22 VanDerWaalsContact C-N 3.34Å; L20-R22 PolarHBondContact O-N 3.39Å; L20-K23 PolarHBondContact O-N 3.07Å; L20-K23 VanDerWaalsContact O-N 3.14Å; L20-V24 WeakPolarHBondContact O-CG2 3.31Å; L20-V24 PolarHBondContact O-N 2.99Å
21K81.6Confident82.2Confident139 Ų139103.4 Ų103.460%0.60451%0.508SS*.Hα-helixtrans-57.6-45.2172.1-81.3179.4176.4-1760112L17 K23 V24 E25L17-K21 HydrophobicContact CD2-CD 4.1Å; L17-K21 VanDerWaalsContact O-CB 3.31Å; L17-K21 WeakPolarHBondContact O-CB 3.25Å; L17-K21 VanDerWaalsContact O-CG 3.25Å; L17-K21 WeakPolarHBondContact O-CG 3.31Å; L17-K21 PolarHBondContact O-N 3.32Å; K21-K23 VanDerWaalsContact C-N 3.33Å; K21-K23 PolarHBondContact O-N 2.93Å; K21-V24 PolarHBondContact O-N 3.01Å; K21-E25 WeakPolarHBondContact O-CB 3.41Å; K21-E25 PolarHBondContact O-N 3.41Å
22R86.4Confident83.3Confident119 Ų119101.2 Ų101.245%0.44951%0.506SS..Hα-helixtrans-63.1-37.1175.3-169.9-170.570136.4-4.1112.4K18 E19 L20 K26K18-R22 PolarHBondContact O-N 3.07Å; E19-R22 PolarHBondContact O-N 2.97Å; E19-R22 IonicContact OE1-NH2 3.78Å; L20-R22 VanDerWaalsContact C-N 3.34Å; L20-R22 PolarHBondContact O-N 3.39Å; R22-K26 WeakPolarHBondContact O-CB 3.29Å; R22-K26 VanDerWaalsContact O-CG 3.29Å; R22-K26 WeakPolarHBondContact O-CG 3.49Å; R22-K26 PolarHBondContact O-N 2.88Å
23K86.8Confident84.4Confident113 Ų113105 Ų10549%0.49151%0.514SS..Hα-helixtrans-70.1-39.4177-75.7175.6-178.1172.50111.6E19 L20 K21 A27E19-K23 HydrophobicContact CG-CD 4.46Å; E19-K23 WeakPolarHBondContact O-CG 3.14Å; E19-K23 PolarHBondContact O-N 2.93Å; E19-K23 IonicContact OE1-NZ 2.79Å; L20-K23 PolarHBondContact O-N 3.07Å; L20-K23 VanDerWaalsContact O-N 3.14Å; K21-K23 VanDerWaalsContact C-N 3.33Å; K21-K23 PolarHBondContact O-N 2.93Å; K23-A27 VanDerWaalsContact O-CB 3.3Å; K23-A27 WeakPolarHBondContact O-CB 3.3Å; K23-A27 PolarHBondContact O-N 3.14Å
24V86.5Confident85.3Confident85 Ų85107.8 Ų107.852%0.51552%0.522SS..Hα-helixtrans-64.4-47.8174171.30000110.3L20 K21 K26 A27 D28L20-V24 WeakPolarHBondContact O-CG2 3.31Å; L20-V24 PolarHBondContact O-N 2.99Å; K21-V24 PolarHBondContact O-N 3.01Å; V24-K26 PolarHBondContact O-N 2.84Å; V24-A27 CarbonylContact O-C 3.58Å; V24-A27 WeakPolarHBondContact O-CB 3.33Å; V24-A27 PolarHBondContact O-N 3.44Å; V24-D28 WeakPolarHBondContact O-CB 3.46Å; V24-D28 PolarHBondContact O-N 3.19Å
25E86.9Confident86.1Confident122 Ų122105.7 Ų105.757%0.5752%0.519SS*.Hα-helixtrans-57.3-46.9175.8-174.4177.2-161.500111.8K21 A27 D28 D29K21-E25 WeakPolarHBondContact O-CB 3.41Å; K21-E25 PolarHBondContact O-N 3.41Å; E25-A27 VanDerWaalsContact C-N 3.32Å; E25-A27 PolarHBondContact O-N 3.44Å; E25-D28 PolarHBondContact O-N 3.1Å; E25-D29 WeakPolarHBondContact O-CB 3.34Å; E25-D29 VanDerWaalsContact O-CG 3.32Å; E25-D29 PolarHBondContact O-N 3.28Å
26K89.2Confident86.7Confident113 Ų113104.4 Ų104.449%0.49152%0.517SS..Hα-helixtrans-63-36174.4-76.6-178.5176.1-166.20113.6R22 V24 A30R22-K26 WeakPolarHBondContact O-CB 3.29Å; R22-K26 VanDerWaalsContact O-CG 3.29Å; R22-K26 WeakPolarHBondContact O-CG 3.49Å; R22-K26 PolarHBondContact O-N 2.88Å; V24-K26 PolarHBondContact O-N 2.84Å; K26-A30 VanDerWaalsContact O-CB 3.31Å; K26-A30 WeakPolarHBondContact O-CB 3.34Å; K26-A30 PolarHBondContact O-N 3.33Å
27A87.9Confident87.3Confident56 Ų56103 Ų10346%0.46351%0.511SS..Hα-helixtrans-72-37.7177.600000111.2K23 V24 E25 A30 K31K23-A27 VanDerWaalsContact O-CB 3.3Å; K23-A27 WeakPolarHBondContact O-CB 3.3Å; K23-A27 PolarHBondContact O-N 3.14Å; V24-A27 CarbonylContact O-C 3.58Å; V24-A27 WeakPolarHBondContact O-CB 3.33Å; V24-A27 PolarHBondContact O-N 3.44Å; E25-A27 VanDerWaalsContact C-N 3.32Å; E25-A27 PolarHBondContact O-N 3.44Å; A27-A30 PolarHBondContact O-N 2.83Å; A27-K31 VanDerWaalsContact O-CB 3.27Å; A27-K31 WeakPolarHBondContact O-CB 3.37Å; A27-K31 PolarHBondContact O-N 3.39Å
28D87.1Confident88.1Confident90 Ų90104.4 Ų104.448%0.48151%0.513SS..Hα-helixtrans-67.5-41.7174.4-74.3-27.9000111.1V24 E25 A30 K31 A32V24-D28 WeakPolarHBondContact O-CB 3.46Å; V24-D28 PolarHBondContact O-N 3.19Å; E25-D28 PolarHBondContact O-N 3.1Å; D28-A30 PolarHBondContact O-N 3.48Å; D28-K31 PolarHBondContact O-N 2.86Å; D28-A32 WeakPolarHBondContact O-CB 3.27Å; D28-A32 PolarHBondContact O-N 3.38Å
29D89.3Confident88.6Confident90 Ų90101.5 Ų101.548%0.48151%0.505SS..Hα-helixtrans-63.7-38.6172.7-74-18.9000112.4E25 R33E25-D29 WeakPolarHBondContact O-CB 3.34Å; E25-D29 VanDerWaalsContact O-CG 3.32Å; E25-D29 PolarHBondContact O-N 3.28Å; D29-R33 WeakPolarHBondContact O-CG 3.46Å; D29-R33 PolarHBondContact O-N 2.81Å; D29-R33 VanDerWaalsContact O-N 3.1Å; D29-R33 PolarHBondContact O-NE 3.28Å
30A90.8Very high89Confident35 Ų35102.9 Ų102.929%0.28951%0.511SS..Hα-helixtrans-68.3-41.6174.600000111.4K26 A27 D28 R33 L34K26-A30 VanDerWaalsContact O-CB 3.31Å; K26-A30 WeakPolarHBondContact O-CB 3.34Å; K26-A30 PolarHBondContact O-N 3.33Å; A27-A30 PolarHBondContact O-N 2.83Å; D28-A30 PolarHBondContact O-N 3.48Å; A30-R33 PolarHBondContact O-N 2.78Å; A30-L34 WeakPolarHBondContact O-CG 3.49Å; A30-L34 PolarHBondContact O-N 2.84Å
31K89.8Confident89.6Confident137 Ų137103.7 Ų103.760%0.59651%0.512SS*.Hα-helixtrans-63.5-43.8175.9-176.5-177.8176.6-1740111.4A27 D28 L34 V35A27-K31 VanDerWaalsContact O-CB 3.27Å; A27-K31 WeakPolarHBondContact O-CB 3.37Å; A27-K31 PolarHBondContact O-N 3.39Å; D28-K31 PolarHBondContact O-N 2.86Å; K31-L34 PolarHBondContact O-N 3.3Å; K31-V35 VanDerWaalsContact O-CG2 3.26Å; K31-V35 WeakPolarHBondContact O-CG2 3.42Å; K31-V35 PolarHBondContact O-N 3.45Å
32A90Very high90Very high53 Ų53100.3 Ų100.344%0.43850%0.501SS..Hα-helixtrans-61.4-43.8176.500000111.6D28 V35 L36D28-A32 WeakPolarHBondContact O-CB 3.27Å; D28-A32 PolarHBondContact O-N 3.38Å; A32-V35 PolarHBondContact O-N 2.91Å; A32-L36 WeakPolarHBondContact O-CG 3.5Å; A32-L36 PolarHBondContact O-N 3.41Å
33R92.6Very high90.4Very high163 Ų163100.6 Ų100.662%0.61551%0.507SS*.Hα-helixtrans-60.9-47.2174.2-78-179.1-70.5173.50.2112.7D29 A30 V35 L36 E37D29-R33 WeakPolarHBondContact O-CG 3.46Å; D29-R33 PolarHBondContact O-N 2.81Å; D29-R33 VanDerWaalsContact O-N 3.1Å; D29-R33 PolarHBondContact O-NE 3.28Å; A30-R33 PolarHBondContact O-N 2.78Å; R33-V35 VanDerWaalsContact C-N 3.28Å; R33-V35 PolarHBondContact O-N 3.12Å; R33-L36 PolarHBondContact O-N 2.95Å; R33-E37 WeakPolarHBondContact O-CB 3.25Å; R33-E37 PolarHBondContact O-N 3.38Å
34L92.4Very high90.7Very high110 Ų110100.9 Ų100.958%0.57651%0.514SS*.Hα-helixtrans-63.7-33.6177.9-73.1171.1000112.6A30 K31 K38A30-L34 WeakPolarHBondContact O-CG 3.49Å; A30-L34 PolarHBondContact O-N 2.84Å; K31-L34 PolarHBondContact O-N 3.3Å; L34-K38 VanDerWaalsContact O-CB 3.25Å; L34-K38 WeakPolarHBondContact O-CB 3.46Å; L34-K38 PolarHBondContact O-N 2.95Å
35V91.6Very high91Very high76 Ų76103.4 Ų103.446%0.46152%0.517SS..Hα-helixtrans-68.3-41174.9169.70000111K31 A32 R33 L39K31-V35 VanDerWaalsContact O-CG2 3.26Å; K31-V35 WeakPolarHBondContact O-CG2 3.42Å; K31-V35 PolarHBondContact O-N 3.45Å; A32-V35 PolarHBondContact O-N 2.91Å; R33-V35 VanDerWaalsContact C-N 3.28Å; R33-V35 PolarHBondContact O-N 3.12Å; V35-L39 HydrophobicContact CG1-CD1 4.15Å; V35-L39 WeakPolarHBondContact O-CB 3.24Å; V35-L39 VanDerWaalsContact O-CG 3.27Å; V35-L39 WeakPolarHBondContact O-CG 3.24Å; V35-L39 PolarHBondContact O-N 2.85Å
36L90.9Very high91.3Very high102 Ų102102 Ų10253%0.53451%0.511SS..Hα-helixtrans-64.6-48175.3-70.9171.6000111.5A32 R33 K38 L39 E40A32-L36 WeakPolarHBondContact O-CG 3.5Å; A32-L36 PolarHBondContact O-N 3.41Å; R33-L36 PolarHBondContact O-N 2.95Å; L36-K38 VanDerWaalsContact C-N 3.34Å; L36-K38 PolarHBondContact O-N 2.91Å; L36-L39 PolarHBondContact O-N 3.19Å; L36-L39 VanDerWaalsContact O-N 3.12Å; L36-E40 WeakPolarHBondContact O-CG 3.45Å; L36-E40 PolarHBondContact O-N 3.04Å
37E92Very high91.4Very high104 Ų104100.5 Ų100.549%0.48651%0.508SS..Hα-helixtrans-59.8-43177.3-175.9173.9-158.700111.7R33 L39 E40 E41R33-E37 WeakPolarHBondContact O-CB 3.25Å; R33-E37 PolarHBondContact O-N 3.38Å; E37-L39 PolarHBondContact O-N 2.93Å; E37-E40 PolarHBondContact O-N 3.32Å; E37-E41 WeakPolarHBondContact O-CB 3.36Å; E37-E41 WeakPolarHBondContact O-CG 3.32Å; E37-E41 PolarHBondContact O-N 3.36Å
38K93.5Very high91.6Very high125 Ų125100.5 Ų100.554%0.54351%0.508SS..Hα-helixtrans-61.3-42.6174.4-172.4-159.7169.6-161.80112L34 L36 E40 E41 D42L34-K38 VanDerWaalsContact O-CB 3.25Å; L34-K38 WeakPolarHBondContact O-CB 3.46Å; L34-K38 PolarHBondContact O-N 2.95Å; L36-K38 VanDerWaalsContact C-N 3.34Å; L36-K38 PolarHBondContact O-N 2.91Å; K38-E40 VanDerWaalsContact C-N 3.35Å; K38-E41 PolarHBondContact O-N 2.88Å; K38-D42 VanDerWaalsContact CE-OD2 3.32Å; K38-D42 WeakPolarHBondContact CE-OD2 3.34Å; K38-D42 IonicContact NZ-OD2 3.14Å; K38-D42 WeakPolarHBondContact O-CB 3.26Å; K38-D42 PolarHBondContact O-N 3.38Å
39L92.1Very high91.9Very high103 Ų103100.3 Ų100.354%0.53950%0.503SS..Hα-helixtrans-64.8-41178.2-74.5170.9000111.2V35 L36 E37 D42 E43V35-L39 HydrophobicContact CG1-CD1 4.15Å; V35-L39 WeakPolarHBondContact O-CB 3.24Å; V35-L39 VanDerWaalsContact O-CG 3.27Å; V35-L39 WeakPolarHBondContact O-CG 3.24Å; V35-L39 PolarHBondContact O-N 2.85Å; L36-L39 PolarHBondContact O-N 3.19Å; L36-L39 VanDerWaalsContact O-N 3.12Å; E37-L39 PolarHBondContact O-N 2.93Å; L39-D42 PolarHBondContact O-N 3.35Å; L39-E43 WeakPolarHBondContact O-CB 3.42Å; L39-E43 PolarHBondContact O-N 3.41Å
40E91.8Very high92Very high121 Ų12199.7 Ų99.757%0.56550%0.503SS*.Hα-helixtrans-63-44.3173.8-70.9173.3-170.200111.3L36 E37 K38 E43 L44L36-E40 WeakPolarHBondContact O-CG 3.45Å; L36-E40 PolarHBondContact O-N 3.04Å; E37-E40 PolarHBondContact O-N 3.32Å; K38-E40 VanDerWaalsContact C-N 3.35Å; E40-E43 PolarHBondContact O-N 3.4Å; E40-L44 WeakPolarHBondContact O-CB 3.27Å; E40-L44 VanDerWaalsContact O-CG 3.24Å; E40-L44 WeakPolarHBondContact O-CG 3.5Å; E40-L44 PolarHBondContact O-N 3.39Å
41E91.5Very high92.2Very high121 Ų121104 Ų10457%0.56552%0.517SS*.Hα-helixtrans-64.1-42.1175.3-77.3-172164.200112.9E37 K38 E43 L44 K45E37-E41 WeakPolarHBondContact O-CB 3.36Å; E37-E41 WeakPolarHBondContact O-CG 3.32Å; E37-E41 PolarHBondContact O-N 3.36Å; K38-E41 PolarHBondContact O-N 2.88Å; E41-E43 VanDerWaalsContact C-N 3.34Å; E41-L44 PolarHBondContact O-N 2.94Å; E41-K45 VanDerWaalsContact O-CB 3.24Å; E41-K45 WeakPolarHBondContact O-CB 3.39Å; E41-K45 PolarHBondContact O-N 3.45Å
42D91.7Very high92.3Very high68 Ų68103.4 Ų103.436%0.36452%0.518SS..Hα-helixtrans-64.9-38.9177.1-80.1-27.2000110.7K38 L39 K45 E46K38-D42 VanDerWaalsContact CE-OD2 3.32Å; K38-D42 WeakPolarHBondContact CE-OD2 3.34Å; K38-D42 IonicContact NZ-OD2 3.14Å; K38-D42 WeakPolarHBondContact O-CB 3.26Å; K38-D42 PolarHBondContact O-N 3.38Å; L39-D42 PolarHBondContact O-N 3.35Å; D42-K45 PolarHBondContact O-N 2.84Å; D42-E46 PolarHBondContact O-N 2.91Å
43E93.6Very high92.4Very high126 Ų126106.4 Ų106.459%0.58952%0.524SS*.Hα-helixtrans-65.9-46.7173.9-173.6175.8-177.300111.6L39 E40 E41 K45 E46 N47L39-E43 WeakPolarHBondContact O-CB 3.42Å; L39-E43 PolarHBondContact O-N 3.41Å; E40-E43 PolarHBondContact O-N 3.4Å; E41-E43 VanDerWaalsContact C-N 3.34Å; E43-K45 VanDerWaalsContact C-N 3.27Å; E43-K45 PolarHBondContact O-N 3.02Å; E43-E46 PolarHBondContact O-N 3.46Å; E43-N47 WeakPolarHBondContact O-CB 3.32Å; E43-N47 PolarHBondContact O-N 2.96Å; E43-N47 PolarHBondContact O-ND2 2.93Å
44L93Very high92.5Very high119 Ų119101.1 Ų101.162%0.62352%0.515SS*.Hα-helixtrans-59.5-38.4174.5-73.3173000111.8E40 E41 A48E40-L44 WeakPolarHBondContact O-CB 3.27Å; E40-L44 VanDerWaalsContact O-CG 3.24Å; E40-L44 WeakPolarHBondContact O-CG 3.5Å; E40-L44 PolarHBondContact O-N 3.39Å; E41-L44 PolarHBondContact O-N 2.94Å; L44-A48 VanDerWaalsContact O-CB 3.27Å; L44-A48 WeakPolarHBondContact O-CB 3.27Å; L44-A48 PolarHBondContact O-N 3.33Å
45K93.3Very high92.5Very high137 Ų137102.2 Ų102.260%0.59652%0.517SS*.Hα-helixtrans-68.5-44.7178.4-178.5-177.6175.3-174.50112.4E41 D42 E43 A48 K49E41-K45 VanDerWaalsContact O-CB 3.24Å; E41-K45 WeakPolarHBondContact O-CB 3.39Å; E41-K45 PolarHBondContact O-N 3.45Å; D42-K45 PolarHBondContact O-N 2.84Å; E43-K45 VanDerWaalsContact C-N 3.27Å; E43-K45 PolarHBondContact O-N 3.02Å; K45-A48 PolarHBondContact O-N 2.89Å; K45-K49 VanDerWaalsContact O-CB 3.24Å; K45-K49 WeakPolarHBondContact O-CB 3.48Å; K45-K49 PolarHBondContact O-N 2.98Å
46E92.7Very high92.6Very high93 Ų93100.7 Ų100.744%0.43551%0.513SS..Hα-helixtrans-67.9-37175.6-75.9-61.2139.900111.4D42 E43 K49 T50D42-E46 PolarHBondContact O-N 2.91Å; E43-E46 PolarHBondContact O-N 3.46Å; E46-K49 PolarHBondContact O-N 2.87Å; E46-K49 IonicContact OE1-NZ 3.82Å; E46-K49 PolarHBondContact OE1-NZ 3.25Å; E46-K49 IonicContact OE2-NZ 2.67Å; E46-K49 PolarHBondContact OE2-NZ 2.84Å; E46-T50 WeakPolarHBondContact O-CG2 3.33Å; E46-T50 PolarHBondContact O-N 3.46Å; E46-T50 PolarHBondContact O-OG1 3.41Å; E46-T50 VanDerWaalsContact O-OG1 3.11Å
47N92.7Very high92.7Very high82 Ų8297.7 Ų97.744%0.43951%0.507SS..Hα-helixtrans-61.6-48.8171.9-72.2-18.5000111.5E43 K49 T50 E51E43-N47 WeakPolarHBondContact O-CB 3.32Å; E43-N47 PolarHBondContact O-N 2.96Å; E43-N47 PolarHBondContact O-ND2 2.93Å; N47-K49 VanDerWaalsContact C-N 3.29Å; N47-K49 PolarHBondContact O-N 2.86Å; N47-T50 PolarHBondContact O-N 3.27Å; N47-T50 PolarHBondContact O-OG1 3.32Å; N47-E51 WeakPolarHBondContact O-CG 3.24Å; N47-E51 PolarHBondContact O-N 3.36Å
48A91.2Very high92.8Very high55 Ų5599.8 Ų99.846%0.45551%0.514SS..Hα-helixtrans-60.9-37.5176.600000112.5L44 K45 M52L44-A48 VanDerWaalsContact O-CB 3.27Å; L44-A48 WeakPolarHBondContact O-CB 3.27Å; L44-A48 PolarHBondContact O-N 3.33Å; K45-A48 PolarHBondContact O-N 2.89Å; A48-M52 WeakPolarHBondContact O-CB 3.44Å; A48-M52 PolarHBondContact O-N 3.36Å
49K92.9Very high92.7Very high86 Ų8699.6 Ų99.637%0.37452%0.515SS..Hα-helixtrans-68.8-41.5177.8178.8178.5158.5-142.70112.3K45 E46 N47 M52 M53K45-K49 VanDerWaalsContact O-CB 3.24Å; K45-K49 WeakPolarHBondContact O-CB 3.48Å; K45-K49 PolarHBondContact O-N 2.98Å; E46-K49 PolarHBondContact O-N 2.87Å; E46-K49 IonicContact OE1-NZ 3.82Å; E46-K49 PolarHBondContact OE1-NZ 3.25Å; E46-K49 IonicContact OE2-NZ 2.67Å; E46-K49 PolarHBondContact OE2-NZ 2.84Å; N47-K49 VanDerWaalsContact C-N 3.29Å; N47-K49 PolarHBondContact O-N 2.86Å; K49-M52 PolarHBondContact O-N 2.84Å; K49-M53 HydrophobicContact CG-CE 4.27Å; K49-M53 WeakPolarHBondContact O-CG 3.39Å; K49-M53 PolarHBondContact O-N 3.43Å
50T92.7Very high92.8Very high78 Ų78100 Ų10048%0.47951%0.514SS..Hα-helixtrans-67.4-4017654.40000111.7E46 N47 M53 A54E46-T50 WeakPolarHBondContact O-CG2 3.33Å; E46-T50 PolarHBondContact O-N 3.46Å; E46-T50 PolarHBondContact O-OG1 3.41Å; E46-T50 VanDerWaalsContact O-OG1 3.11Å; N47-T50 PolarHBondContact O-N 3.27Å; N47-T50 PolarHBondContact O-OG1 3.32Å; T50-M53 PolarHBondContact O-N 2.91Å; T50-A54 WeakPolarHBondContact O-CB 3.48Å; T50-A54 PolarHBondContact O-N 2.92Å
51E93.9Very high92.7Very high125 Ų12597 Ų9758%0.58451%0.507SS*.Hα-helixtrans-62.5-43.6172.3-74.7-173175.500112.3N47 M53 A54 Q55N47-E51 WeakPolarHBondContact O-CG 3.24Å; N47-E51 PolarHBondContact O-N 3.36Å; E51-M53 VanDerWaalsContact C-N 3.34Å; E51-M53 PolarHBondContact O-N 3.22Å; E51-A54 PolarHBondContact O-N 3.45Å; E51-Q55 WeakPolarHBondContact O-CB 3.42Å; E51-Q55 WeakPolarHBondContact O-CG 3.37Å; E51-Q55 PolarHBondContact O-N 3.01Å
52M92.5Very high92.7Very high124 Ų12495 Ų9561%0.61151%0.505SS*.Hα-helixtrans-59.8-44.5176.2-171.7-172.878.800111.4A48 K49 Q55 A56A48-M52 WeakPolarHBondContact O-CB 3.44Å; A48-M52 PolarHBondContact O-N 3.36Å; K49-M52 PolarHBondContact O-N 2.84Å; M52-Q55 PolarHBondContact O-N 3.37Å; M52-A56 WeakPolarHBondContact O-CB 3.34Å; M52-A56 PolarHBondContact O-N 2.94Å
53M92.9Very high92.8Very high117 Ų11797.2 Ų97.258%0.57651%0.513SS*.Hα-helixtrans-64.2-40.8175.7-72.6-177.9177.100112.1K49 T50 E51 A56 G57K49-M53 HydrophobicContact CG-CE 4.27Å; K49-M53 WeakPolarHBondContact O-CG 3.39Å; K49-M53 PolarHBondContact O-N 3.43Å; T50-M53 PolarHBondContact O-N 2.91Å; E51-M53 VanDerWaalsContact C-N 3.34Å; E51-M53 PolarHBondContact O-N 3.22Å; M53-A56 PolarHBondContact O-N 2.89Å; M53-G57 PolarHBondContact O-N 2.93Å
54A94.3Very high92.8Very high52 Ų5297.1 Ų97.143%0.4351%0.511SS..Hα-helixtrans-65.8-39.4176.900000112.3T50 E51 K58T50-A54 WeakPolarHBondContact O-CB 3.48Å; T50-A54 PolarHBondContact O-N 2.92Å; E51-A54 PolarHBondContact O-N 3.45Å; A54-K58 WeakPolarHBondContact O-CG 3.38Å; A54-K58 PolarHBondContact O-N 3.32Å
55Q92.5Very high92.8Very high132 Ų13296.8 Ų96.862%0.61751%0.506SS*.Hα-helixtrans-67.3-43.4174.7-73.5-175.8500111.9E51 M52 G57 K58 Q59E51-Q55 WeakPolarHBondContact O-CB 3.42Å; E51-Q55 WeakPolarHBondContact O-CG 3.37Å; E51-Q55 PolarHBondContact O-N 3.01Å; M52-Q55 PolarHBondContact O-N 3.37Å; Q55-G57 VanDerWaalsContact C-N 3.34Å; Q55-G57 PolarHBondContact O-N 3.43Å; Q55-K58 PolarHBondContact O-N 3.11Å; Q55-Q59 WeakPolarHBondContact O-CB 3.44Å; Q55-Q59 PolarHBondContact O-N 2.91Å
56A92.6Very high92.8Very high44 Ų4496.9 Ų96.936%0.36451%0.507SS..Hα-helixtrans-59.8-44.3175.500000111.6M52 M53 K58 Q59 E60M52-A56 WeakPolarHBondContact O-CB 3.34Å; M52-A56 PolarHBondContact O-N 2.94Å; M53-A56 PolarHBondContact O-N 2.89Å; A56-K58 PolarHBondContact O-N 2.9Å; A56-Q59 PolarHBondContact O-N 3.04Å; A56-E60 PolarHBondContact O-N 2.85Å
57G93.7Very high92.9Very high40 Ų4096.4 Ų96.441%0.41251%0.51SS..Hα-helixtrans-62.1-41.4175.700000113.2M53 Q55 E60 S61M53-G57 PolarHBondContact O-N 2.93Å; Q55-G57 VanDerWaalsContact C-N 3.34Å; Q55-G57 PolarHBondContact O-N 3.43Å; G57-E60 PolarHBondContact O-N 3.38Å; G57-S61 PolarHBondContact O-N 2.9Å
58K93.6Very high93Very high148 Ų14897.8 Ų97.864%0.64351%0.514SS*.Hα-helixtrans-63.5-43.2173.7-73.6173.4-177.3177.90111.6A54 Q55 A56 E60 S61 C62A54-K58 WeakPolarHBondContact O-CG 3.38Å; A54-K58 PolarHBondContact O-N 3.32Å; Q55-K58 PolarHBondContact O-N 3.11Å; A56-K58 PolarHBondContact O-N 2.9Å; K58-E60 PolarHBondContact O-N 2.92Å; K58-S61 PolarHBondContact O-N 3.41Å; K58-C62 WeakPolarHBondContact O-CB 3.05Å; K58-C62 PolarHBondContact O-N 3.38Å; K58-C62 PolarHBondContact O-SG 2.94Å; K58-C62 VanDerWaalsContact O-SG 3.38Å
59Q92.8Very high93.2Very high121 Ų12199.2 Ų99.257%0.56551%0.514SS*.Hα-helixtrans-61.4-43.7177.9-178177.3-6.300111.8Q55 A56 C62 Q63Q55-Q59 WeakPolarHBondContact O-CB 3.44Å; Q55-Q59 PolarHBondContact O-N 2.91Å; A56-Q59 PolarHBondContact O-N 3.04Å; Q59-C62 PolarHBondContact O-N 3.46Å; Q59-Q63 WeakPolarHBondContact O-CB 3.26Å; Q59-Q63 PolarHBondContact O-N 3.5Å
60E93.1Very high93.3Very high111 Ų11199.8 Ų99.852%0.51952%0.521SS..Hα-helixtrans-62.9-42.6175.2-76-173.3-169.800112.3A56 G57 K58 Q63 K64A56-E60 PolarHBondContact O-N 2.85Å; G57-E60 PolarHBondContact O-N 3.38Å; K58-E60 PolarHBondContact O-N 2.92Å; E60-Q63 PolarHBondContact O-N 3.47Å; E60-K64 WeakPolarHBondContact O-CG 3.5Å; E60-K64 PolarHBondContact O-N 3.05Å
61S90.6Very high93.4Very high59 Ų59102.1 Ų102.141%0.41353%0.526SS..Hα-helixtrans-62-48.2176.9-163.90000111.2G57 K58 Q63 K64 E65G57-S61 PolarHBondContact O-N 2.9Å; K58-S61 PolarHBondContact O-N 3.41Å; S61-Q63 VanDerWaalsContact C-N 3.33Å; S61-Q63 PolarHBondContact O-N 3.28Å; S61-K64 PolarHBondContact O-N 3.24Å; S61-E65 PolarHBondContact O-N 3.47Å
62C91.3Very high93.5Very high77 Ų77101.4 Ų101.452%0.5252%0.521SS..Hα-helixtrans-62.7-37.9177.3-70.50000112.4K58 Q59 F66K58-C62 WeakPolarHBondContact O-CB 3.05Å; K58-C62 PolarHBondContact O-N 3.38Å; K58-C62 PolarHBondContact O-SG 2.94Å; K58-C62 VanDerWaalsContact O-SG 3.38Å; Q59-C62 PolarHBondContact O-N 3.46Å; C62-F66 VanDerWaalsContact O-CB 3.26Å; C62-F66 WeakPolarHBondContact O-CB 3.44Å; C62-F66 PolarHBondContact O-N 2.92Å
63Q92.4Very high93.6Very high115 Ų11599.3 Ų99.354%0.53752%0.515SS..Hα-helixtrans-64.4-41.3174.4-86-175.5-13.400112.2Q59 E60 S61 F66 T67Q59-Q63 WeakPolarHBondContact O-CB 3.26Å; Q59-Q63 PolarHBondContact O-N 3.5Å; E60-Q63 PolarHBondContact O-N 3.47Å; S61-Q63 VanDerWaalsContact C-N 3.33Å; S61-Q63 PolarHBondContact O-N 3.28Å; Q63-F66 PolarHBondContact O-N 2.96Å; Q63-T67 WeakPolarHBondContact O-CB 3.33Å; Q63-T67 WeakPolarHBondContact O-CG2 3.41Å; Q63-T67 PolarHBondContact O-N 2.71Å; Q63-T67 PolarHBondContact O-OG1 3.24Å
64K93.7Very high93.8Very high125 Ų12599.6 Ų99.654%0.54351%0.513SS..Hα-helixtrans-63.1-45.3176.4-73.4170.5-175.1166.70111.8E60 S61 T67 Q68E60-K64 WeakPolarHBondContact O-CG 3.5Å; E60-K64 PolarHBondContact O-N 3.05Å; S61-K64 PolarHBondContact O-N 3.24Å; K64-T67 WeakPolarHBondContact CA-OG1 3.28Å; K64-T67 PolarHBondContact O-N 3.37Å; K64-T67 PolarHBondContact O-OG1 3.35Å; K64-Q68 WeakPolarHBondContact O-CB 3.23Å; K64-Q68 VanDerWaalsContact O-CG 3.31Å; K64-Q68 WeakPolarHBondContact O-CG 3.17Å; K64-Q68 PolarHBondContact O-N 2.99Å
65E94.4Very high93.8Very high111 Ų111100.8 Ų100.852%0.51951%0.512SS..Hα-helixtrans-62.6-47.6175.8-72.2174.6-176.100111.5S61 T67 Q68 D69S61-E65 PolarHBondContact O-N 3.47Å; E65-T67 VanDerWaalsContact C-N 3.34Å; E65-T67 PolarHBondContact O-N 3.07Å; E65-Q68 PolarHBondContact O-N 2.9Å; E65-D69 PolarHBondContact O-N 3.45Å
66F93.7Very high94Very high140 Ų140100.1 Ų100.161%0.61451%0.509SS*.Hα-helixtrans-59.7-43.5178.8-178.7-98.8000112.3C62 Q63 D69 L70C62-F66 VanDerWaalsContact O-CB 3.26Å; C62-F66 WeakPolarHBondContact O-CB 3.44Å; C62-F66 PolarHBondContact O-N 2.92Å; Q63-F66 PolarHBondContact O-N 2.96Å; F66-D69 PolarHBondContact O-N 3.08Å; F66-L70 HydrophobicContact CE1-CD1 3.81Å; F66-L70 HydrophobicContact CZ-CD1 4.03Å; F66-L70 VanDerWaalsContact O-CB 3.27Å; F66-L70 WeakPolarHBondContact O-CB 3.17Å; F66-L70 PolarHBondContact O-N 3.17Å
67T93.7Very high94.2Very high82 Ų82103.1 Ų103.150%0.50352%0.518SS..Hα-helixtrans-65.6-41177.943.80000112.3Q63 K64 E65 L70 E71Q63-T67 WeakPolarHBondContact O-CB 3.33Å; Q63-T67 WeakPolarHBondContact O-CG2 3.41Å; Q63-T67 PolarHBondContact O-N 2.71Å; Q63-T67 PolarHBondContact O-OG1 3.24Å; K64-T67 WeakPolarHBondContact CA-OG1 3.28Å; K64-T67 PolarHBondContact O-N 3.37Å; K64-T67 PolarHBondContact O-OG1 3.35Å; E65-T67 VanDerWaalsContact C-N 3.34Å; E65-T67 PolarHBondContact O-N 3.07Å; T67-L70 PolarHBondContact O-N 3.07Å; T67-E71 PolarHBondContact O-N 3.33Å
68Q95.5Very high94.3Very high112 Ų112105.8 Ų105.852%0.52352%0.52SS..Hα-helixtrans-62.4-44.7174.8-76.1178.910.400112.2K64 E65 E71 K72K64-Q68 WeakPolarHBondContact O-CB 3.23Å; K64-Q68 VanDerWaalsContact O-CG 3.31Å; K64-Q68 WeakPolarHBondContact O-CG 3.17Å; K64-Q68 PolarHBondContact O-N 2.99Å; E65-Q68 PolarHBondContact O-N 2.9Å; Q68-E71 PolarHBondContact O-N 3.37Å; Q68-K72 WeakPolarHBondContact O-CG 3.29Å; Q68-K72 PolarHBondContact O-N 2.91Å
69D94.4Very high94.4Very high84 Ų84105.5 Ų105.545%0.44952%0.519SS..Hα-helixtrans-68.8-36.6-179.8-73.5-16.5000111.9E65 F66 E71 K72 V73E65-D69 PolarHBondContact O-N 3.45Å; F66-D69 PolarHBondContact O-N 3.08Å; D69-E71 VanDerWaalsContact C-N 3.3Å; D69-E71 PolarHBondContact O-N 2.77Å; D69-K72 PolarHBondContact O-N 2.99Å; D69-K72 IonicContact OD1-NZ 2.99Å; D69-K72 PolarHBondContact OD1-NZ 3.26Å; D69-V73 WeakPolarHBondContact O-CG2 3.27Å; D69-V73 PolarHBondContact O-N 3.29Å
70L95Very high94.5Very high98 Ų98105.3 Ų105.351%0.51352%0.521SS..Hα-helixtrans-62.3-38.8173.3-167.5145.4000111.7F66 T67 K74F66-L70 HydrophobicContact CE1-CD1 3.81Å; F66-L70 HydrophobicContact CZ-CD1 4.03Å; F66-L70 VanDerWaalsContact O-CB 3.27Å; F66-L70 WeakPolarHBondContact O-CB 3.17Å; F66-L70 PolarHBondContact O-N 3.17Å; T67-L70 PolarHBondContact O-N 3.07Å; L70-K74 VanDerWaalsContact O-CB 3.31Å; L70-K74 WeakPolarHBondContact O-CB 3.38Å; L70-K74 PolarHBondContact O-N 2.86Å
71E95Very high94.6Very high127 Ų127103.7 Ų103.759%0.59352%0.522SS*.Hα-helixtrans-68.4-42.5176.2-165.4157.2-141.800112T67 Q68 D69 V73 K74 D75T67-E71 PolarHBondContact O-N 3.33Å; Q68-E71 PolarHBondContact O-N 3.37Å; D69-E71 VanDerWaalsContact C-N 3.3Å; D69-E71 PolarHBondContact O-N 2.77Å; E71-V73 PolarHBondContact O-N 2.9Å; E71-K74 WeakPolarHBondContact O-CB 3.46Å; E71-K74 PolarHBondContact O-N 3.28Å; E71-D75 PolarHBondContact O-N 3.49Å
72K96.2Very high94.9Very high111 Ų111108.1 Ų108.148%0.48353%0.534SS..Hα-helixtrans-57.9-48.2173-69.2172.2-162155.80112Q68 D69 K74 D75 E76Q68-K72 WeakPolarHBondContact O-CG 3.29Å; Q68-K72 PolarHBondContact O-N 2.91Å; D69-K72 PolarHBondContact O-N 2.99Å; D69-K72 IonicContact OD1-NZ 2.99Å; D69-K72 PolarHBondContact OD1-NZ 3.26Å; K72-K74 VanDerWaalsContact C-N 3.31Å; K72-K74 PolarHBondContact O-N 2.86Å; K72-D75 PolarHBondContact O-N 3.4Å; K72-E76 WeakPolarHBondContact O-CG 3.28Å; K72-E76 PolarHBondContact O-N 2.96Å
73V95.3Very high95.1Very high79 Ų79109.6 Ų109.648%0.47953%0.533SS..Hα-helixtrans-63-40.2178.8171.40000110.7D69 E71 D75 E76 I77D69-V73 WeakPolarHBondContact O-CG2 3.27Å; D69-V73 PolarHBondContact O-N 3.29Å; E71-V73 PolarHBondContact O-N 2.9Å; V73-D75 VanDerWaalsContact C-N 3.35Å; V73-D75 PolarHBondContact O-N 2.97Å; V73-E76 PolarHBondContact O-N 2.86Å; V73-I77 HydrophobicContact CG1-CD1 3.87Å; V73-I77 HydrophobicContact CG1-CG1 4.43Å; V73-I77 VanDerWaalsContact O-CG1 3.28Å; V73-I77 WeakPolarHBondContact O-CG1 3.32Å; V73-I77 PolarHBondContact O-N 2.9Å
74K95.8Very high95.2Very high123 Ų123111 Ų11154%0.53554%0.537SS..Hα-helixtrans-62.3-42.2176.4-171.2179.8179.3-175.50111.8L70 E71 K72 I77 Q78L70-K74 VanDerWaalsContact O-CB 3.31Å; L70-K74 WeakPolarHBondContact O-CB 3.38Å; L70-K74 PolarHBondContact O-N 2.86Å; E71-K74 WeakPolarHBondContact O-CB 3.46Å; E71-K74 PolarHBondContact O-N 3.28Å; K72-K74 VanDerWaalsContact C-N 3.31Å; K72-K74 PolarHBondContact O-N 2.86Å; K74-I77 PolarHBondContact O-N 3.3Å; K74-Q78 WeakPolarHBondContact O-CG 3.47Å; K74-Q78 PolarHBondContact O-N 2.96Å
75D95.8Very high95.4Very high78 Ų78111.7 Ų111.742%0.41754%0.54SS..Hα-helixtrans-64.8-41.4175.8-81.9-6.1000112.4E71 K72 V73 Q78 K79E71-D75 PolarHBondContact O-N 3.49Å; K72-D75 PolarHBondContact O-N 3.4Å; V73-D75 VanDerWaalsContact C-N 3.35Å; V73-D75 PolarHBondContact O-N 2.97Å; D75-Q78 PolarHBondContact O-N 3.34Å; D75-K79 WeakPolarHBondContact O-CB 3.46Å; D75-K79 VanDerWaalsContact O-CG 3.3Å; D75-K79 WeakPolarHBondContact O-CG 3.47Å; D75-K79 PolarHBondContact O-N 3.18Å
76E96.1Very high95.5Very high118 Ų118109.2 Ų109.255%0.55153%0.53SS*.Hα-helixtrans-62.6-44.9174.8-75-179.1-178.100112K72 V73 Q78 K79 L80K72-E76 WeakPolarHBondContact O-CG 3.28Å; K72-E76 PolarHBondContact O-N 2.96Å; V73-E76 PolarHBondContact O-N 2.86Å; E76-Q78 VanDerWaalsContact C-N 3.29Å; E76-Q78 PolarHBondContact O-N 3.43Å; E76-K79 PolarHBondContact O-N 3.13Å; E76-L80 WeakPolarHBondContact O-CB 3.31Å; E76-L80 WeakPolarHBondContact O-CG 3.27Å; E76-L80 PolarHBondContact O-N 2.97Å
77I95.7Very high95.6Very high106 Ų106106.4 Ų106.454%0.54452%0.521SS..Hα-helixtrans-58.9-42.9175.2-70.6167.9000110.5V73 K74 S81V73-I77 HydrophobicContact CG1-CD1 3.87Å; V73-I77 HydrophobicContact CG1-CG1 4.43Å; V73-I77 VanDerWaalsContact O-CG1 3.28Å; V73-I77 WeakPolarHBondContact O-CG1 3.32Å; V73-I77 PolarHBondContact O-N 2.9Å; K74-I77 PolarHBondContact O-N 3.3Å; I77-S81 VanDerWaalsContact O-CB 3.22Å; I77-S81 WeakPolarHBondContact O-CB 3.41Å; I77-S81 PolarHBondContact O-N 3.45Å
78Q95.6Very high95.7Very high96 Ų96106.2 Ų106.245%0.44952%0.516SS..Hα-helixtrans-65.4-42.8176.9-74.2-172.710.700112.5K74 D75 E76 S81 K82K74-Q78 WeakPolarHBondContact O-CG 3.47Å; K74-Q78 PolarHBondContact O-N 2.96Å; D75-Q78 PolarHBondContact O-N 3.34Å; E76-Q78 VanDerWaalsContact C-N 3.29Å; E76-Q78 PolarHBondContact O-N 3.43Å; Q78-S81 PolarHBondContact O-N 2.93Å; Q78-K82 WeakPolarHBondContact O-CG 3.39Å; Q78-K82 PolarHBondContact O-N 3.44Å
79K96Very high95.8Very high143 Ų143103.3 Ų103.362%0.62250%0.504SS*.Hα-helixtrans-61.2-47.7176-74169.8-175.5169.90111.1D75 E76 S81 K82 H83D75-K79 WeakPolarHBondContact O-CB 3.46Å; D75-K79 VanDerWaalsContact O-CG 3.3Å; D75-K79 WeakPolarHBondContact O-CG 3.47Å; D75-K79 PolarHBondContact O-N 3.18Å; E76-K79 PolarHBondContact O-N 3.13Å; K79-S81 PolarHBondContact O-N 2.81Å; K79-K82 PolarHBondContact O-N 3.23Å; K79-H83 WeakPolarHBondContact O-CB 3.45Å; K79-H83 PolarHBondContact O-N 2.93Å
80L95.7Very high95.8Very high117 Ų117104.3 Ų104.361%0.61351%0.505SS*.Hα-helixtrans-63.2-40.8177.4-73.2172.8000112E76 H83 K84E76-L80 WeakPolarHBondContact O-CB 3.31Å; E76-L80 WeakPolarHBondContact O-CG 3.27Å; E76-L80 PolarHBondContact O-N 2.97Å; L80-H83 PolarHBondContact O-N 3.03Å; L80-K84 VanDerWaalsContact O-CB 3.31Å; L80-K84 WeakPolarHBondContact O-CB 3.33Å; L80-K84 PolarHBondContact O-N 3.28Å
81S94.9Very high95.9Very high77 Ų77103.6 Ų103.654%0.53850%0.501SS..Hα-helixtrans-62.6-45176.2-178.40000112.1I77 Q78 K79 K84 K85I77-S81 VanDerWaalsContact O-CB 3.22Å; I77-S81 WeakPolarHBondContact O-CB 3.41Å; I77-S81 PolarHBondContact O-N 3.45Å; Q78-S81 PolarHBondContact O-N 2.93Å; K79-S81 PolarHBondContact O-N 2.81Å; S81-K84 PolarHBondContact O-N 3.23Å; S81-K85 PolarHBondContact O-N 3.04Å
82K96.1Very high95.9Very high152 Ų152105.4 Ų105.466%0.66150%0.502SS*.Hα-helixtrans-60.7-45.8173.9-75.4176.3-179.3174.70111.5Q78 K79 K85 D86Q78-K82 WeakPolarHBondContact O-CG 3.39Å; Q78-K82 PolarHBondContact O-N 3.44Å; K79-K82 PolarHBondContact O-N 3.23Å; K82-K85 PolarHBondContact O-N 3.48Å; K82-D86 PolarHBondContact O-N 2.99Å
83H95.8Very high95.9Very high108 Ų108106.8 Ų106.850%0.551%0.505SS..Hα-helixtrans-64.4-43.1179.4-168.457.7000112.3K79 L80 K85 D86 I87K79-H83 WeakPolarHBondContact O-CB 3.45Å; K79-H83 PolarHBondContact O-N 2.93Å; L80-H83 PolarHBondContact O-N 3.03Å; H83-K85 VanDerWaalsContact C-N 3.3Å; H83-K85 PolarHBondContact O-N 3.37Å; H83-D86 PolarHBondContact O-N 2.93Å; H83-I87 WeakPolarHBondContact NE2-CD1 3.36Å; H83-I87 WeakPolarHBondContact O-CG1 3.4Å; H83-I87 PolarHBondContact O-N 2.77Å
84K95.6Very high95.9Very high144 Ų144106.7 Ų106.763%0.62651%0.507SS*.Hα-helixtrans-57.1-43.4173.8-179.8179.2178.1177.20111.5L80 S81 L88L80-K84 VanDerWaalsContact O-CB 3.31Å; L80-K84 WeakPolarHBondContact O-CB 3.33Å; L80-K84 PolarHBondContact O-N 3.28Å; S81-K84 PolarHBondContact O-N 3.23Å; K84-L88 HydrophobicContact CG-CD1 4.22Å; K84-L88 WeakPolarHBondContact O-CB 3.2Å; K84-L88 VanDerWaalsContact O-CG 3.3Å; K84-L88 WeakPolarHBondContact O-CG 3.45Å; K84-L88 PolarHBondContact O-N 2.98Å
85K96.6Very high95.8Very high140 Ų140107.1 Ų107.161%0.60951%0.508SS*.Hα-helixtrans-63.7-46.6177.3-171177.6178.3179.40111.8S81 K82 H83 I87 L88 D89S81-K85 PolarHBondContact O-N 3.04Å; K82-K85 PolarHBondContact O-N 3.48Å; H83-K85 VanDerWaalsContact C-N 3.3Å; H83-K85 PolarHBondContact O-N 3.37Å; K85-I87 PolarHBondContact O-N 3.49Å; K85-L88 PolarHBondContact O-N 2.82Å; K85-D89 PolarHBondContact O-N 2.77Å
86D96.6Very high95.8Very high58 Ų58106.5 Ų106.531%0.3151%0.514SS..Hα-helixtrans-61-43.1177.518054.9000112.3K82 H83 L88 D89 K90K82-D86 PolarHBondContact O-N 2.99Å; H83-D86 PolarHBondContact O-N 2.93Å; D86-L88 PolarHBondContact O-N 3.05Å; D86-D89 PolarHBondContact O-N 3.23Å; D86-K90 WeakPolarHBondContact O-CB 3.27Å; D86-K90 WeakPolarHBondContact O-CG 3.49Å; D86-K90 PolarHBondContact O-N 2.87Å; D86-K90 IonicContact OD1-NZ 2.89Å; D86-K90 WeakPolarHBondContact OD2-CE 3.26Å; D86-K90 IonicContact OD2-NZ 2.93Å; D86-K90 PolarHBondContact OD2-NZ 3.34Å
87I96.7Very high95.8Very high81 Ų81107.1 Ų107.142%0.41552%0.517SS..Hα-helixtrans-60.8-45174.5-69.8171.8000110.9H83 K85 D89 K90 L91H83-I87 WeakPolarHBondContact NE2-CD1 3.36Å; H83-I87 WeakPolarHBondContact O-CG1 3.4Å; H83-I87 PolarHBondContact O-N 2.77Å; K85-I87 PolarHBondContact O-N 3.49Å; I87-D89 VanDerWaalsContact C-N 3.32Å; I87-D89 PolarHBondContact O-N 2.92Å; I87-K90 PolarHBondContact O-N 3.2Å; I87-L91 WeakPolarHBondContact O-CB 3.48Å; I87-L91 PolarHBondContact O-N 3Å
88L96.2Very high95.7Very high79 Ų79106.5 Ų106.541%0.41451%0.514SS..Hα-helixtrans-62-40.3178.3-75.6170.7000112K84 K85 D86 L91 R92K84-L88 HydrophobicContact CG-CD1 4.22Å; K84-L88 WeakPolarHBondContact O-CB 3.2Å; K84-L88 VanDerWaalsContact O-CG 3.3Å; K84-L88 WeakPolarHBondContact O-CG 3.45Å; K84-L88 PolarHBondContact O-N 2.98Å; K85-L88 PolarHBondContact O-N 2.82Å; D86-L88 PolarHBondContact O-N 3.05Å; L88-L91 PolarHBondContact O-N 3.32Å; L88-R92 WeakPolarHBondContact O-CG 3.37Å; L88-R92 PolarHBondContact O-N 2.99Å
89D96.1Very high95.6Very high51 Ų51106.5 Ų106.527%0.27351%0.514SS..Hα-helixtrans-71.6-35.7178-70.6-24.6000112.1K85 D86 I87 R92 R93K85-D89 PolarHBondContact O-N 2.77Å; D86-D89 PolarHBondContact O-N 3.23Å; I87-D89 VanDerWaalsContact C-N 3.32Å; I87-D89 PolarHBondContact O-N 2.92Å; D89-R92 IonicContact OD1-NH1 2.94Å; D89-R92 PolarHBondContact OD1-NH1 3.47Å; D89-R93 WeakPolarHBondContact O-CG 3.41Å; D89-R93 PolarHBondContact O-N 2.87Å; D89-R93 PolarHBondContact O-NE 3.41Å
90K96Very high95.5Very high104 Ų104102.3 Ų102.345%0.45251%0.506SS..Hα-helixtrans-61-46.2168.2-75.9170.3175.4164.70111.3D86 I87 R92 R93 C94D86-K90 WeakPolarHBondContact O-CB 3.27Å; D86-K90 WeakPolarHBondContact O-CG 3.49Å; D86-K90 PolarHBondContact O-N 2.87Å; D86-K90 IonicContact OD1-NZ 2.89Å; D86-K90 WeakPolarHBondContact OD2-CE 3.26Å; D86-K90 IonicContact OD2-NZ 2.93Å; D86-K90 PolarHBondContact OD2-NZ 3.34Å; I87-K90 PolarHBondContact O-N 3.2Å; K90-R92 PolarHBondContact O-N 2.9Å; K90-R93 PolarHBondContact O-N 3.13Å; K90-C94 PolarHBondContact O-N 2.95Å; K90-C94 PolarHBondContact O-SG 3.43Å; K90-C94 VanDerWaalsContact O-SG 3.35Å
91L95.8Very high95.3Very high83 Ų83102.9 Ų102.944%0.43550%0.504SS..Hα-helixtrans-63.3-39.9179.5-173.4141.4000112.1I87 L88 K95I87-L91 WeakPolarHBondContact O-CB 3.48Å; I87-L91 PolarHBondContact O-N 3Å; L88-L91 PolarHBondContact O-N 3.32Å; L91-K95 HydrophobicContact CD2-CD 3.87Å; L91-K95 HydrophobicContact CD2-CG 4.45Å; L91-K95 WeakPolarHBondContact O-CB 3.44Å; L91-K95 WeakPolarHBondContact O-CG 3.33Å; L91-K95 PolarHBondContact O-N 2.91Å
92R96.5Very high95Very high165 Ų165104.3 Ų104.362%0.62350%0.5SS*.Hα-helixtrans-61-46.9172.3-75.9174.5-178.3153.8-6.8112L88 D89 K90 K95 A96L88-R92 WeakPolarHBondContact O-CG 3.37Å; L88-R92 PolarHBondContact O-N 2.99Å; D89-R92 IonicContact OD1-NH1 2.94Å; D89-R92 PolarHBondContact OD1-NH1 3.47Å; K90-R92 PolarHBondContact O-N 2.9Å; R92-K95 PolarHBondContact O-N 2.9Å; R92-A96 PolarHBondContact O-N 3.07Å
93R96.2Very high94.6Very high141 Ų141100.6 Ų100.653%0.53249%0.49SS..Hα-helixtrans-60.7-47.5177.4-77.2179.7-78-148.71.1111.8D89 K90 K95 A96 Q97D89-R93 WeakPolarHBondContact O-CG 3.41Å; D89-R93 PolarHBondContact O-N 2.87Å; D89-R93 PolarHBondContact O-NE 3.41Å; K90-R93 PolarHBondContact O-N 3.13Å; R93-K95 PolarHBondContact O-N 2.84Å; R93-A96 PolarHBondContact O-N 2.99Å; R93-Q97 WeakPolarHBondContact O-CG 3.25Å; R93-Q97 PolarHBondContact O-N 3.31Å
94C93.8Very high94.1Very high77 Ų77100 Ų10052%0.5249%0.488SS..Hα-helixtrans-61.7-41.7177-68.30000112K90 Q97 L98K90-C94 PolarHBondContact O-N 2.95Å; K90-C94 PolarHBondContact O-SG 3.43Å; K90-C94 VanDerWaalsContact O-SG 3.35Å; C94-Q97 PolarHBondContact O-N 3.39Å; C94-L98 WeakPolarHBondContact O-CB 3.4Å; C94-L98 PolarHBondContact O-N 2.9Å
95K95.2Very high93.4Very high132 Ų13295.9 Ų95.957%0.57448%0.48SS*.Hα-helixtrans-61.9-44.6174.7-80.1-176.2176.1-179.80112.2L91 R92 R93 L98 E99L91-K95 HydrophobicContact CD2-CD 3.87Å; L91-K95 HydrophobicContact CD2-CG 4.45Å; L91-K95 WeakPolarHBondContact O-CB 3.44Å; L91-K95 WeakPolarHBondContact O-CG 3.33Å; L91-K95 PolarHBondContact O-N 2.91Å; R92-K95 PolarHBondContact O-N 2.9Å; R93-K95 PolarHBondContact O-N 2.84Å; K95-L98 PolarHBondContact O-N 2.83Å; K95-E99 PolarHBondContact O-N 2.85Å
96A95.3Very high92.4Very high64 Ų6493 Ų9353%0.52948%0.478SS..Hα-helixtrans-63-42.8177.800000112R92 R93 E99 A100R92-A96 PolarHBondContact O-N 3.07Å; R93-A96 PolarHBondContact O-N 2.99Å; A96-E99 PolarHBondContact O-N 2.71Å; A96-A100 WeakPolarHBondContact O-CB 3.46Å; A96-A100 PolarHBondContact O-N 2.83Å
97Q94.9Very high91.4Very high131 Ų13197.5 Ų97.561%0.61250%0.495SS*.Hα-helixtrans-63.5-41174.9-73.6177-15.100112.1R93 C94 A100 K101R93-Q97 WeakPolarHBondContact O-CG 3.25Å; R93-Q97 PolarHBondContact O-N 3.31Å; C94-Q97 PolarHBondContact O-N 3.39Å; Q97-A100 PolarHBondContact O-N 3.33Å; Q97-K101 WeakPolarHBondContact O-CB 3.27Å; Q97-K101 WeakPolarHBondContact O-CG 3.44Å; Q97-K101 PolarHBondContact O-N 3.46Å
98L93.8Very high90.3Very high93 Ų9398.1 Ų98.149%0.48750%0.498SS..Hα-helixtrans-62.9-46.4177-179.564.4000111.4C94 K95 K101 K102C94-L98 WeakPolarHBondContact O-CB 3.4Å; C94-L98 PolarHBondContact O-N 2.9Å; K95-L98 PolarHBondContact O-N 2.83Å; L98-K101 PolarHBondContact O-N 2.79Å; L98-K102 HydrophobicContact CG-CD 4.45Å; L98-K102 WeakPolarHBondContact O-CB 3.15Å; L98-K102 WeakPolarHBondContact O-CG 3.42Å; L98-K102 PolarHBondContact O-N 2.84Å
99E93.8Very high89.2Confident96 Ų96101.3 Ų101.345%0.44951%0.509SS..Hα-helixtrans-65.9-39.8177.3-69.8-53.9134.300112K95 A96 K101 K102 T103K95-E99 PolarHBondContact O-N 2.85Å; A96-E99 PolarHBondContact O-N 2.71Å; E99-K101 VanDerWaalsContact C-N 3.33Å; E99-K101 PolarHBondContact O-N 3.45Å; E99-K102 PolarHBondContact O-N 3.4Å; E99-K102 IonicContact OE1-NZ 3.96Å; E99-K102 PolarHBondContact OE1-NZ 3.38Å; E99-T103 VanDerWaalsContact O-CG2 3.31Å; E99-T103 WeakPolarHBondContact O-CG2 3.49Å; E99-T103 PolarHBondContact O-N 3.02Å; E99-T103 PolarHBondContact O-OG1 2.93Å
100A93.7Very high87.7Confident55 Ų55106.6 Ų106.646%0.45553%0.532SS..Hα-helixtrans-58.4-45.4171.900000111.5A96 Q97 T103 E104A96-A100 WeakPolarHBondContact O-CB 3.46Å; A96-A100 PolarHBondContact O-N 2.83Å; Q97-A100 PolarHBondContact O-N 3.33Å; A100-T103 PolarHBondContact O-N 3.31Å; A100-T103 PolarHBondContact O-OG1 3.43Å; A100-E104 WeakPolarHBondContact O-CB 3.31Å; A100-E104 PolarHBondContact O-N 3.33Å
101K91.4Very high86.3Confident130 Ų130107.1 Ų107.157%0.56553%0.534SS*.Hα-helixtrans-67.1-37.5177.2-73.6-74.1164.6-158.40113Q97 L98 E99 E104 A105Q97-K101 WeakPolarHBondContact O-CB 3.27Å; Q97-K101 WeakPolarHBondContact O-CG 3.44Å; Q97-K101 PolarHBondContact O-N 3.46Å; L98-K101 PolarHBondContact O-N 2.79Å; E99-K101 VanDerWaalsContact C-N 3.33Å; E99-K101 PolarHBondContact O-N 3.45Å; K101-E104 IonicContact NZ-OE2 3.88Å; K101-E104 PolarHBondContact NZ-OE2 2.9Å; K101-E104 PolarHBondContact O-N 2.95Å; K101-A105 VanDerWaalsContact O-CB 3.29Å; K101-A105 WeakPolarHBondContact O-CB 3.37Å; K101-A105 PolarHBondContact O-N 3.48Å
102K89.3Confident84.8Confident107 Ų107106.5 Ų106.547%0.46553%0.528SS..Hα-helixtrans-64.4-43.9173.9-77.1178.1-176170.40112L98 E99 A105 S106L98-K102 HydrophobicContact CG-CD 4.45Å; L98-K102 WeakPolarHBondContact O-CB 3.15Å; L98-K102 WeakPolarHBondContact O-CG 3.42Å; L98-K102 PolarHBondContact O-N 2.84Å; E99-K102 PolarHBondContact O-N 3.4Å; E99-K102 IonicContact OE1-NZ 3.96Å; E99-K102 PolarHBondContact OE1-NZ 3.38Å; K102-A105 PolarHBondContact O-N 2.87Å; K102-S106 WeakPolarHBondContact O-CB 3.4Å; K102-S106 PolarHBondContact O-N 3.25Å
103T87.3Confident83.4Confident73 Ų73103.7 Ų103.745%0.44852%0.52SS..Hα-helixtrans-66-40.8177.757.80000111.4E99 A100 S106 K107E99-T103 VanDerWaalsContact O-CG2 3.31Å; E99-T103 WeakPolarHBondContact O-CG2 3.49Å; E99-T103 PolarHBondContact O-N 3.02Å; E99-T103 PolarHBondContact O-OG1 2.93Å; A100-T103 PolarHBondContact O-N 3.31Å; A100-T103 PolarHBondContact O-OG1 3.43Å; T103-S106 PolarHBondContact O-N 3.43Å; T103-K107 WeakPolarHBondContact O-CB 3.39Å; T103-K107 VanDerWaalsContact O-CG 3.29Å; T103-K107 WeakPolarHBondContact O-CG 3.3Å; T103-K107 PolarHBondContact O-N 3.21Å
104E86.2Confident81.8Confident97 Ų9799.2 Ų99.245%0.45351%0.506SS..Hα-helixtrans-59.4-49.9172.1-170.9-178-172.800111.3A100 K101 S106 K107 L108A100-E104 WeakPolarHBondContact O-CB 3.31Å; A100-E104 PolarHBondContact O-N 3.33Å; K101-E104 IonicContact NZ-OE2 3.88Å; K101-E104 PolarHBondContact NZ-OE2 2.9Å; K101-E104 PolarHBondContact O-N 2.95Å; E104-S106 VanDerWaalsContact C-N 3.32Å; E104-S106 PolarHBondContact O-N 3.46Å; E104-K107 WeakPolarHBondContact O-CB 3.22Å; E104-K107 PolarHBondContact O-N 2.92Å; E104-L108 WeakPolarHBondContact O-CB 3.46Å; E104-L108 PolarHBondContact O-N 3.15Å
105A80.1Confident80.4Confident57 Ų57104.3 Ų104.347%0.47152%0.516SS..Hα-helixtrans-62-37.4177.300000112.7K101 K102 L108 K109K101-A105 VanDerWaalsContact O-CB 3.29Å; K101-A105 WeakPolarHBondContact O-CB 3.37Å; K101-A105 PolarHBondContact O-N 3.48Å; K102-A105 PolarHBondContact O-N 2.87Å; A105-L108 PolarHBondContact O-N 3.46Å; A105-K109 VanDerWaalsContact O-CB 3.22Å; A105-K109 WeakPolarHBondContact O-CB 3.5Å; A105-K109 PolarHBondContact O-N 3.01Å
106S75.7Confident78.9Confident79 Ų79100.3 Ų100.355%0.55251%0.507SS*.Hα-helixtrans-67.5-43.4176-169.80000111.7K102 T103 E104 L108 K109 H110K102-S106 WeakPolarHBondContact O-CB 3.4Å; K102-S106 PolarHBondContact O-N 3.25Å; T103-S106 PolarHBondContact O-N 3.43Å; E104-S106 VanDerWaalsContact C-N 3.32Å; E104-S106 PolarHBondContact O-N 3.46Å; S106-L108 VanDerWaalsContact C-N 3.34Å; S106-L108 PolarHBondContact O-N 2.93Å; S106-K109 PolarHBondContact O-N 2.99Å; S106-H110 WeakPolarHBondContact O-CB 3.39Å; S106-H110 PolarHBondContact O-N 3.28Å
107K76.4Confident77.3Confident153 Ų153106.1 Ų106.167%0.66552%0.524SS*.Hα-helixtrans-59.7-45.6172.8-73.6173.7-178.8-178.20111.3T103 E104 H110 K111T103-K107 WeakPolarHBondContact O-CB 3.39Å; T103-K107 VanDerWaalsContact O-CG 3.29Å; T103-K107 WeakPolarHBondContact O-CG 3.3Å; T103-K107 PolarHBondContact O-N 3.21Å; E104-K107 WeakPolarHBondContact O-CB 3.22Å; E104-K107 PolarHBondContact O-N 2.92Å; K107-H110 PolarHBondContact O-N 3.16Å; K107-K111 WeakPolarHBondContact O-CB 3.41Å; K107-K111 PolarHBondContact O-N 2.87Å
108L71.9Confident76.1Confident94 Ų94105.2 Ų105.249%0.49252%0.522SS..Hα-helixtrans-61.2-49.1176.1-128.368.3000110.7E104 A105 S106 H110 K111 F112E104-L108 WeakPolarHBondContact O-CB 3.46Å; E104-L108 PolarHBondContact O-N 3.15Å; A105-L108 PolarHBondContact O-N 3.46Å; S106-L108 VanDerWaalsContact C-N 3.34Å; S106-L108 PolarHBondContact O-N 2.93Å; L108-H110 VanDerWaalsContact C-N 3.3Å; L108-H110 PolarHBondContact O-N 2.92Å; L108-K111 PolarHBondContact O-N 2.93Å; L108-K111 VanDerWaalsContact O-N 3.13Å; L108-F112 HydrophobicContact CB-CD2 4.46Å; L108-F112 HydrophobicContact CD1-CE2 4.04Å; L108-F112 HydrophobicContact CG-CD2 3.89Å; L108-F112 HydrophobicContact CG-CE2 3.73Å; L108-F112 WeakPolarHBondContact O-CD2 3.3Å; L108-F112 PolarHBondContact O-N 2.9Å
109K73.3Confident75.1Confident145 Ų145105.1 Ų105.163%0.6353%0.527SS*.Hα-helixtrans-58.6-41.7178-173.1176.7-177.5177.20111.5A105 S106 K113A105-K109 VanDerWaalsContact O-CB 3.22Å; A105-K109 WeakPolarHBondContact O-CB 3.5Å; A105-K109 PolarHBondContact O-N 3.01Å; S106-K109 PolarHBondContact O-N 2.99Å; K109-K113 WeakPolarHBondContact O-CB 3.31Å; K109-K113 PolarHBondContact O-N 3Å
110H66.3Low74.2Confident163 Ų163110.4 Ų110.476%0.75555%0.551SS**Hα-helixtrans-68.2-40.1176.8-168.947.2000112.1S106 K107 L108 F112S106-H110 WeakPolarHBondContact O-CB 3.39Å; S106-H110 PolarHBondContact O-N 3.28Å; K107-H110 PolarHBondContact O-N 3.16Å; L108-H110 VanDerWaalsContact C-N 3.3Å; L108-H110 PolarHBondContact O-N 2.92Å; H110-F112 VanDerWaalsContact C-N 3.35Å; H110-F112 PolarHBondContact O-N 3.21Å
111K66.5Low73.3Confident114 Ų114112.2 Ų112.250%0.49656%0.557SS.*Hα-helixtrans-64.4-35.4177.7-174.1175.2176.9-179.20113.3K107 L108 T201 C306K107-K111 WeakPolarHBondContact O-CB 3.41Å; K107-K111 PolarHBondContact O-N 2.87Å; L108-K111 PolarHBondContact O-N 2.93Å; L108-K111 VanDerWaalsContact O-N 3.13Å; K111-T201 WeakPolarHBondContact CE-OG1 3.24Å; K111-C306 PolarHBondContact NZ-SG 2.77Å
112F64Low72.8Confident70 Ų70115.5 Ų115.531%0.30758%0.575SS.*Hα-helixtrans-1071.1-174.4-64.9-73.2000114.2L108 H110 I114 T201 T304L108-F112 HydrophobicContact CB-CD2 4.46Å; L108-F112 HydrophobicContact CD1-CE2 4.04Å; L108-F112 HydrophobicContact CG-CD2 3.89Å; L108-F112 HydrophobicContact CG-CE2 3.73Å; L108-F112 WeakPolarHBondContact O-CD2 3.3Å; L108-F112 PolarHBondContact O-N 2.9Å; H110-F112 VanDerWaalsContact C-N 3.35Å; H110-F112 PolarHBondContact O-N 3.21Å; F112-I114 PolarHBondContact O-N 3.49Å; F112-I114 VanDerWaalsContact O-N 3.1Å; F112-T201 HydrophobicContact CD1-CG2 4.07Å; F112-T201 HydrophobicContact CE1-CG2 3.69Å; F112-T304 HydrophobicContact CD1-CG2 4.31Å; F112-T304 HydrophobicContact CE1-CG2 4.45Å
113K66Low72.3Confident107 Ų107114.6 Ų114.647%0.46558%0.578SS.*  trans-80.893.7174.4-168.9170.9-165.9-171.70109.5K109 Y115K109-K113 WeakPolarHBondContact O-CB 3.31Å; K109-K113 PolarHBondContact O-N 3Å; K113-Y115 HydrophobicContact CB-CE2 4.44Å; K113-Y115 HydrophobicContact CD-CD2 4.49Å; K113-Y115 HydrophobicContact CD-CE1 4.38Å; K113-Y115 HydrophobicContact CD-CE2 3.55Å; K113-Y115 WeakPolarHBondContact CD-OH 3.5Å; K113-Y115 WeakPolarHBondContact CE-OH 3.16Å; K113-Y115 HydrophobicContact CG-CD2 4.11Å; K113-Y115 HydrophobicContact CG-CE2 3.63Å; K113-Y115 PolarHBondContact NZ-OH 3.31Å; K113-Y115 PolarHBondContact O-N 2.99Å
114I63.7Low71.9Confident47 Ų47120.2 Ų120.224%0.24160%0.596CS.*  trans-80.1114177.6-55.8138.5000107.9F112 A116 V203 F302F112-I114 PolarHBondContact O-N 3.49Å; F112-I114 VanDerWaalsContact O-N 3.1Å; I114-A116 HydrophobicContact CG2-CB 4.02Å; I114-V203 HydrophobicContact CD1-CB 3.75Å; I114-V203 HydrophobicContact CD1-CG1 3.31Å; I114-V203 HydrophobicContact CD1-CG2 3.64Å; I114-V203 HydrophobicContact CG1-CB 4.29Å; I114-V203 HydrophobicContact CG1-CG1 4.35Å; I114-V203 HydrophobicContact CG1-CG2 3.93Å; I114-F302 HydrophobicContact CD1-CE2 3.63Å; I114-F302 HydrophobicContact CD1-CZ 3.86Å
115Y64.5Low71.6Confident183 Ų183123.9 Ų123.972%0.71861%0.611SS**  trans-100.188.3163.3-64.9-84.6000107.2K113K113-Y115 HydrophobicContact CB-CE2 4.44Å; K113-Y115 HydrophobicContact CD-CD2 4.49Å; K113-Y115 HydrophobicContact CD-CE1 4.38Å; K113-Y115 HydrophobicContact CD-CE2 3.55Å; K113-Y115 WeakPolarHBondContact CD-OH 3.5Å; K113-Y115 WeakPolarHBondContact CE-OH 3.16Å; K113-Y115 HydrophobicContact CG-CD2 4.11Å; K113-Y115 HydrophobicContact CG-CE2 3.63Å; K113-Y115 PolarHBondContact NZ-OH 3.31Å; K113-Y115 PolarHBondContact O-N 2.99Å
116A62.1Low71.5Confident48 Ų48129.2 Ų129.240%0.39763%0.63SS.*  trans-90.4113.8172.100000108.2I114 I118I114-A116 HydrophobicContact CG2-CB 4.02Å; A116-I118 PolarHBondContact O-N 2.89Å
117Q63.5Low71.2Confident187 Ų187129.7 Ų129.787%0.87463%0.634SS**  trans-76.6112.3164-171.6172.410.400107.1P119Q117-P119 WeakPolarHBondContact O-CD 3.3Å
118I69.4Low70.8Confident111 Ų111128.4 Ų128.457%0.56963%0.633SS**PPolyproline II helixtrans-76116.8177.8-55.8175000107.1A116 I149A116-I118 PolarHBondContact O-N 2.89Å; I118-I149 HydrophobicContact CD1-CD1 3.48Å; I118-I149 VanDerWaalsContact CD1-CD1 3.48Å; I118-I149 HydrophobicContact CG1-CD1 3.72Å
119P71.3Confident70.3Confident92 Ų92128.7 Ų128.760%0.59763%0.634SS**PPolyproline II helixtrans-69.4147.418028.7-33.5000110.6Q117 T121Q117-P119 WeakPolarHBondContact O-CD 3.3Å; P119-T121 PolarHBondContact O-N 2.76Å; P119-T121 VanDerWaalsContact O-N 3.13Å; P119-T121 PolarHBondContact O-OG1 2.92Å; P119-T121 VanDerWaalsContact O-OG1 3.04Å
120E75.4Confident69.6Low206 Ų206131.7 Ų131.796%0.96364%0.642SS**PPolyproline II helixtrans-62.9116.1168-170.5170.5-173.100108.3
121T76.1Confident69Low94 Ų94128.4 Ų128.458%0.57763%0.627SS**  trans-132.3134.6-172.8-53.10000109P119 V123P119-T121 PolarHBondContact O-N 2.76Å; P119-T121 VanDerWaalsContact O-N 3.13Å; P119-T121 PolarHBondContact O-OG1 2.92Å; P119-T121 VanDerWaalsContact O-OG1 3.04Å; T121-V123 PolarHBondContact O-N 2.8Å
122E79Confident68Low199 Ų199132.1 Ų132.193%0.9365%0.646SS**  trans-68.9126.9172.4-66.2-174.1173.900110
123V79.8Confident67Low88 Ų88133.4 Ų133.453%0.53366%0.656SS.*  trans-114.6146.5-178.2-62.40000110T121 F147T121-V123 PolarHBondContact O-N 2.8Å; V123-F147 HydrophobicContact CG1-CE1 3.94Å
124K78.8Confident66.1Low191 Ų191138 Ų13883%0.8368%0.679SS**  trans-103.8135.3175.7-64.9-179.9-177.7177.30109.1L126K124-L126 PolarHBondContact O-N 3.04Å
125F80.9Confident65.2Low174 Ų174144.4 Ų144.476%0.76371%0.708SS**  trans-70.6121.9171.5-67.7-76.9000109.3V143F125-V143 HydrophobicContact CE1-CG1 3.76Å
126L76.2Confident64.2Low168 Ų168138.7 Ų138.788%0.8871%0.705SS**  trans-82.8-41.6-174.6-63.8176.5000112.1K124K124-L126 PolarHBondContact O-N 3.04Å
127S69.8Low63.4Low89 Ų89145.7 Ų145.762%0.62273%0.729SS**  trans-161.3157.2-176.2550000111.9
128L67.8Low62.8Low126 Ų126142.1 Ų142.166%0.6672%0.716SS**  trans-86.5110.6163.6-175.876.4000107.4R130L128-R130 HydrophobicContact CD2-CG 4.1Å; L128-R130 HydrophobicContact CG-CG 4.41Å; L128-R130 PolarHBondContact O-N 2.81Å
129I63.2Low62.2Low100 Ų100141 Ų14151%0.51371%0.714SS.*  trans-81112169.9-56.5173.6000106.2
130R57.1Low61.9Low208 Ų208138.2 Ų138.279%0.78570%0.697SS**  trans-87.5116.9167.8-66-178.6179.4-178.1-1.9106.2L128 E132L128-R130 HydrophobicContact CD2-CG 4.1Å; L128-R130 HydrophobicContact CG-CG 4.41Å; L128-R130 PolarHBondContact O-N 2.81Å; R130-E132 PolarHBondContact O-N 3.29Å
131E53.7Low61.9Low94 Ų94130.9 Ų130.944%0.43966%0.664SS.*  trans-72.3117.4167-65.8-176.2167.900106.4N133E131-N133 PolarHBondContact O-N 2.96Å
132E45Very low62.3Low192 Ų192128 Ų12890%0.89765%0.648SS**  trans-70.877.1174.1-72.9179167.700108.7R130R130-E132 PolarHBondContact O-N 3.29Å
133N43.7Very low62.7Low98 Ų98121 Ų12152%0.52462%0.619SS.*  trans-93.4121.7164-66.8-25.8000107.2E131 E135E131-N133 PolarHBondContact O-N 2.96Å; N133-E135 PolarHBondContact O-N 2.92Å
134E46.4Very low63Low202 Ų202123.4 Ų123.494%0.94462%0.619SS**SBendtrans-67.44.3-170.6-72.9-173.9146.600115.3
135E44.7Very low63.4Low182 Ų182115 Ų11585%0.8559%0.586SS**SBendtrans-140.9102.7178.6-66.4-172.7171.300111.1N133N133-E135 PolarHBondContact O-N 2.92Å
136G44.8Very low63.7Low63 Ų63110.3 Ų110.365%0.64957%0.571SS**SBendtrans98.7146.1170.500000114.4D138G136-D138 PolarHBondContact O-N 3.43Å
137E45.4Very low64.2Low196 Ų196105.9 Ų105.992%0.91655%0.545SS*.  trans-72.863177.9-155.7172.8-142.200109.8V139E137-V139 PolarHBondContact O-N 3.34Å
138D49.6Very low65Low111 Ų111105.3 Ų105.359%0.59454%0.538SS*.  trans-86.496.6-172.8-133.1-3.2000109.9G136 S140G136-D138 PolarHBondContact O-N 3.43Å; D138-S140 PolarHBondContact O-N 2.83Å
139V57.6Low65.8Low88 Ų88100.8 Ų100.853%0.53351%0.514SS..  trans-72.283.2178.6177.80000108.5E137 D141 R213E137-V139 PolarHBondContact O-N 3.34Å; V139-D141 VanDerWaalsContact C-N 3.27Å; V139-D141 PolarHBondContact O-N 3Å; V139-R213 VanDerWaalsContact C-NH2 3.33Å; V139-R213 PolarHBondContact O-NH2 3.34Å
140S64.7Low66.7Low34 Ų3499.3 Ų99.324%0.23851%0.513CS..  trans6.112175.5115.90000123.8D138 S142 R213D138-S140 PolarHBondContact O-N 2.83Å; S140-S142 PolarHBondContact O-N 3.48Å; S140-S142 PolarHBondContact O-OG 3.2Å; S140-S142 PolarHBondContact OG-O 3.44Å; S140-R213 VanDerWaalsContact CA-NH2 3.28Å; S140-R213 PolarHBondContact OG-NH2 2.94Å
141D76.5Confident67.8Low51 Ų5193.9 Ų93.927%0.27350%0.496SS..SBendtrans47-20.1176.5-77.45.1000121.9V139 R213 K214V139-D141 VanDerWaalsContact C-N 3.27Å; V139-D141 PolarHBondContact O-N 3Å; D141-R213 VanDerWaalsContact N-NH2 3.13Å; D141-R213 VanDerWaalsContact O-CB 3.28Å; D141-R213 WeakPolarHBondContact O-CB 3.41Å; D141-R213 PolarHBondContact O-N 3.31Å; D141-K214 VanDerWaalsContact CG-NZ 3.3Å; D141-K214 WeakPolarHBondContact OD1-CE 3.16Å; D141-K214 IonicContact OD1-NZ 2.71Å; D141-K214 PolarHBondContact OD1-NZ 3.06Å; D141-K214 IonicContact OD2-NZ 3.46Å; D141-K214 PolarHBondContact OD2-NZ 2.87Å; D141-K214 VanDerWaalsContact OD2-NZ 3.14Å
142S84.3Confident69.1Low34 Ų3496.3 Ų96.324%0.23850%0.501CS..EExtended strand (participates in β ladder)trans-131.6168.5-178.967.10000110.8S140 V211 R213S140-S142 PolarHBondContact O-N 3.48Å; S140-S142 PolarHBondContact O-OG 3.2Å; S140-S142 PolarHBondContact OG-O 3.44Å; S142-V211 CarbonylContact C-O 3.44Å; S142-V211 WeakPolarHBondContact CA-O 3.31Å; S142-V211 WeakPolarHBondContact CB-O 3.39Å; S142-R213 PolarHBondContact O-NE 3.46Å; S142-R213 VanDerWaalsContact O-NE 3.13Å; S142-R213 PolarHBondContact O-NH2 3.35Å
143V86.3Confident70.9Confident53 Ų5387.3 Ų87.332%0.32146%0.46SS..EExtended strand (participates in β ladder)trans-120.8114.3174.1174.90000106.7F125 V211 R213F125-V143 HydrophobicContact CE1-CG1 3.76Å; V143-V211 PolarHBondContact N-O 3.26Å; V143-V211 PolarHBondContact O-N 2.94Å; V143-R213 HydrophobicContact CG2-CG 3.72Å
144R86.9Confident72.8Confident138 Ų13883.1 Ų83.152%0.52144%0.439SS..EExtended strand (participates in β ladder)trans-83.3130.8176.2-174.2167.7-69.7162.71.1111.1M209 D210R144-M209 CarbonylContact C-O 3.58Å; R144-M209 WeakPolarHBondContact CA-O 3.48Å; R144-D210 WeakPolarHBondContact CA-OD1 3.24Å; R144-D210 WeakPolarHBondContact CB-OD1 3.34Å; R144-D210 WeakPolarHBondContact CG-OD1 3.34Å; R144-D210 IonicContact CZ-OD1 2.64Å; R144-D210 IonicContact NE-OD1 2.75Å; R144-D210 PolarHBondContact NE-OD1 2.89Å; R144-D210 IonicContact NE-OD2 2.77Å; R144-D210 IonicContact NH2-OD1 3.35Å; R144-D210 IonicContact NH2-OD2 2.97Å; R144-D210 PolarHBondContact NH2-OD2 3.42Å
145G86.2Confident74.7Confident14 Ų1474.7 Ų74.714%0.14440%0.401CS..EExtended strand (participates in β ladder)trans-124.4131.317200000110.5M209G145-M209 PolarHBondContact N-O 3.44Å; G145-M209 PolarHBondContact O-N 3.42Å
146V88.1Confident76.9Confident75 Ų7570.9 Ų70.946%0.45539%0.386SS..EExtended strand (participates in β ladder)trans-117.4113.7174-177.30000108E206 V207V146-E206 HydrophobicContact CG1-CB 4.49Å; V146-V207 WeakPolarHBondContact CA-O 3.06Å
147F86.1Confident79Confident75 Ų7568 Ų6833%0.32936%0.356SS..EExtended strand (participates in β ladder)trans-115.6117-176.2-53.7-82.1000110.2V123 I149 E206 V207 M209V123-F147 HydrophobicContact CG1-CE1 3.94Å; F147-I149 PolarHBondContact O-N 2.95Å; F147-E206 CarbonylContact O-C 3.55Å; F147-E206 VanDerWaalsContact O-CA 3.3Å; F147-E206 WeakPolarHBondContact O-CA 3.49Å; F147-V207 HydrophobicContact CB-CB 4.33Å; F147-V207 PolarHBondContact N-O 3.15Å; F147-V207 PolarHBondContact O-N 2.82Å; F147-M209 HydrophobicContact CE2-CB 4.38Å; F147-M209 HydrophobicContact CE2-CE 3.61Å; F147-M209 HydrophobicContact CZ-CE 4.12Å
148T87.3Confident81.3Confident78 Ų7862.9 Ų62.948%0.47933%0.334SS..EExtended strand (participates in β ladder)trans-84113.3172-50.70000109.8K204 E206T148-K204 HydrophobicContact CG2-CG 4.11Å; T148-E206 HydrophobicContact CG2-CG 4.47Å
149I84.3Confident83.2Confident31 Ų3158.8 Ų58.816%0.15932%0.318CS..EExtended strand (participates in β ladder)trans-98.6125.9174-60.2179.7000107.9I118 F147 K204 F205 V207I118-I149 HydrophobicContact CD1-CD1 3.48Å; I118-I149 VanDerWaalsContact CD1-CD1 3.48Å; I118-I149 HydrophobicContact CG1-CD1 3.72Å; F147-I149 PolarHBondContact O-N 2.95Å; I149-K204 WeakPolarHBondContact O-CA 3.49Å; I149-F205 HydrophobicContact CB-CD1 4.32Å; I149-F205 HydrophobicContact CB-CD2 4.39Å; I149-F205 HydrophobicContact CB-CE1 3.87Å; I149-F205 HydrophobicContact CB-CE2 3.96Å; I149-F205 HydrophobicContact CB-CZ 3.68Å; I149-F205 HydrophobicContact CD1-CE2 3.72Å; I149-F205 HydrophobicContact CD1-CZ 3.75Å; I149-F205 HydrophobicContact CG1-CE2 4.26Å; I149-F205 HydrophobicContact CG1-CZ 4.26Å; I149-F205 HydrophobicContact CG2-CD1 4.49Å; I149-F205 HydrophobicContact CG2-CE1 3.68Å; I149-F205 HydrophobicContact CG2-CE2 4.43Å; I149-F205 HydrophobicContact CG2-CZ 3.65Å; I149-F205 PolarHBondContact N-O 3.3Å; I149-F205 PolarHBondContact O-N 2.96Å; I149-V207 HydrophobicContact CD1-CG2 3.53Å; I149-V207 HydrophobicContact CG1-CG2 4.21Å
150S82.6Confident84.8Confident68 Ų6854.9 Ų54.948%0.47630%0.296SS..EExtended strand (participates in β ladder)trans-129.612017760.20000111.1V203S150-V203 CarbonylContact C-O 3.58Å; S150-V203 WeakPolarHBondContact CA-O 3.07Å
151Q79.8Confident86.2Confident95 Ų9554.6 Ų54.644%0.44429%0.291SS..EExtended strand (participates in β ladder)trans-92.7106.9166.7-177.1176.8-400107.7S202 V203Q151-S202 VanDerWaalsContact O-CA 3.29Å; Q151-S202 WeakPolarHBondContact O-CA 3.4Å; Q151-S202 VanDerWaalsContact O-CB 3.31Å; Q151-S202 WeakPolarHBondContact O-CB 3.42Å; Q151-V203 PolarHBondContact N-O 2.87Å; Q151-V203 PolarHBondContact O-N 3.46Å
152R81.6Confident87Confident144 Ų14452.1 Ų52.154%0.54328%0.278SS..  trans-71.4143.3177.2-67.7-174.8-172.51790.7110.2A154 F360 F361R152-A154 PolarHBondContact O-N 2.92Å; R152-F360 HydrophobicContact CB-CD1 4.43Å; R152-F361 WeakPolarHBondContact CB-O 3.43Å
153A82.4Confident87.5Confident4 Ų451.2 Ų51.23%0.03327%0.27CS..EExtended strand (participates in β ladder)trans-65.7136.2172.100000108.5L199 E200 F361A153-L199 HydrophobicContact CB-CB 4.09Å; A153-E200 WeakPolarHBondContact CB-O 3.17Å; A153-F361 HydrophobicContact CB-CB 4.32Å; A153-F361 PolarHBondContact O-N 3.24Å
154A84.3Confident87.9Confident10 Ų1048.7 Ų48.78%0.08326%0.255CS..EExtended strand (participates in β ladder)trans-125.1147.9179.700000110.6R152 Q358 A359 F360R152-A154 PolarHBondContact O-N 2.92Å; A154-Q358 HydrophobicContact CB-CG 4.12Å; A154-A359 CarbonylContact C-O 3.37Å; A154-A359 WeakPolarHBondContact CA-O 3.29Å; A154-F360 HydrophobicContact CB-CD1 3.88Å; A154-F360 HydrophobicContact CB-CE1 3.94Å
155V86.3Confident88.1Confident24 Ų2443.2 Ų43.215%0.14524%0.236CC..EExtended strand (participates in β ladder)trans-130.2132.8171.8178.40000108.6L157 L197 L199 A359 F361V155-L157 PolarHBondContact O-N 3.01Å; V155-L197 HydrophobicContact CG1-CD1 4.04Å; V155-L197 HydrophobicContact CG2-CD1 4.04Å; V155-L197 HydrophobicContact CG2-CD2 4.41Å; V155-L197 HydrophobicContact CG2-CG 4.37Å; V155-L199 HydrophobicContact CG2-CD2 3.65Å; V155-A359 PolarHBondContact N-O 2.81Å; V155-A359 PolarHBondContact O-N 3.27Å; V155-F361 HydrophobicContact CB-CE2 4.11Å; V155-F361 HydrophobicContact CG2-CD2 4.43Å; V155-F361 HydrophobicContact CG2-CE2 3.83Å
156L89.5Confident88.5Confident103 Ų10342.5 Ų42.554%0.53923%0.23SC..EExtended strand (participates in β ladder)trans-81.5110.1170.8-175.366.7000109L158L156-L158 HydrophobicContact CD2-CD2 3.95Å; L156-L158 HydrophobicContact CG-CD2 4.07Å
157L90.5Very high88.6Confident2 Ų243.8 Ų43.81%0.0123%0.23CC..EExtended strand (participates in β ladder)trans-84.5123.3172.8-168.264.6000108.9V155 Q161 L163 L314 I351 S356 L357V155-L157 PolarHBondContact O-N 3.01Å; L157-Q161 HydrophobicContact CD1-CB 3.49Å; L157-Q161 VanDerWaalsContact CD1-CB 3.49Å; L157-Q161 HydrophobicContact CG-CB 4.22Å; L157-L163 HydrophobicContact CB-CD1 4.43Å; L157-L163 HydrophobicContact CD1-CD1 4.04Å; L157-L163 HydrophobicContact CD1-CG 4.01Å; L157-L163 HydrophobicContact CD2-CD1 4.11Å; L157-L163 HydrophobicContact CD2-CG 4.42Å; L157-L163 HydrophobicContact CG-CD1 4.44Å; L157-L314 HydrophobicContact CD1-CD1 3.46Å; L157-L314 VanDerWaalsContact CD1-CD1 3.46Å; L157-I351 HydrophobicContact CB-CG1 4.5Å; L157-I351 HydrophobicContact CD2-CB 4.32Å; L157-I351 HydrophobicContact CD2-CG1 3.46Å; L157-I351 VanDerWaalsContact CD2-CG1 3.46Å; L157-I351 HydrophobicContact CG-CB 4.49Å; L157-I351 HydrophobicContact CG-CG1 3.96Å; L157-S356 CarbonylContact O-C 3.52Å; L157-S356 VanDerWaalsContact O-CA 3.26Å; L157-S356 WeakPolarHBondContact O-CA 3.37Å; L157-L357 WeakPolarHBondContact CB-O 3.46Å; L157-L357 PolarHBondContact N-O 2.98Å; L157-L357 PolarHBondContact O-N 3.28Å
158L91.8Very high88.8Confident89 Ų8945.5 Ų45.547%0.46624%0.24SC..EExtended strand (participates in β ladder)trans-96.5156.3179.2-57.9176.5000110.4L156 Q161L156-L158 HydrophobicContact CD2-CD2 3.95Å; L156-L158 HydrophobicContact CG-CD2 4.07Å; L158-Q161 WeakPolarHBondContact O-CB 3.41Å; L158-Q161 WeakPolarHBondContact O-CG 3.35Å; L158-Q161 PolarHBondContact O-N 3.03Å
159G91.4Very high89Confident25 Ų2544.8 Ų44.826%0.25823%0.231SC..THydrogen-bonded Turntrans-58.1140.8175.900000113.6I351 A352 K355G159-I351 CarbonylContact C-O 3.56Å; G159-I351 WeakPolarHBondContact CA-O 3.49Å; G159-A352 WeakPolarHBondContact CA-O 3.48Å; G159-K355 WeakPolarHBondContact CA-O 3.33Å; G159-K355 PolarHBondContact N-O 3.33Å
160G91Very high89.3Confident6 Ų650.2 Ų50.26%0.06225%0.253CS..THydrogen-bonded Turntrans80.616.5-169.900000113.6G317 I318 I351G160-G317 PolarHBondContact O-N 3.26Å; G160-I318 WeakPolarHBondContact CA-O 3.47Å; G160-I318 PolarHBondContact O-N 2.88Å; G160-I318 VanDerWaalsContact O-N 3.08Å; G160-I351 PolarHBondContact N-O 3.36Å
161Q94.1Very high89.7Confident27 Ų2747.4 Ų47.413%0.12623%0.233CC..EExtended strand (participates in β ladder)trans-124.2151.3175.4-56.3-178.5-40.200111.6L157 L158 L314 L315 E316 Y350 I351L157-Q161 HydrophobicContact CD1-CB 3.49Å; L157-Q161 VanDerWaalsContact CD1-CB 3.49Å; L157-Q161 HydrophobicContact CG-CB 4.22Å; L158-Q161 WeakPolarHBondContact O-CB 3.41Å; L158-Q161 WeakPolarHBondContact O-CG 3.35Å; L158-Q161 PolarHBondContact O-N 3.03Å; Q161-L314 HydrophobicContact CB-CD1 4.04Å; Q161-L315 WeakPolarHBondContact CA-O 3.41Å; Q161-L315 WeakPolarHBondContact CB-O 3.28Å; Q161-E316 HydrophobicContact CG-CG 4.45Å; Q161-Y350 WeakPolarHBondContact O-CD2 3.38Å; Q161-I351 PolarHBondContact O-N 3.29Å; Q161-I351 VanDerWaalsContact O-N 3.09Å
162A93.4Very high90.3Very high0 Ų042.9 Ų42.90%021%0.212CC..EExtended strand (participates in β ladder)trans-131.5141.8171.600000111.2L315 I318 L331 K349 Y350A162-L315 HydrophobicContact CB-CB 4.22Å; A162-L315 HydrophobicContact CB-CD1 4.37Å; A162-L315 PolarHBondContact N-O 3.37Å; A162-L315 PolarHBondContact O-N 2.96Å; A162-I318 HydrophobicContact CB-CD1 3.58Å; A162-L331 HydrophobicContact CB-CD1 4.06Å; A162-K349 CarbonylContact C-O 3.57Å; A162-K349 VanDerWaalsContact CA-O 3.25Å; A162-K349 WeakPolarHBondContact CA-O 3.43Å; A162-Y350 HydrophobicContact CB-CD2 4.16Å
163L93.9Very high90.7Very high14 Ų1440.3 Ų40.37%0.07321%0.206CC..EExtended strand (participates in β ladder)trans-99.3128.1169.7-89.5160.2000108.7L157 L197 T312 L314 I348 K349 A359 F361L157-L163 HydrophobicContact CB-CD1 4.43Å; L157-L163 HydrophobicContact CD1-CD1 4.04Å; L157-L163 HydrophobicContact CD1-CG 4.01Å; L157-L163 HydrophobicContact CD2-CD1 4.11Å; L157-L163 HydrophobicContact CD2-CG 4.42Å; L157-L163 HydrophobicContact CG-CD1 4.44Å; L163-L197 HydrophobicContact CD2-CD1 4.26Å; L163-L197 HydrophobicContact CD2-CD2 3.64Å; L163-T312 HydrophobicContact CD2-CG2 3.48Å; L163-T312 VanDerWaalsContact CD2-CG2 3.48Å; L163-L314 HydrophobicContact CG-CD1 4.32Å; L163-I348 CarbonylContact O-C 3.55Å; L163-I348 VanDerWaalsContact O-CA 3.31Å; L163-I348 WeakPolarHBondContact O-CA 3.43Å; L163-K349 PolarHBondContact N-O 2.83Å; L163-K349 PolarHBondContact O-N 2.99Å; L163-A359 HydrophobicContact CD1-CB 3.68Å; L163-F361 HydrophobicContact CD1-CZ 4.37Å; L163-F361 HydrophobicContact CD2-CZ 4.1Å
164I93.8Very high91.1Very high0 Ų045.7 Ų45.70%023%0.229CC..EExtended strand (participates in β ladder)trans-124.4121.3174.8-55.3-175.6000108.6F166 T312 I313 L315 F335 I345 I348I164-F166 HydrophobicContact CB-CE2 4.38Å; I164-F166 HydrophobicContact CG2-CD1 4.49Å; I164-F166 HydrophobicContact CG2-CD2 4.24Å; I164-F166 HydrophobicContact CG2-CE1 4.06Å; I164-F166 HydrophobicContact CG2-CE2 3.79Å; I164-F166 HydrophobicContact CG2-CZ 3.68Å; I164-T312 CarbonylContact O-C 3.53Å; I164-T312 VanDerWaalsContact O-CA 3.25Å; I164-T312 WeakPolarHBondContact O-CA 3.42Å; I164-T312 WeakPolarHBondContact O-CG2 3Å; I164-I313 HydrophobicContact CB-CG1 3.98Å; I164-I313 PolarHBondContact N-O 2.72Å; I164-I313 PolarHBondContact O-N 3.26Å; I164-L315 HydrophobicContact CD1-CD1 3.45Å; I164-L315 VanDerWaalsContact CD1-CD1 3.45Å; I164-L315 HydrophobicContact CD1-CG 4.07Å; I164-L315 HydrophobicContact CG1-CD1 4.2Å; I164-L315 HydrophobicContact CG1-CG 4.46Å; I164-F335 HydrophobicContact CD1-CB 4.23Å; I164-F335 HydrophobicContact CD1-CD2 3.51Å; I164-F335 HydrophobicContact CD1-CE2 4.07Å; I164-F335 HydrophobicContact CD1-CG 3.92Å; I164-I345 HydrophobicContact CG2-CD1 4.01Å; I164-I345 HydrophobicContact CG2-CG1 4.2Å; I164-I345 HydrophobicContact CG2-CG2 4.09Å; I164-I348 HydrophobicContact CD1-CD1 3.87Å; I164-I348 HydrophobicContact CG1-CD1 3.82Å; I164-I348 HydrophobicContact CG1-CG1 3.92Å
165T92.9Very high91.4Very high23 Ų2345.2 Ų45.214%0.14123%0.225CC..EExtended strand (participates in β ladder)trans-104.3120.8170.4-58.20000109.3R311 T312 E346 N347T165-R311 HydrophobicContact CG2-CB 4.41Å; T165-T312 WeakPolarHBondContact OG1-CG2 3.38Å; T165-T312 PolarHBondContact OG1-OG1 3.43Å; T165-E346 HydrophobicContact CG2-CB 4.25Å; T165-E346 PolarHBondContact O-N 3.3Å; T165-N347 PolarHBondContact N-O 2.92Å; T165-N347 PolarHBondContact O-N 3.21Å
166F93.1Very high91.6Very high0 Ų047 Ų470%023%0.233CC..EExtended strand (participates in β ladder)trans-90.7153174.9-63.4-83.4000111I164 E168 V171 A172 V175 R311 I313 F335 E344 I345I164-F166 HydrophobicContact CB-CE2 4.38Å; I164-F166 HydrophobicContact CG2-CD1 4.49Å; I164-F166 HydrophobicContact CG2-CD2 4.24Å; I164-F166 HydrophobicContact CG2-CE1 4.06Å; I164-F166 HydrophobicContact CG2-CE2 3.79Å; I164-F166 HydrophobicContact CG2-CZ 3.68Å; F166-E168 VanDerWaalsContact C-N 3.35Å; F166-V171 HydrophobicContact CB-CB 4.35Å; F166-V171 HydrophobicContact CB-CG1 4.49Å; F166-V171 HydrophobicContact CD1-CB 4.25Å; F166-V171 HydrophobicContact CD1-CG1 3.5Å; F166-V171 VanDerWaalsContact CD1-CG1 3.5Å; F166-V171 HydrophobicContact CE1-CG1 3.73Å; F166-V171 HydrophobicContact CG-CB 4.26Å; F166-V171 HydrophobicContact CG-CG1 3.92Å; F166-V171 HydrophobicContact CZ-CG1 4.33Å; F166-A172 HydrophobicContact CD2-CB 3.82Å; F166-A172 HydrophobicContact CE2-CB 4.45Å; F166-V175 HydrophobicContact CZ-CG2 4.12Å; F166-R311 PolarHBondContact N-O 2.92Å; F166-R311 WeakPolarHBondContact O-CB 3.38Å; F166-R311 PolarHBondContact O-NH1 2.97Å; F166-I313 HydrophobicContact CE2-CD1 3.69Å; F166-I313 HydrophobicContact CE2-CG1 3.88Å; F166-I313 HydrophobicContact CE2-CG2 4.4Å; F166-I313 HydrophobicContact CZ-CD1 4.18Å; F166-F335 HydrophobicContact CE1-CB 4.18Å; F166-F335 HydrophobicContact CZ-CB 4.17Å; F166-F335 HydrophobicContact CZ-CD1 4.33Å; F166-E344 WeakPolarHBondContact CA-O 3.41Å; F166-I345 HydrophobicContact CD1-CG1 3.96Å; F166-I345 HydrophobicContact CE1-CD1 4.34Å; F166-I345 HydrophobicContact CE1-CG1 3.92Å
167E90.9Very high91.6Very high101 Ų10150.1 Ų50.147%0.47224%0.242SC..SBendtrans-64-43.4171.8-66.6-160.4-173.300111R311 E344 E346E167-R311 WeakPolarHBondContact O-CD 3.15Å; E167-R311 PolarHBondContact O-NH1 2.9Å; E167-R311 VanDerWaalsContact O-NH1 3.11Å; E167-E344 HydrophobicContact CB-CB 4.27Å; E167-E344 HydrophobicContact CG-CB 4.03Å; E167-E344 PolarHBondContact N-O 2.92Å; E167-E346 HydrophobicContact CG-CB 4.16Å
168E90.7Very high91.5Very high112 Ų11252.6 Ų52.652%0.52326%0.256SS..  trans-100.4126.1-179.7-71.5-169.8-126.900113.7F166 K170 V171F166-E168 VanDerWaalsContact C-N 3.35Å; E168-K170 PolarHBondContact O-N 3.35Å; E168-K170 VanDerWaalsContact O-N 3.16Å; E168-V171 HydrophobicContact CB-CG2 3.92Å; E168-V171 PolarHBondContact O-N 3.49Å; E168-V171 VanDerWaalsContact O-N 3.09Å
169E90.4Very high91Very high62 Ų6254 Ų5429%0.2927%0.27SS..Hα-helixtrans-54-36.6171.9168.2172.6-174.900112.7V171 A172 Q173 R310 R311E169-V171 PolarHBondContact O-N 2.97Å; E169-A172 PolarHBondContact O-N 3.1Å; E169-Q173 HydrophobicContact CG-CG 4.29Å; E169-Q173 WeakPolarHBondContact O-CG 3.45Å; E169-Q173 PolarHBondContact O-N 3.21Å; E169-Q173 PolarHBondContact OE1-NE2 2.91Å; E169-R310 HydrophobicContact CB-CB 4.49Å; E169-R310 VanDerWaalsContact CD-CB 3.49Å; E169-R310 HydrophobicContact CG-CB 3.88Å; E169-R310 WeakPolarHBondContact OE1-CD 3.43Å; E169-R310 WeakPolarHBondContact OE2-CD 3.25Å; E169-R310 IonicContact OE2-NH1 3.87Å; E169-R311 HydrophobicContact CB-CG 4Å
170K90.7Very high90.8Very high146 Ų14654.7 Ų54.764%0.63528%0.277SS*.Hα-helixtrans-62.4-31.4-177.9-67.5177-175.71670112.2E168 K174E168-K170 PolarHBondContact O-N 3.35Å; E168-K170 VanDerWaalsContact O-N 3.16Å; K170-K174 VanDerWaalsContact O-CG 3.29Å; K170-K174 WeakPolarHBondContact O-CG 3.32Å; K170-K174 PolarHBondContact O-N 2.76Å
171V91.9Very high90.6Very high9 Ų954.8 Ų54.86%0.05528%0.276CS..Hα-helixtrans-71.2-50.1178.8177.30000109.5F166 E168 E169 Q173 K174 V175 G342F166-V171 HydrophobicContact CB-CB 4.35Å; F166-V171 HydrophobicContact CB-CG1 4.49Å; F166-V171 HydrophobicContact CD1-CB 4.25Å; F166-V171 HydrophobicContact CD1-CG1 3.5Å; F166-V171 VanDerWaalsContact CD1-CG1 3.5Å; F166-V171 HydrophobicContact CE1-CG1 3.73Å; F166-V171 HydrophobicContact CG-CB 4.26Å; F166-V171 HydrophobicContact CG-CG1 3.92Å; F166-V171 HydrophobicContact CZ-CG1 4.33Å; E168-V171 HydrophobicContact CB-CG2 3.92Å; E168-V171 PolarHBondContact O-N 3.49Å; E168-V171 VanDerWaalsContact O-N 3.09Å; E169-V171 PolarHBondContact O-N 2.97Å; V171-Q173 VanDerWaalsContact C-N 3.29Å; V171-Q173 PolarHBondContact O-N 3.4Å; V171-K174 WeakPolarHBondContact O-CB 3.4Å; V171-K174 PolarHBondContact O-N 3.32Å; V171-V175 PolarHBondContact O-N 3.17Å; V171-G342 VanDerWaalsContact CG1-C 3.48Å
172A91Very high90.3Very high0 Ų062.5 Ų62.50%030%0.304CS..Hα-helixtrans-53.3-46.1175.700000111.8F166 E169 K174 V175 L176 R310 I313F166-A172 HydrophobicContact CD2-CB 3.82Å; F166-A172 HydrophobicContact CE2-CB 4.45Å; E169-A172 PolarHBondContact O-N 3.1Å; A172-K174 VanDerWaalsContact C-N 3.32Å; A172-K174 PolarHBondContact O-N 3.41Å; A172-V175 PolarHBondContact O-N 3.36Å; A172-L176 WeakPolarHBondContact O-CB 3.4Å; A172-L176 VanDerWaalsContact O-CG 3.25Å; A172-L176 WeakPolarHBondContact O-CG 3.36Å; A172-L176 PolarHBondContact O-N 3.22Å; A172-R310 WeakPolarHBondContact CB-O 3.31Å; A172-I313 HydrophobicContact CB-CG2 3.97Å
173Q90.4Very high90Very high90 Ų9062.5 Ų62.542%0.42130%0.304SS..Hα-helixtrans-64.3-31.1177.6-69.7-171.40.900114E169 V171 K177E169-Q173 HydrophobicContact CG-CG 4.29Å; E169-Q173 WeakPolarHBondContact O-CG 3.45Å; E169-Q173 PolarHBondContact O-N 3.21Å; E169-Q173 PolarHBondContact OE1-NE2 2.91Å; V171-Q173 VanDerWaalsContact C-N 3.29Å; V171-Q173 PolarHBondContact O-N 3.4Å; Q173-K177 WeakPolarHBondContact O-CG 3.34Å
174K90.9Very high89.6Confident117 Ų11765.5 Ų65.551%0.50933%0.326SS..Hα-helixtrans-70.2-46.4174.6-72.2168.3-175175.60110.5K170 V171 A172 L176 K177K170-K174 VanDerWaalsContact O-CG 3.29Å; K170-K174 WeakPolarHBondContact O-CG 3.32Å; K170-K174 PolarHBondContact O-N 2.76Å; V171-K174 WeakPolarHBondContact O-CB 3.4Å; V171-K174 PolarHBondContact O-N 3.32Å; A172-K174 VanDerWaalsContact C-N 3.32Å; A172-K174 PolarHBondContact O-N 3.41Å; K174-L176 VanDerWaalsContact C-N 3.33Å; K174-L176 PolarHBondContact O-N 2.83Å; K174-K177 WeakPolarHBondContact O-CB 3.4Å; K174-K177 PolarHBondContact O-N 2.82Å; K174-K177 VanDerWaalsContact O-N 3.17Å
175V90Very high89.1Confident0 Ų065.5 Ų65.50%033%0.326CS..Hα-helixtrans-62.2-40.8178.6178.30000111.2F166 V171 A172 K177 L178 P194 I313 F335 S341F166-V175 HydrophobicContact CZ-CG2 4.12Å; V171-V175 PolarHBondContact O-N 3.17Å; A172-V175 PolarHBondContact O-N 3.36Å; V175-K177 PolarHBondContact O-N 3.02Å; V175-L178 VanDerWaalsContact O-CB 3.29Å; V175-L178 WeakPolarHBondContact O-CB 3.44Å; V175-L178 PolarHBondContact O-N 2.83Å; V175-P194 HydrophobicContact CG1-CB 3.87Å; V175-P194 HydrophobicContact CG1-CG 4.22Å; V175-P194 WeakPolarHBondContact O-CG 3.24Å; V175-I313 HydrophobicContact CB-CD1 4.22Å; V175-I313 HydrophobicContact CG1-CD1 3.51Å; V175-F335 HydrophobicContact CG1-CD1 4.09Å; V175-F335 HydrophobicContact CG1-CE1 3.63Å; V175-F335 HydrophobicContact CG2-CD1 4.29Å; V175-S341 WeakPolarHBondContact CG2-O 3.39Å
176L90.5Very high88.4Confident60 Ų6071.3 Ų71.331%0.31435%0.352SS..THydrogen-bonded Turntrans-63.7-20177.3-72.5174.8000114.6A172 K174 L178 G196 I313A172-L176 WeakPolarHBondContact O-CB 3.4Å; A172-L176 VanDerWaalsContact O-CG 3.25Å; A172-L176 WeakPolarHBondContact O-CG 3.36Å; A172-L176 PolarHBondContact O-N 3.22Å; K174-L176 VanDerWaalsContact C-N 3.33Å; K174-L176 PolarHBondContact O-N 2.83Å; L176-L178 VanDerWaalsContact C-N 3.28Å; L176-G196 VanDerWaalsContact CD2-N 3.29Å; L176-I313 HydrophobicContact CD1-CG2 4.07Å; L176-I313 HydrophobicContact CD2-CB 4.17Å; L176-I313 HydrophobicContact CD2-CG2 3.74Å; L176-I313 HydrophobicContact CG-CG2 3.7Å
177K90Very high87.7Confident169 Ų16979.2 Ų79.274%0.73539%0.394SS*.THydrogen-bonded Turntrans-79.7-12.6175-70.7170.1-174.8178.90112.5Q173 K174 V175Q173-K177 WeakPolarHBondContact O-CG 3.34Å; K174-K177 WeakPolarHBondContact O-CB 3.4Å; K174-K177 PolarHBondContact O-N 2.82Å; K174-K177 VanDerWaalsContact O-N 3.17Å; V175-K177 PolarHBondContact O-N 3.02Å
178L87.8Confident87.4Confident55 Ų5578.4 Ų78.429%0.28839%0.392SS..SBendtrans-76.6133.5178.4-59.2175.3000109.8V175 L176 G180 P194V175-L178 VanDerWaalsContact O-CB 3.29Å; V175-L178 WeakPolarHBondContact O-CB 3.44Å; V175-L178 PolarHBondContact O-N 2.83Å; L176-L178 VanDerWaalsContact C-N 3.28Å; L178-G180 PolarHBondContact O-N 3.41Å; L178-P194 HydrophobicContact CB-CG 4.41Å
179P83.1Confident87.1Confident119 Ų11977 Ų7777%0.77339%0.391SS*.SBendtrans-67.8-22.6176.727.6-34.1000112.6
180G86.6Confident87Confident38 Ų3874.2 Ų74.239%0.39238%0.379SS..  trans-179.4161.2177.200000110.2L178 V192L178-G180 PolarHBondContact O-N 3.41Å; G180-V192 CarbonylContact C-O 3.47Å; G180-V192 WeakPolarHBondContact CA-O 3.49Å
181C86.9Confident86.9Confident8 Ų872.9 Ų72.95%0.05438%0.378CS..EExtended strand (participates in β ladder)trans-122141.1179-550000109.3V192 F335C181-V192 HydrophobicContact CB-CG2 3.69Å; C181-V192 PolarHBondContact N-O 3.49Å; C181-V192 PolarHBondContact O-N 3.32Å; C181-F335 HydrophobicContact CB-CE1 4.35Å; C181-F335 HydrophobicContact CB-CZ 3.92Å
182R87.6Confident86.8Confident189 Ų18972.6 Ų72.671%0.71338%0.376SS*.EExtended strand (participates in β ladder)trans-105.4102.2176.5-81.6-174.7-69.2-162.9-0.4109.1T189 L190 N191 H334R182-T189 HydrophobicContact CB-CG2 3.77Å; R182-T189 HydrophobicContact CG-CG2 4.08Å; R182-L190 CarbonylContact C-O 3.56Å; R182-L190 VanDerWaalsContact CA-O 3.31Å; R182-L190 WeakPolarHBondContact CA-O 3.37Å; R182-N191 WeakPolarHBondContact CG-OD1 3.39Å; R182-H334 PolarHBondContact O-NE2 3.24Å
183V87.5Confident86.9Confident0 Ų078.5 Ų78.50%040%0.402CS..EExtended strand (participates in β ladder)trans-93.1122.7-177.5-177.50000108.3T189 L190 V192 L331 H334 F335V183-T189 CarbonylContact O-C 3.39Å; V183-T189 WeakPolarHBondContact O-CA 3.38Å; V183-L190 HydrophobicContact CB-CB 4.39Å; V183-L190 PolarHBondContact N-O 2.86Å; V183-L190 PolarHBondContact O-N 2.73Å; V183-V192 HydrophobicContact CG2-CG1 4.39Å; V183-V192 HydrophobicContact CG2-CG2 3.65Å; V183-L331 HydrophobicContact CB-CD2 4.5Å; V183-L331 HydrophobicContact CG1-CD2 4.18Å; V183-L331 HydrophobicContact CG2-CD2 3.98Å; V183-H334 HydrophobicContact CG1-CB 3.88Å; V183-H334 HydrophobicContact CG2-CB 4.34Å; V183-F335 HydrophobicContact CG2-CE2 4.23Å
184S85Confident87Confident77 Ų7774.7 Ų74.754%0.53839%0.385SS..EExtended strand (participates in β ladder)trans-84.3118174.8-160.20000108.6
185C83.4Confident87Confident0 Ų073.9 Ų73.90%038%0.382CS..EExtended strand (participates in β ladder)trans-115.6102.9172.4-49.40000106.2D187 I188 L190 V321 H330C185-D187 PolarHBondContact O-N 2.92Å; C185-I188 PolarHBondContact N-O 3.5Å; C185-I188 PolarHBondContact O-N 2.83Å; C185-L190 WeakPolarHBondContact SG-CD1 3.43Å; C185-V321 HydrophobicContact CB-CG2 4.42Å; C185-H330 HydrophobicContact CB-CB 4.49Å
186E78.4Confident86.9Confident146 Ų14676 Ų7668%0.68240%0.404SS*.THydrogen-bonded Turntrans40.7-100.9-171.3-57.7-169.2160.100113.7
187D77.3Confident86.8Confident165 Ų16573.5 Ų73.588%0.88239%0.391SS*.THydrogen-bonded Turntrans-95.5-3.3-176.3-67.8-32.5000114.6C185C185-D187 PolarHBondContact O-N 2.92Å
188I84.3Confident86.4Confident84 Ų8469.4 Ų69.443%0.43139%0.388SS..EExtended strand (participates in β ladder)trans-120.5139.9-174-56.2173.1000110.4C185 L190 V321C185-I188 PolarHBondContact N-O 3.5Å; C185-I188 PolarHBondContact O-N 2.83Å; I188-L190 HydrophobicContact CG2-CD2 4.43Å; I188-V321 HydrophobicContact CD1-CB 4.15Å; I188-V321 HydrophobicContact CD1-CG1 4.21Å; I188-V321 HydrophobicContact CG2-CG1 4.16Å
189T85.9Confident86.1Confident83 Ų8368.5 Ų68.551%0.50938%0.384SS..EExtended strand (participates in β ladder)trans-106.7119.3173.5-550000110.6R182 V183R182-T189 HydrophobicContact CB-CG2 3.77Å; R182-T189 HydrophobicContact CG-CG2 4.08Å; V183-T189 CarbonylContact O-C 3.39Å; V183-T189 WeakPolarHBondContact O-CA 3.38Å
190L87.1Confident85.7Confident4 Ų469.1 Ų69.12%0.02138%0.376CS..EExtended strand (participates in β ladder)trans-90.6137.8177.2-61.7-179.9000111.5R182 V183 C185 I188 V192 I318 D319 V321 L327R182-L190 CarbonylContact C-O 3.56Å; R182-L190 VanDerWaalsContact CA-O 3.31Å; R182-L190 WeakPolarHBondContact CA-O 3.37Å; V183-L190 HydrophobicContact CB-CB 4.39Å; V183-L190 PolarHBondContact N-O 2.86Å; V183-L190 PolarHBondContact O-N 2.73Å; C185-L190 WeakPolarHBondContact SG-CD1 3.43Å; I188-L190 HydrophobicContact CG2-CD2 4.43Å; L190-V192 HydrophobicContact CB-CG1 4.39Å; L190-I318 HydrophobicContact CD1-CG2 4.4Å; L190-D319 HydrophobicContact CD2-CB 4.08Å; L190-V321 HydrophobicContact CD1-CG2 3.96Å; L190-V321 HydrophobicContact CD2-CB 4.5Å; L190-V321 HydrophobicContact CD2-CG1 3.71Å; L190-V321 HydrophobicContact CD2-CG2 3.94Å; L190-V321 HydrophobicContact CG-CG2 4.26Å; L190-L327 HydrophobicContact CD1-CD1 3.42Å; L190-L327 VanDerWaalsContact CD1-CD1 3.42Å
191N88.3Confident85.1Confident118 Ų11868.1 Ų68.163%0.63136%0.363SS*.EExtended strand (participates in β ladder)trans-99.4101.1172.7-74.6-50.4000110R182R182-N191 WeakPolarHBondContact CG-OD1 3.39Å
192V91.3Very high84.7Confident2 Ų269 Ų691%0.01237%0.368CS..EExtended strand (participates in β ladder)trans-105.4143.1-179.9-57.70000110.8G180 C181 V183 L190 I318 L331 F335G180-V192 CarbonylContact C-O 3.47Å; G180-V192 WeakPolarHBondContact CA-O 3.49Å; C181-V192 HydrophobicContact CB-CG2 3.69Å; C181-V192 PolarHBondContact N-O 3.49Å; C181-V192 PolarHBondContact O-N 3.32Å; V183-V192 HydrophobicContact CG2-CG1 4.39Å; V183-V192 HydrophobicContact CG2-CG2 3.65Å; L190-V192 HydrophobicContact CB-CG1 4.39Å; V192-I318 HydrophobicContact CB-CG1 4.42Å; V192-I318 HydrophobicContact CG1-CG1 3.59Å; V192-L331 HydrophobicContact CG1-CD2 4.38Å; V192-F335 HydrophobicContact CG2-CE2 4.33Å; V192-F335 HydrophobicContact CG2-CZ 4.1Å
193K92.6Very high84.4Confident125 Ų12560.3 Ų60.354%0.54334%0.336SS..EExtended strand (participates in β ladder)trans-111.1116.9-180-171.1175.3-178.8179.30110.8E316K193-E316 PolarHBondContact N-O 3.35Å; K193-E316 PolarHBondContact O-N 3.35Å
194P92.5Very high84.3Confident9 Ų964 Ų646%0.05835%0.353CS..EExtended strand (participates in β ladder)trans-75.2140.2174.130.9-32.6000111V175 L178 I313 L314 L315V175-P194 HydrophobicContact CG1-CB 3.87Å; V175-P194 HydrophobicContact CG1-CG 4.22Å; V175-P194 WeakPolarHBondContact O-CG 3.24Å; L178-P194 HydrophobicContact CB-CG 4.41Å; P194-I313 HydrophobicContact CB-CD1 4.27Å; P194-L314 CarbonylContact C-O 3.37Å; P194-L315 HydrophobicContact CB-CD2 3.99Å
195K91.6Very high84.4Confident100 Ų10061.6 Ų61.644%0.43533%0.332SS..EExtended strand (participates in β ladder)trans-141.4141.6-179-172176.5173.7-176.60110.7L314 E316K195-L314 PolarHBondContact N-O 2.98Å; K195-L314 PolarHBondContact O-N 3.4Å; K195-E316 WeakPolarHBondContact CD-OE1 3.42Å; K195-E316 WeakPolarHBondContact CD-OE2 3.5Å; K195-E316 IonicContact NZ-OE1 3.7Å; K195-E316 PolarHBondContact NZ-OE1 3.07Å; K195-E316 IonicContact NZ-OE2 2.82Å; K195-E316 PolarHBondContact NZ-OE2 2.96Å
196G88.3Confident84.8Confident45 Ų4562.8 Ų62.846%0.46434%0.338SS..EExtended strand (participates in β ladder)trans-66.7138176.700000110.7L176L176-G196 VanDerWaalsContact CD2-N 3.29Å
197L86.8Confident85.3Confident8 Ų856.7 Ų56.74%0.04231%0.311CS..EExtended strand (participates in β ladder)trans-93.1109.2-178.8-171.868.6000110.5V155 L163 L199 S308 S309 T312 L314 F361V155-L197 HydrophobicContact CG1-CD1 4.04Å; V155-L197 HydrophobicContact CG2-CD1 4.04Å; V155-L197 HydrophobicContact CG2-CD2 4.41Å; V155-L197 HydrophobicContact CG2-CG 4.37Å; L163-L197 HydrophobicContact CD2-CD1 4.26Å; L163-L197 HydrophobicContact CD2-CD2 3.64Å; L197-L199 HydrophobicContact CD2-CD2 3.64Å; L197-L199 HydrophobicContact CD2-CG 4.49Å; L197-L199 HydrophobicContact CG-CD2 3.97Å; L197-S308 CarbonylContact O-C 3.56Å; L197-S308 WeakPolarHBondContact O-CA 3.48Å; L197-S308 WeakPolarHBondContact O-CB 3.32Å; L197-S309 PolarHBondContact O-N 2.92Å; L197-T312 HydrophobicContact CD2-CG2 3.92Å; L197-L314 HydrophobicContact CD1-CB 4.36Å; L197-F361 HydrophobicContact CD2-CE1 3.75Å; L197-F361 HydrophobicContact CD2-CE2 4.05Å; L197-F361 HydrophobicContact CD2-CZ 3.33Å
198A83Confident85.9Confident83 Ų8350.9 Ų50.969%0.68628%0.278SS*.EExtended strand (participates in β ladder)trans-82.4116.4168.700000109
199L81.3Confident86.2Confident36 Ų3649.2 Ų49.219%0.18827%0.269CS..PPolyproline II helixtrans-86.4146.1177.7-63.7176.8000110.5A153 V155 L197 G307 F361A153-L199 HydrophobicContact CB-CB 4.09Å; V155-L199 HydrophobicContact CG2-CD2 3.65Å; L197-L199 HydrophobicContact CD2-CD2 3.64Å; L197-L199 HydrophobicContact CD2-CG 4.49Å; L197-L199 HydrophobicContact CG-CD2 3.97Å; L199-G307 WeakPolarHBondContact CB-O 3.46Å; L199-G307 PolarHBondContact N-O 3.39Å; L199-G307 VanDerWaalsContact N-O 3.11Å; L199-F361 HydrophobicContact CD1-CB 4.25Å; L199-F361 HydrophobicContact CD1-CD1 4.18Å; L199-F361 HydrophobicContact CD1-CG 4.09Å; L199-F361 HydrophobicContact CD2-CD1 4.02Å; L199-F361 HydrophobicContact CD2-CD2 3.47Å; L199-F361 VanDerWaalsContact CD2-CD2 3.47Å; L199-F361 HydrophobicContact CD2-CE1 4.12Å; L199-F361 HydrophobicContact CD2-CE2 3.6Å; L199-F361 HydrophobicContact CD2-CG 3.71Å; L199-F361 HydrophobicContact CD2-CZ 3.94Å
200E74.1Confident86.4Confident131 Ų13147.8 Ų47.861%0.61226%0.258SS*.PPolyproline II helixtrans-63.1160.3166.7-66.4-168.8168.300110.8A153 S202A153-E200 WeakPolarHBondContact CB-O 3.17Å; E200-S202 PolarHBondContact O-N 3.37Å; E200-S202 VanDerWaalsContact O-N 3.14Å
201T74.6Confident86.5Confident18 Ų1848.9 Ų48.911%0.1127%0.265CS..  trans-67.3115.2180-58.70000109.8K111 F112 V203 S305 C306K111-T201 WeakPolarHBondContact CE-OG1 3.24Å; F112-T201 HydrophobicContact CD1-CG2 4.07Å; F112-T201 HydrophobicContact CE1-CG2 3.69Å; T201-V203 HydrophobicContact CG2-CG2 4.09Å; T201-S305 WeakPolarHBondContact CA-O 3.36Å; T201-C306 HydrophobicContact CG2-CB 4.48Å
202S78.6Confident86.7Confident25 Ų2544.7 Ų44.718%0.17525%0.245CC..EExtended strand (participates in β ladder)trans-83.5145.8166.834.30000110.1Q151 E200 S305Q151-S202 VanDerWaalsContact O-CA 3.29Å; Q151-S202 WeakPolarHBondContact O-CA 3.4Å; Q151-S202 VanDerWaalsContact O-CB 3.31Å; Q151-S202 WeakPolarHBondContact O-CB 3.42Å; E200-S202 PolarHBondContact O-N 3.37Å; E200-S202 VanDerWaalsContact O-N 3.14Å; S202-S305 PolarHBondContact N-O 2.84Å; S202-S305 PolarHBondContact O-N 2.78Å; S202-S305 PolarHBondContact OG-O 2.92Å; S202-S305 PolarHBondContact OG-OG 3.39Å
203V80.5Confident86.6Confident7 Ų747.2 Ų47.24%0.04225%0.254CS..EExtended strand (participates in β ladder)trans-136134.3-178.4-171.30000110.1I114 S150 Q151 T201 F205 F302 Q303 T304I114-V203 HydrophobicContact CD1-CB 3.75Å; I114-V203 HydrophobicContact CD1-CG1 3.31Å; I114-V203 HydrophobicContact CD1-CG2 3.64Å; I114-V203 HydrophobicContact CG1-CB 4.29Å; I114-V203 HydrophobicContact CG1-CG1 4.35Å; I114-V203 HydrophobicContact CG1-CG2 3.93Å; S150-V203 CarbonylContact C-O 3.58Å; S150-V203 WeakPolarHBondContact CA-O 3.07Å; Q151-V203 PolarHBondContact N-O 2.87Å; Q151-V203 PolarHBondContact O-N 3.46Å; T201-V203 HydrophobicContact CG2-CG2 4.09Å; V203-F205 HydrophobicContact CG1-CD1 4.27Å; V203-F302 HydrophobicContact CG1-CD2 4.11Å; V203-F302 HydrophobicContact CG1-CE2 3.4Å; V203-F302 VanDerWaalsContact CG1-CE2 3.4Å; V203-F302 HydrophobicContact CG1-CZ 3.78Å; V203-Q303 WeakPolarHBondContact CA-O 3.43Å; V203-T304 HydrophobicContact CG1-CG2 4.23Å; V203-T304 HydrophobicContact CG2-CG2 4.21Å
204K86.3Confident86.6Confident79 Ų7942.9 Ų42.934%0.34324%0.235SC..EExtended strand (participates in β ladder)trans-131.1133.9176.5-177.6-179.9178.5-175.90108.8T148 I149 Q303T148-K204 HydrophobicContact CG2-CG 4.11Å; I149-K204 WeakPolarHBondContact O-CA 3.49Å; K204-Q303 HydrophobicContact CB-CB 4.41Å; K204-Q303 PolarHBondContact N-O 3.06Å; K204-Q303 PolarHBondContact O-N 3.39Å
205F87.1Confident86.7Confident25 Ų2545 Ų4511%0.1124%0.244CC..EExtended strand (participates in β ladder)trans-152.7162.8175.663-84.6000110.1I149 V203 V207 L299 F302I149-F205 HydrophobicContact CB-CD1 4.32Å; I149-F205 HydrophobicContact CB-CD2 4.39Å; I149-F205 HydrophobicContact CB-CE1 3.87Å; I149-F205 HydrophobicContact CB-CE2 3.96Å; I149-F205 HydrophobicContact CB-CZ 3.68Å; I149-F205 HydrophobicContact CD1-CE2 3.72Å; I149-F205 HydrophobicContact CD1-CZ 3.75Å; I149-F205 HydrophobicContact CG1-CE2 4.26Å; I149-F205 HydrophobicContact CG1-CZ 4.26Å; I149-F205 HydrophobicContact CG2-CD1 4.49Å; I149-F205 HydrophobicContact CG2-CE1 3.68Å; I149-F205 HydrophobicContact CG2-CE2 4.43Å; I149-F205 HydrophobicContact CG2-CZ 3.65Å; I149-F205 PolarHBondContact N-O 3.3Å; I149-F205 PolarHBondContact O-N 2.96Å; V203-F205 HydrophobicContact CG1-CD1 4.27Å; F205-V207 HydrophobicContact CD2-CG2 4.05Å; F205-V207 HydrophobicContact CE2-CG2 3.66Å; F205-L299 HydrophobicContact CD2-CD2 3.98Å; F205-L299 HydrophobicContact CE2-CD2 3.95Å; F205-F302 HydrophobicContact CB-CB 4.44Å; F205-F302 HydrophobicContact CB-CD2 3.94Å; F205-F302 HydrophobicContact CG-CD2 4.46Å
206E90.4Very high86.9Confident26 Ų2640.2 Ų40.212%0.12122%0.224CC..EExtended strand (participates in β ladder)trans-109.1135.7174.8-68179.8-177.100110V146 F147 T148 H208 L299 E300 K301V146-E206 HydrophobicContact CG1-CB 4.49Å; F147-E206 CarbonylContact O-C 3.55Å; F147-E206 VanDerWaalsContact O-CA 3.3Å; F147-E206 WeakPolarHBondContact O-CA 3.49Å; T148-E206 HydrophobicContact CG2-CG 4.47Å; E206-H208 IonicContact OE2-CE1 2.81Å; E206-H208 IonicContact OE2-NE2 2.81Å; E206-H208 PolarHBondContact OE2-NE2 2.93Å; E206-L299 CarbonylContact O-C 3.58Å; E206-L299 WeakPolarHBondContact O-CA 3.45Å; E206-E300 PolarHBondContact N-O 2.83Å; E206-E300 PolarHBondContact O-N 3.03Å; E206-K301 VanDerWaalsContact CD-CD 3.49Å; E206-K301 HydrophobicContact CG-CB 4.36Å; E206-K301 HydrophobicContact CG-CD 4.43Å; E206-K301 WeakPolarHBondContact OE1-CD 3.33Å; E206-K301 IonicContact OE1-NZ 3.94Å; E206-K301 PolarHBondContact OE1-NZ 3.28Å; E206-K301 WeakPolarHBondContact OE2-CD 3.29Å; E206-K301 WeakPolarHBondContact OE2-CE 3.49Å; E206-K301 IonicContact OE2-NZ 2.72Å; E206-K301 PolarHBondContact OE2-NZ 3.28Å
207V88.9Confident87.2Confident17 Ų1742.5 Ų42.510%0.10322%0.221CC..EExtended strand (participates in β ladder)trans-100.2109.5168-173.50000107V146 F147 I149 F205 L299V146-V207 WeakPolarHBondContact CA-O 3.06Å; F147-V207 HydrophobicContact CB-CB 4.33Å; F147-V207 PolarHBondContact N-O 3.15Å; F147-V207 PolarHBondContact O-N 2.82Å; I149-V207 HydrophobicContact CD1-CG2 3.53Å; I149-V207 HydrophobicContact CG1-CG2 4.21Å; F205-V207 HydrophobicContact CD2-CG2 4.05Å; F205-V207 HydrophobicContact CE2-CG2 3.66Å; V207-L299 HydrophobicContact CB-CD2 4.33Å; V207-L299 HydrophobicContact CG1-CD2 4.32Å; V207-L299 HydrophobicContact CG2-CD2 3.72Å
208H90.7Very high87.7Confident43 Ų4342.2 Ų42.220%0.19922%0.22CC..EExtended strand (participates in β ladder)trans-92.6118.1171.4-71.4-118.5000106.9E206 Y297 Q298 E300E206-H208 IonicContact OE2-CE1 2.81Å; E206-H208 IonicContact OE2-NE2 2.81Å; E206-H208 PolarHBondContact OE2-NE2 2.93Å; H208-Y297 CarbonylContact O-C 3.56Å; H208-Y297 WeakPolarHBondContact O-CA 3.39Å; H208-Q298 PolarHBondContact N-O 2.91Å; H208-Q298 PolarHBondContact O-N 2.86Å; H208-E300 IonicContact CD2-OE2 2.86Å; H208-E300 IonicContact CE1-OE2 3.66Å; H208-E300 PolarHBondContact CE1-OE2 3.42Å; H208-E300 IonicContact NE2-OE2 2.76Å; H208-E300 PolarHBondContact NE2-OE2 2.95Å
209M89.6Confident88.2Confident50 Ų5040.4 Ų40.425%0.24620%0.202CC..EExtended strand (participates in β ladder)trans-127.5127.3-174.8-178.9175.259.200109.6R144 G145 F147 V211 Y295 E296R144-M209 CarbonylContact C-O 3.58Å; R144-M209 WeakPolarHBondContact CA-O 3.48Å; G145-M209 PolarHBondContact N-O 3.44Å; G145-M209 PolarHBondContact O-N 3.42Å; F147-M209 HydrophobicContact CE2-CB 4.38Å; F147-M209 HydrophobicContact CE2-CE 3.61Å; F147-M209 HydrophobicContact CZ-CE 4.12Å; M209-V211 HydrophobicContact CE-CG2 3.86Å; M209-V211 HydrophobicContact CG-CG2 3.83Å; M209-V211 HydrophobicContact SD-CG2 3.92Å; M209-Y295 HydrophobicContact CG-CD2 4.28Å; M209-Y295 HydrophobicContact SD-CD2 4.08Å; M209-Y295 HydrophobicContact SD-CG 4.3Å; M209-E296 CarbonylContact C-O 3.52Å; M209-E296 WeakPolarHBondContact CA-O 3.35Å
210D90.6Very high88.8Confident52 Ų5244 Ų4428%0.27822%0.221SC..EExtended strand (participates in β ladder)trans-111.3109.6174.4-75.5-30000108.5R144 Y295 E296R144-D210 WeakPolarHBondContact CA-OD1 3.24Å; R144-D210 WeakPolarHBondContact CB-OD1 3.34Å; R144-D210 WeakPolarHBondContact CG-OD1 3.34Å; R144-D210 IonicContact CZ-OD1 2.64Å; R144-D210 IonicContact NE-OD1 2.75Å; R144-D210 PolarHBondContact NE-OD1 2.89Å; R144-D210 IonicContact NE-OD2 2.77Å; R144-D210 IonicContact NH2-OD1 3.35Å; R144-D210 IonicContact NH2-OD2 2.97Å; R144-D210 PolarHBondContact NH2-OD2 3.42Å; D210-Y295 CarbonylContact O-C 3.53Å; D210-Y295 WeakPolarHBondContact O-CA 3.16Å; D210-E296 PolarHBondContact N-O 2.9Å; D210-E296 PolarHBondContact O-N 3.23Å
211V90.2Very high89.6Confident28 Ų2838.1 Ų38.117%0.1719%0.194CC..EExtended strand (participates in β ladder)trans-100.2120.6-177.8-174.20000109.8S142 V143 M209 P293S142-V211 CarbonylContact C-O 3.44Å; S142-V211 WeakPolarHBondContact CA-O 3.31Å; S142-V211 WeakPolarHBondContact CB-O 3.39Å; V143-V211 PolarHBondContact N-O 3.26Å; V143-V211 PolarHBondContact O-N 2.94Å; M209-V211 HydrophobicContact CE-CG2 3.86Å; M209-V211 HydrophobicContact CG-CG2 3.83Å; M209-V211 HydrophobicContact SD-CG2 3.92Å; V211-P293 HydrophobicContact CG1-CB 4.02Å
212S91.1Very high90.2Very high29 Ų2939.5 Ų39.520%0.20320%0.203CC..EExtended strand (participates in β ladder)trans-67.1137.4178.7-172.90000112.2K214 E215 A294S212-K214 PolarHBondContact OG-N 3.19Å; S212-E215 VanDerWaalsContact OG-CB 3.24Å; S212-E215 WeakPolarHBondContact OG-CB 3.35Å; S212-E215 PolarHBondContact OG-N 2.86Å; S212-A294 PolarHBondContact N-O 2.95Å
213R90Very high90.5Very high56 Ų5643.4 Ų43.421%0.21123%0.228CC..EExtended strand (participates in β ladder)trans-87-19174.9-64.5-175.6-86.4-176-11.3112.8V139 S140 D141 S142 V143 P267 G268V139-R213 VanDerWaalsContact C-NH2 3.33Å; V139-R213 PolarHBondContact O-NH2 3.34Å; S140-R213 VanDerWaalsContact CA-NH2 3.28Å; S140-R213 PolarHBondContact OG-NH2 2.94Å; D141-R213 VanDerWaalsContact N-NH2 3.13Å; D141-R213 VanDerWaalsContact O-CB 3.28Å; D141-R213 WeakPolarHBondContact O-CB 3.41Å; D141-R213 PolarHBondContact O-N 3.31Å; S142-R213 PolarHBondContact O-NE 3.46Å; S142-R213 VanDerWaalsContact O-NE 3.13Å; S142-R213 PolarHBondContact O-NH2 3.35Å; V143-R213 HydrophobicContact CG2-CG 3.72Å; R213-P267 HydrophobicContact CB-CB 4.08Å; R213-G268 PolarHBondContact O-N 2.76Å
214K91.9Very high90.6Very high33 Ų3345.2 Ų45.214%0.14324%0.243CC..EExtended strand (participates in β ladder)trans-113.3-25.6-174.9-72.8-179.8-178.9163.70113D141 S212 K263 F264 P267D141-K214 VanDerWaalsContact CG-NZ 3.3Å; D141-K214 WeakPolarHBondContact OD1-CE 3.16Å; D141-K214 IonicContact OD1-NZ 2.71Å; D141-K214 PolarHBondContact OD1-NZ 3.06Å; D141-K214 IonicContact OD2-NZ 3.46Å; D141-K214 PolarHBondContact OD2-NZ 2.87Å; D141-K214 VanDerWaalsContact OD2-NZ 3.14Å; S212-K214 PolarHBondContact OG-N 3.19Å; K214-K263 HydrophobicContact CB-CG 4.4Å; K214-F264 WeakPolarHBondContact CB-O 3.31Å; K214-F264 WeakPolarHBondContact CG-O 3.29Å; K214-F264 WeakPolarHBondContact O-CD2 3.19Å; K214-F264 PolarHBondContact O-N 2.84Å; K214-P267 HydrophobicContact CG-CB 4.21Å
215E94.7Very high90.6Very high53 Ų5342.3 Ų42.325%0.24823%0.231CC..EExtended strand (participates in β ladder)trans-98.4137.8-176.2-167.2-171.2159.400112.4S212 K217 S261 I262 A294S212-E215 VanDerWaalsContact OG-CB 3.24Å; S212-E215 WeakPolarHBondContact OG-CB 3.35Å; S212-E215 PolarHBondContact OG-N 2.86Å; E215-K217 IonicContact OE1-NZ 3.41Å; E215-K217 PolarHBondContact OE1-NZ 3.23Å; E215-S261 WeakPolarHBondContact OE1-CB 3.43Å; E215-I262 CarbonylContact C-O 3.52Å; E215-I262 WeakPolarHBondContact CA-O 3.41Å; E215-A294 HydrophobicContact CB-CB 3.74Å; E215-A294 HydrophobicContact CG-CB 3.68Å; E215-A294 WeakPolarHBondContact O-CB 3.46Å; E215-A294 PolarHBondContact O-N 3.21Å
216L95.8Very high90.8Very high0 Ų045.4 Ų45.40%025%0.254CS..EExtended strand (participates in β ladder)trans-120.4129.1177.5-176.577.5000109.4V218 F238 S261 I262 F264 A270 L273 A274 V291 G292L216-V218 HydrophobicContact CD2-CG2 4.32Å; L216-F238 HydrophobicContact CD2-CD1 4.11Å; L216-F238 HydrophobicContact CD2-CE1 3.59Å; L216-F238 HydrophobicContact CD2-CZ 4.43Å; L216-S261 WeakPolarHBondContact O-CA 3.3Å; L216-I262 HydrophobicContact CB-CB 4.5Å; L216-I262 PolarHBondContact N-O 2.97Å; L216-I262 PolarHBondContact O-N 2.85Å; L216-F264 HydrophobicContact CB-CE2 3.93Å; L216-F264 HydrophobicContact CD2-CE2 4.18Å; L216-A270 HydrophobicContact CB-CB 4.11Å; L216-A270 WeakPolarHBondContact CD1-O 3.34Å; L216-L273 HydrophobicContact CD1-CB 4.11Å; L216-L273 HydrophobicContact CD2-CB 3.94Å; L216-L273 HydrophobicContact CD2-CD1 3.95Å; L216-A274 HydrophobicContact CD1-CB 3.82Å; L216-V291 HydrophobicContact CD1-CB 4.21Å; L216-V291 HydrophobicContact CD2-CB 4.08Å; L216-V291 HydrophobicContact CD2-CG1 4.05Å; L216-V291 HydrophobicContact CG-CB 4.31Å; L216-G292 VanDerWaalsContact CD1-O 3.24Å; L216-G292 WeakPolarHBondContact CD1-O 3.25Å
217K96.2Very high90.8Very high94 Ų9448 Ų4841%0.40927%0.266SS..EExtended strand (participates in β ladder)trans-86.6135.7169.9-73-59.9-172.5-149.50110.4E215 S261 V291 G292 A294E215-K217 IonicContact OE1-NZ 3.41Å; E215-K217 PolarHBondContact OE1-NZ 3.23Å; K217-S261 PolarHBondContact NZ-OG 3.36Å; K217-V291 CarbonylContact O-C 3.52Å; K217-V291 WeakPolarHBondContact O-CA 3.39Å; K217-G292 PolarHBondContact N-O 2.82Å; K217-G292 PolarHBondContact O-N 2.86Å; K217-A294 HydrophobicContact CG-CB 3.89Å
218V95.4Very high90.9Very high2 Ų252.8 Ų52.81%0.01229%0.291CS..EExtended strand (participates in β ladder)trans-121.5135.7178.5-170.50000108.5L216 I221 F238 T259 G260 I262 V289 K290 V291L216-V218 HydrophobicContact CD2-CG2 4.32Å; V218-I221 HydrophobicContact CB-CD1 4.22Å; V218-I221 HydrophobicContact CG1-CD1 3.91Å; V218-I221 HydrophobicContact CG1-CG1 3.96Å; V218-F238 HydrophobicContact CG1-CZ 4.3Å; V218-F238 HydrophobicContact CG2-CE1 4.4Å; V218-F238 HydrophobicContact CG2-CE2 4.28Å; V218-F238 HydrophobicContact CG2-CZ 3.77Å; V218-T259 CarbonylContact O-C 3.54Å; V218-T259 VanDerWaalsContact O-CA 3.27Å; V218-T259 WeakPolarHBondContact O-CA 3.2Å; V218-G260 PolarHBondContact N-O 2.88Å; V218-G260 PolarHBondContact O-N 3.41Å; V218-I262 HydrophobicContact CG2-CD1 3.65Å; V218-I262 HydrophobicContact CG2-CG1 3.97Å; V218-V289 HydrophobicContact CG1-CB 3.77Å; V218-V289 HydrophobicContact CG1-CG1 4.45Å; V218-V289 HydrophobicContact CG1-CG2 3.51Å; V218-K290 CarbonylContact C-O 3.57Å; V218-K290 WeakPolarHBondContact CA-O 3.37Å; V218-V291 HydrophobicContact CG1-CG1 4.31Å; V218-V291 HydrophobicContact CG2-CG1 4.17Å
219S94.8Very high90.9Very high45 Ų4556.8 Ų56.832%0.31530%0.304SS..EExtended strand (participates in β ladder)trans-139.9166-178.758.30000111.4K290S219-K290 PolarHBondContact N-O 2.87Å; S219-K290 PolarHBondContact O-N 3.41Å; S219-K290 WeakPolarHBondContact OG-CB 3.13Å
220N92.5Very high91.1Very high112 Ų11254.4 Ų54.460%0.59929%0.293SS*.  trans63.540.9-175.8-165.353.3000112.2P222 G258N220-P222 WeakPolarHBondContact O-CD 3.37Å; N220-G258 PolarHBondContact N-O 2.68Å
221I91.4Very high91.2Very high6 Ų653.9 Ų53.93%0.03129%0.289CS..  trans-82.2120.4175.6-58.9163.4000107.9V218 T230 L234 Y253 G258 L283 V289V218-I221 HydrophobicContact CB-CD1 4.22Å; V218-I221 HydrophobicContact CG1-CD1 3.91Å; V218-I221 HydrophobicContact CG1-CG1 3.96Å; I221-T230 HydrophobicContact CG2-CG2 3.99Å; I221-L234 HydrophobicContact CD1-CD1 4.07Å; I221-L234 HydrophobicContact CD1-CD2 4.45Å; I221-Y253 HydrophobicContact CB-CE2 3.86Å; I221-Y253 HydrophobicContact CD1-CD2 3.68Å; I221-Y253 HydrophobicContact CD1-CE2 3.65Å; I221-Y253 HydrophobicContact CG1-CE2 4.37Å; I221-Y253 HydrophobicContact CG2-CE2 3.81Å; I221-G258 PolarHBondContact N-O 3.42Å; I221-G258 VanDerWaalsContact N-O 3.13Å; I221-L283 HydrophobicContact CG2-CD1 4.21Å; I221-V289 HydrophobicContact CG1-CG1 4.2Å
222P88.3Confident91.4Very high48 Ų4856.8 Ų56.831%0.31230%0.303SS..  trans-64137.8178.9-21.432.9000112N220 A224 V287N220-P222 WeakPolarHBondContact O-CD 3.37Å; P222-A224 PolarHBondContact O-N 3.22Å; P222-V287 HydrophobicContact CG-CG1 4.4Å; P222-V287 HydrophobicContact CG-CG2 4.43Å
223P84.3Confident91.5Very high107 Ų10759.7 Ų59.770%0.69531%0.31SS*.  trans-79.159.6175.634.8-36.3000110.6
224A81.9Confident91.7Very high44 Ų4457.1 Ų57.136%0.36430%0.3SS..  trans-83.3-22.1-176.400000112.7P222 E284P222-A224 PolarHBondContact O-N 3.22Å; A224-E284 HydrophobicContact CB-CG 4.37Å
225M86.9Confident91.8Very high18 Ų1859.6 Ų59.69%0.08931%0.312CS..SBendtrans-149.2164.7-16862.9-160.3-64.200111.9R229 T230 R233 L283M225-R229 HydrophobicContact CE-CB 3.6Å; M225-R229 HydrophobicContact CE-CG 3.28Å; M225-R229 WeakPolarHBondContact CE-O 3.25Å; M225-T230 WeakPolarHBondContact CG-OG1 3.03Å; M225-T230 PolarHBondContact O-OG1 2.96Å; M225-R233 HydrophobicContact CE-CG 3.65Å; M225-R233 HydrophobicContact SD-CG 4.12Å; M225-L283 HydrophobicContact SD-CB 4.11Å; M225-L283 HydrophobicContact SD-CD2 4.16Å
226P90.6Very high91.8Very high90 Ų9060.7 Ų60.758%0.58432%0.319SS*.  trans-58.5156.4176.6-23.934.7000112.7D228 R229 T230P226-D228 PolarHBondContact O-N 2.77Å; P226-R229 PolarHBondContact O-N 3.05Å; P226-T230 PolarHBondContact O-N 3.36Å; P226-T230 PolarHBondContact O-OG1 2.91Å
227Q91.1Very high91.7Very high81 Ų8160.8 Ų60.838%0.37932%0.319SS..Hα-helixtrans-52.5-59.6-175.5-175.6174.8-19.200112.4R229 T230 E231 Y253 V255Q227-R229 PolarHBondContact O-N 3.04Å; Q227-T230 WeakPolarHBondContact O-CA 3.19Å; Q227-T230 VanDerWaalsContact O-CB 3.27Å; Q227-T230 WeakPolarHBondContact O-CB 3.34Å; Q227-T230 PolarHBondContact O-N 3.4Å; Q227-E231 WeakPolarHBondContact CG-OE1 3.22Å; Q227-E231 PolarHBondContact NE2-OE1 3.13Å; Q227-E231 PolarHBondContact O-N 3.38Å; Q227-Y253 HydrophobicContact CG-CD1 4.08Å; Q227-Y253 PolarHBondContact NE2-O 2.8Å; Q227-Y253 VanDerWaalsContact NE2-O 3.07Å; Q227-V255 HydrophobicContact CB-CG2 3.6Å; Q227-V255 HydrophobicContact CG-CG2 3.83Å
228D90.8Very high91.6Very high117 Ų11756.3 Ų56.363%0.62630%0.3SS*.Hα-helixtrans-53.2-44.7-177.3-47-10.5000111.2P226 T230 E231 D232P226-D228 PolarHBondContact O-N 2.77Å; D228-T230 VanDerWaalsContact C-N 3.29Å; D228-T230 PolarHBondContact O-N 2.93Å; D228-E231 PolarHBondContact O-N 2.82Å; D228-D232 PolarHBondContact O-N 2.94Å
229R91.9Very high91.5Very high127 Ų12758.4 Ų58.448%0.47932%0.315SS..Hα-helixtrans-69.9-29.1-179.4-153.5-170.2174.5-167.73.6111.8M225 P226 Q227 R233M225-R229 HydrophobicContact CE-CB 3.6Å; M225-R229 HydrophobicContact CE-CG 3.28Å; M225-R229 WeakPolarHBondContact CE-O 3.25Å; P226-R229 PolarHBondContact O-N 3.05Å; Q227-R229 PolarHBondContact O-N 3.04Å; R229-R233 VanDerWaalsContact O-CG 3.28Å; R229-R233 WeakPolarHBondContact O-CG 3.45Å; R229-R233 PolarHBondContact O-N 3.33Å
230T92.3Very high91.4Very high0 Ų061.2 Ų61.20%032%0.318CS..Hα-helixtrans-71.4-44.4175.6-52.70000110.3I221 M225 P226 Q227 D228 R233 L234 Y253 L283I221-T230 HydrophobicContact CG2-CG2 3.99Å; M225-T230 WeakPolarHBondContact CG-OG1 3.03Å; M225-T230 PolarHBondContact O-OG1 2.96Å; P226-T230 PolarHBondContact O-N 3.36Å; P226-T230 PolarHBondContact O-OG1 2.91Å; Q227-T230 WeakPolarHBondContact O-CA 3.19Å; Q227-T230 VanDerWaalsContact O-CB 3.27Å; Q227-T230 WeakPolarHBondContact O-CB 3.34Å; Q227-T230 PolarHBondContact O-N 3.4Å; D228-T230 VanDerWaalsContact C-N 3.29Å; D228-T230 PolarHBondContact O-N 2.93Å; T230-R233 PolarHBondContact O-N 3.36Å; T230-R233 VanDerWaalsContact O-N 3.17Å; T230-L234 HydrophobicContact CG2-CD1 4.05Å; T230-L234 HydrophobicContact CG2-CG 4.4Å; T230-L234 VanDerWaalsContact O-CG 3.29Å; T230-L234 WeakPolarHBondContact O-CG 3.09Å; T230-L234 PolarHBondContact O-N 3.1Å; T230-Y253 HydrophobicContact CG2-CD1 3.8Å; T230-Y253 HydrophobicContact CG2-CE1 3.64Å; T230-Y253 HydrophobicContact CG2-CG 4.31Å; T230-L283 HydrophobicContact CG2-CD2 4.3Å
231E93.6Very high91.2Very high42 Ų4261 Ų6120%0.19632%0.323CS..Hα-helixtrans-57.9-49.4176.8-69.6173.2-176.200110.9Q227 D228 R233 L234 E235 V251 Y253Q227-E231 WeakPolarHBondContact CG-OE1 3.22Å; Q227-E231 PolarHBondContact NE2-OE1 3.13Å; Q227-E231 PolarHBondContact O-N 3.38Å; D228-E231 PolarHBondContact O-N 2.82Å; E231-R233 VanDerWaalsContact C-N 3.29Å; E231-R233 PolarHBondContact O-N 2.79Å; E231-L234 WeakPolarHBondContact O-CB 3.32Å; E231-L234 PolarHBondContact O-N 3.46Å; E231-L234 VanDerWaalsContact O-N 3.13Å; E231-E235 PolarHBondContact O-N 3.46Å; E231-V251 HydrophobicContact CB-CG1 4.25Å; E231-V251 HydrophobicContact CG-CG1 4.31Å; E231-Y253 PolarHBondContact OE1-N 2.92Å
232D94Very high90.9Very high88 Ų8866.8 Ų66.847%0.47136%0.359SS..Hα-helixtrans-54.7-43.7174.7-70.5-18.9000112.1D228 E235 I236D228-D232 PolarHBondContact O-N 2.94Å; D232-E235 PolarHBondContact O-N 3.26Å; D232-I236 WeakPolarHBondContact O-CB 3.37Å; D232-I236 WeakPolarHBondContact O-CD1 3.42Å; D232-I236 WeakPolarHBondContact O-CG1 3.33Å; D232-I236 PolarHBondContact O-N 2.94Å
233R93.8Very high90.8Very high91 Ų9167.3 Ų67.334%0.34336%0.355SS..Hα-helixtrans-70.1-35.9-179.4-74.3-58.3-165.5-164.62112.7M225 R229 T230 E231 S237 L283M225-R233 HydrophobicContact CE-CG 3.65Å; M225-R233 HydrophobicContact SD-CG 4.12Å; R229-R233 VanDerWaalsContact O-CG 3.28Å; R229-R233 WeakPolarHBondContact O-CG 3.45Å; R229-R233 PolarHBondContact O-N 3.33Å; T230-R233 PolarHBondContact O-N 3.36Å; T230-R233 VanDerWaalsContact O-N 3.17Å; E231-R233 VanDerWaalsContact C-N 3.29Å; E231-R233 PolarHBondContact O-N 2.79Å; R233-S237 VanDerWaalsContact O-CB 3.23Å; R233-S237 WeakPolarHBondContact O-CB 3.15Å; R233-S237 PolarHBondContact O-N 2.87Å; R233-S237 PolarHBondContact O-OG 2.67Å; R233-L283 HydrophobicContact CB-CD2 3.77Å
234L93.5Very high90.9Very high1 Ų163.4 Ų63.41%0.00533%0.334CS..Hα-helixtrans-64.9-50.9173.7-70.4168.2000109.1I221 T230 E231 I236 S237 F238 V251 Y253 V281I221-L234 HydrophobicContact CD1-CD1 4.07Å; I221-L234 HydrophobicContact CD1-CD2 4.45Å; T230-L234 HydrophobicContact CG2-CD1 4.05Å; T230-L234 HydrophobicContact CG2-CG 4.4Å; T230-L234 VanDerWaalsContact O-CG 3.29Å; T230-L234 WeakPolarHBondContact O-CG 3.09Å; T230-L234 PolarHBondContact O-N 3.1Å; E231-L234 WeakPolarHBondContact O-CB 3.32Å; E231-L234 PolarHBondContact O-N 3.46Å; E231-L234 VanDerWaalsContact O-N 3.13Å; L234-I236 VanDerWaalsContact C-N 3.34Å; L234-I236 PolarHBondContact O-N 3.48Å; L234-S237 PolarHBondContact O-N 2.79Å; L234-F238 HydrophobicContact CB-CD2 4.49Å; L234-F238 HydrophobicContact CD2-CD2 4.41Å; L234-F238 HydrophobicContact CD2-CE2 3.9Å; L234-F238 WeakPolarHBondContact O-CB 3.29Å; L234-F238 VanDerWaalsContact O-CD2 3.26Å; L234-F238 WeakPolarHBondContact O-CD2 3.49Å; L234-F238 PolarHBondContact O-N 2.76Å; L234-V251 HydrophobicContact CB-CG1 4.02Å; L234-V251 HydrophobicContact CD1-CG1 4.22Å; L234-Y253 HydrophobicContact CD1-CD2 4.43Å; L234-Y253 HydrophobicContact CD1-CG 4.45Å; L234-V281 HydrophobicContact CD2-CG1 3.84Å; L234-V281 HydrophobicContact CD2-CG2 4.18Å
235E94.9Very high91.3Very high86 Ų8661.7 Ų61.740%0.40232%0.321SS..Hα-helixtrans-53.8-49.8177.7-167.8-178.3171.200111.9E231 D232 S237 F238 S239 V248 V251E231-E235 PolarHBondContact O-N 3.46Å; D232-E235 PolarHBondContact O-N 3.26Å; E235-S237 VanDerWaalsContact C-N 3.3Å; E235-S237 PolarHBondContact O-N 3.14Å; E235-F238 PolarHBondContact O-N 2.64Å; E235-S239 VanDerWaalsContact O-CB 3.24Å; E235-S239 WeakPolarHBondContact O-CB 3.1Å; E235-S239 PolarHBondContact O-N 2.86Å; E235-S239 PolarHBondContact O-OG 2.74Å; E235-V248 HydrophobicContact CG-CB 4Å; E235-V248 HydrophobicContact CG-CG1 3.97Å; E235-V248 HydrophobicContact CG-CG2 4.48Å; E235-V251 HydrophobicContact CB-CG2 3.76Å; E235-V251 HydrophobicContact CG-CG2 4.18Å
236I94Very high91.5Very high76 Ų7661.4 Ų61.439%0.3932%0.322SS..Hα-helixtrans-63.8-34.2177.7-66.8165.2000112.2D232 L234 S239 R240D232-I236 WeakPolarHBondContact O-CB 3.37Å; D232-I236 WeakPolarHBondContact O-CD1 3.42Å; D232-I236 WeakPolarHBondContact O-CG1 3.33Å; D232-I236 PolarHBondContact O-N 2.94Å; L234-I236 VanDerWaalsContact C-N 3.34Å; L234-I236 PolarHBondContact O-N 3.48Å; I236-S239 WeakPolarHBondContact CA-OG 3.28Å; I236-S239 PolarHBondContact O-OG 2.9Å; I236-S239 VanDerWaalsContact O-OG 3.05Å; I236-R240 WeakPolarHBondContact O-CG 3.48Å
237S93.2Very high91.7Very high1 Ų162.7 Ų62.71%0.00732%0.321CS..Hα-helixtrans-76.6-37.2-178.7-66.10000112.3R233 L234 E235 Y279 N282R233-S237 VanDerWaalsContact O-CB 3.23Å; R233-S237 WeakPolarHBondContact O-CB 3.15Å; R233-S237 PolarHBondContact O-N 2.87Å; R233-S237 PolarHBondContact O-OG 2.67Å; L234-S237 PolarHBondContact O-N 2.79Å; E235-S237 VanDerWaalsContact C-N 3.3Å; E235-S237 PolarHBondContact O-N 3.14Å; S237-Y279 PolarHBondContact O-OH 3.11Å; S237-N282 PolarHBondContact OG-N 3.13Å; S237-N282 VanDerWaalsContact OG-N 3.08Å
238F94.6Very high91.9Very high0 Ų059.8 Ų59.80%031%0.308CS..Hα-helixtrans-86.8-16.7-178.5-77.4-88.6000113.3L216 V218 L234 E235 R240 G245 G246 V248 I262 F264 L273 Y279 V281 V289 V291L216-F238 HydrophobicContact CD2-CD1 4.11Å; L216-F238 HydrophobicContact CD2-CE1 3.59Å; L216-F238 HydrophobicContact CD2-CZ 4.43Å; V218-F238 HydrophobicContact CG1-CZ 4.3Å; V218-F238 HydrophobicContact CG2-CE1 4.4Å; V218-F238 HydrophobicContact CG2-CE2 4.28Å; V218-F238 HydrophobicContact CG2-CZ 3.77Å; L234-F238 HydrophobicContact CB-CD2 4.49Å; L234-F238 HydrophobicContact CD2-CD2 4.41Å; L234-F238 HydrophobicContact CD2-CE2 3.9Å; L234-F238 WeakPolarHBondContact O-CB 3.29Å; L234-F238 VanDerWaalsContact O-CD2 3.26Å; L234-F238 WeakPolarHBondContact O-CD2 3.49Å; L234-F238 PolarHBondContact O-N 2.76Å; E235-F238 PolarHBondContact O-N 2.64Å; F238-R240 VanDerWaalsContact C-N 3.28Å; F238-R240 PolarHBondContact O-N 2.76Å; F238-G245 CarbonylContact O-C 3.52Å; F238-G245 WeakPolarHBondContact O-CA 3.32Å; F238-G246 PolarHBondContact O-N 3.2Å; F238-V248 HydrophobicContact CB-CG2 4.14Å; F238-I262 HydrophobicContact CB-CD1 3.94Å; F238-I262 HydrophobicContact CB-CG2 4.16Å; F238-I262 HydrophobicContact CD1-CD1 3.71Å; F238-I262 HydrophobicContact CD2-CD1 3Å; F238-I262 HydrophobicContact CD2-CG1 4.49Å; F238-I262 HydrophobicContact CE1-CD1 3.85Å; F238-I262 HydrophobicContact CE2-CD1 3.17Å; F238-I262 HydrophobicContact CG-CD1 3.27Å; F238-I262 HydrophobicContact CG-CG2 4.46Å; F238-I262 HydrophobicContact CZ-CD1 3.59Å; F238-F264 HydrophobicContact CB-CE1 4.2Å; F238-F264 HydrophobicContact CB-CZ 4.1Å; F238-F264 HydrophobicContact CD1-CZ 4.02Å; F238-F264 HydrophobicContact CG-CZ 4.49Å; F238-L273 HydrophobicContact CD1-CD1 3.92Å; F238-L273 HydrophobicContact CE1-CD1 4.25Å; F238-Y279 AromaticContact CD1-CD1 3.83Å; F238-Y279 HydrophobicContact CD1-CD1 3.83Å; F238-Y279 AromaticContact CD1-CE1 3.6Å; F238-Y279 HydrophobicContact CD1-CE1 3.6Å; F238-Y279 HydrophobicContact CD1-CG 4.42Å; F238-Y279 HydrophobicContact CD2-CD1 4.29Å; F238-Y279 HydrophobicContact CD2-CE1 4.06Å; F238-Y279 AromaticContact CE1-CD1 3.29Å; F238-Y279 HydrophobicContact CE1-CD1 3.29Å; F238-Y279 HydrophobicContact CE1-CD2 4.36Å; F238-Y279 AromaticContact CE1-CE1 3.61Å; F238-Y279 HydrophobicContact CE1-CE1 3.61Å; F238-Y279 AromaticContact CE1-CG 3.7Å; F238-Y279 HydrophobicContact CE1-CG 3.7Å; F238-Y279 AromaticContact CE2-CD1 3.83Å; F238-Y279 HydrophobicContact CE2-CD1 3.83Å; F238-Y279 HydrophobicContact CE2-CE1 4.07Å; F238-Y279 HydrophobicContact CG-CD1 4.34Å; F238-Y279 AromaticContact CG-CE1 3.88Å; F238-Y279 HydrophobicContact CG-CE1 3.88Å; F238-Y279 AromaticContact CZ-CD1 3.32Å; F238-Y279 HydrophobicContact CZ-CD1 3.32Å; F238-Y279 AromaticContact CZ-CE1 3.87Å; F238-Y279 HydrophobicContact CZ-CE1 3.87Å; F238-Y279 AromaticContact CZ-CG 3.98Å; F238-Y279 HydrophobicContact CZ-CG 3.98Å; F238-V281 HydrophobicContact CD2-CG2 4.33Å; F238-V281 HydrophobicContact CE2-CG2 3.52Å; F238-V281 HydrophobicContact CZ-CG2 4.04Å; F238-V289 HydrophobicContact CZ-CG2 4.24Å; F238-V291 HydrophobicContact CE1-CG1 4.07Å; F238-V291 HydrophobicContact CZ-CG1 3.97Å
239S94.2Very high92.1Very high47 Ų4758.4 Ų58.433%0.32930%0.298SS..SBendtrans-73.6-14.2169.854.80000114.6E235 I236 P241 G246E235-S239 VanDerWaalsContact O-CB 3.24Å; E235-S239 WeakPolarHBondContact O-CB 3.1Å; E235-S239 PolarHBondContact O-N 2.86Å; E235-S239 PolarHBondContact O-OG 2.74Å; I236-S239 WeakPolarHBondContact CA-OG 3.28Å; I236-S239 PolarHBondContact O-OG 2.9Å; I236-S239 VanDerWaalsContact O-OG 3.05Å; S239-P241 WeakPolarHBondContact O-CD 3.12Å; S239-G246 VanDerWaalsContact CA-O 3.3Å; S239-G246 WeakPolarHBondContact CA-O 3.41Å
240R91.9Very high92.2Very high103 Ų10355.2 Ų55.239%0.38930%0.295SS..  trans-73.9112.6-175.6-74.6171.7-178.7-118.40112.9I236 F238 T242 R243 G245I236-R240 WeakPolarHBondContact O-CG 3.48Å; F238-R240 VanDerWaalsContact C-N 3.28Å; F238-R240 PolarHBondContact O-N 2.76Å; R240-T242 VanDerWaalsContact C-N 3.26Å; R240-T242 PolarHBondContact O-N 3.43Å; R240-R243 PolarHBondContact O-N 3.13Å; R240-G245 WeakPolarHBondContact O-CA 3.16Å; R240-G245 PolarHBondContact O-N 2.94Å
241P87.7Confident92.3Very high107 Ų10756.4 Ų56.470%0.69530%0.302SS*.G310 helixtrans-66.6-29.3178.3-20.234.6000112.7S239 R243 G244S239-P241 WeakPolarHBondContact O-CD 3.12Å; P241-R243 PolarHBondContact O-N 3.44Å; P241-R243 VanDerWaalsContact O-N 3.15Å; P241-G244 PolarHBondContact O-N 2.86Å
242T86.4Confident92.3Very high128 Ų12859 Ų5979%0.78532%0.318SS*.G310 helixtrans-61.3-23.417961.50000113.5R240R240-T242 VanDerWaalsContact C-N 3.26Å; R240-T242 PolarHBondContact O-N 3.43Å
243R84.8Confident92.3Very high59 Ų5955 Ų5522%0.22330%0.296CS..G310 helixtrans-99.53.5176.8-66.1-176.1176.8-171.8-3.5112.4R240 P241 G245 Y279 K280 N282 E286R240-R243 PolarHBondContact O-N 3.13Å; P241-R243 PolarHBondContact O-N 3.44Å; P241-R243 VanDerWaalsContact O-N 3.15Å; R243-G245 VanDerWaalsContact C-N 3.34Å; R243-Y279 HydrophobicContact CB-CE2 4Å; R243-Y279 VanDerWaalsContact CB-OH 3.27Å; R243-Y279 WeakPolarHBondContact CB-OH 3.44Å; R243-Y279 WeakPolarHBondContact O-CE2 3.41Å; R243-K280 PolarHBondContact NH1-O 2.81Å; R243-N282 VanDerWaalsContact NH1-CG 3.33Å; R243-N282 PolarHBondContact NH1-ND2 2.8Å; R243-N282 PolarHBondContact NH1-OD1 2.87Å; R243-N282 PolarHBondContact NH2-ND2 2.78Å; R243-N282 PolarHBondContact NH2-OD1 2.94Å; R243-E286 IonicContact CZ-OE1 3.67Å; R243-E286 IonicContact NH1-OE1 3.93Å; R243-E286 IonicContact NH2-OE1 3.91Å; R243-E286 PolarHBondContact NH2-OE1 2.65Å
244G86.4Confident92.3Very high25 Ų2553.7 Ų53.726%0.25830%0.296SS..THydrogen-bonded Turntrans83.510.8-173.900000113.9P241P241-G244 PolarHBondContact O-N 2.86Å
245G89.9Confident92.1Very high9 Ų956.6 Ų56.69%0.09331%0.313CS..  trans-71.1-175.6169.900000112.9F238 R240 R243F238-G245 CarbonylContact O-C 3.52Å; F238-G245 WeakPolarHBondContact O-CA 3.32Å; R240-G245 WeakPolarHBondContact O-CA 3.16Å; R240-G245 PolarHBondContact O-N 2.94Å; R243-G245 VanDerWaalsContact C-N 3.34Å
246G92.6Very high91.8Very high11 Ų1161.9 Ų61.911%0.11334%0.335CS..  trans-166.7175-178.400000111.2F238 S239 V248 F264F238-G246 PolarHBondContact O-N 3.2Å; S239-G246 VanDerWaalsContact CA-O 3.3Å; S239-G246 WeakPolarHBondContact CA-O 3.41Å; G246-V248 WeakPolarHBondContact O-CG2 3.4Å; G246-V248 PolarHBondContact O-N 3.49Å; G246-V248 VanDerWaalsContact O-N 3.16Å; G246-F264 WeakPolarHBondContact O-CD1 3.46Å
247E93.9Very high91.7Very high118 Ų11862.3 Ų62.355%0.55134%0.341SS*.  trans-53.9120.3-177.9-169.1167.5-166.600111.8F264 L265E247-F264 WeakPolarHBondContact O-CA 3.38Å; E247-L265 HydrophobicContact CB-CB 4.28Å; E247-L265 VanDerWaalsContact CD-CD2 3.49Å; E247-L265 HydrophobicContact CG-CB 4.19Å; E247-L265 HydrophobicContact CG-CD2 4.1Å; E247-L265 PolarHBondContact O-N 3.07Å; E247-L265 WeakPolarHBondContact OE2-CD2 3.07Å
248V95.4Very high91.6Very high19 Ų1962.8 Ų62.812%0.11535%0.347CS..EExtended strand (participates in β ladder)trans-91.4131.4-177.4-179.60000107.8E235 F238 G246 V251 I262 F264E235-V248 HydrophobicContact CG-CB 4Å; E235-V248 HydrophobicContact CG-CG1 3.97Å; E235-V248 HydrophobicContact CG-CG2 4.48Å; F238-V248 HydrophobicContact CB-CG2 4.14Å; G246-V248 WeakPolarHBondContact O-CG2 3.4Å; G246-V248 PolarHBondContact O-N 3.49Å; G246-V248 VanDerWaalsContact O-N 3.16Å; V248-V251 HydrophobicContact CG1-CG2 3.69Å; V248-I262 HydrophobicContact CG1-CG2 3.92Å; V248-I262 HydrophobicContact CG2-CG2 4.14Å; V248-F264 HydrophobicContact CG2-CD1 4.14Å; V248-F264 HydrophobicContact CG2-CE1 3.91Å
249E94.2Very high91.6Very high89 Ų8965.6 Ų65.642%0.41636%0.364SS..EExtended strand (participates in β ladder)trans-89.4-43.6175.9-175.8-172.3161.800110.6K263E249-K263 HydrophobicContact CB-CB 4.42Å; E249-K263 HydrophobicContact CB-CG 4.41Å; E249-K263 VanDerWaalsContact CD-NZ 3.33Å; E249-K263 HydrophobicContact CG-CD 4.46Å; E249-K263 PolarHBondContact N-O 2.94Å; E249-K263 IonicContact OE1-NZ 3.36Å; E249-K263 PolarHBondContact OE1-NZ 3.32Å; E249-K263 VanDerWaalsContact OE2-CD 3.25Å; E249-K263 WeakPolarHBondContact OE2-CD 3.48Å; E249-K263 WeakPolarHBondContact OE2-CE 3.26Å; E249-K263 IonicContact OE2-NZ 3.8Å; E249-K263 PolarHBondContact OE2-NZ 2.71Å
250S94.1Very high91.6Very high59 Ų5963.6 Ų63.641%0.41335%0.35SS..EExtended strand (participates in β ladder)trans-157.1155.9176.663.60000112.3K263S250-K263 PolarHBondContact N-O 2.82Å; S250-K263 PolarHBondContact O-N 3.2Å; S250-K263 WeakPolarHBondContact OG-CB 3.42Å
251V95.5Very high91.7Very high25 Ų2559.3 Ų59.315%0.15234%0.337CS..EExtended strand (participates in β ladder)trans-126.9134.6172.2-178.70000108.3E231 L234 E235 V248 S261 I262E231-V251 HydrophobicContact CB-CG1 4.25Å; E231-V251 HydrophobicContact CG-CG1 4.31Å; L234-V251 HydrophobicContact CB-CG1 4.02Å; L234-V251 HydrophobicContact CD1-CG1 4.22Å; E235-V251 HydrophobicContact CB-CG2 3.76Å; E235-V251 HydrophobicContact CG-CG2 4.18Å; V248-V251 HydrophobicContact CG1-CG2 3.69Å; V251-S261 WeakPolarHBondContact CA-O 3.34Å; V251-I262 HydrophobicContact CG2-CG1 4.5Å; V251-I262 HydrophobicContact CG2-CG2 4.5Å
252D94.2Very high92.1Very high98 Ų9854.3 Ų54.352%0.52430%0.304SS..EExtended strand (participates in β ladder)trans-126.6129.6172.4178.521.8000108.3G260 S261D252-G260 CarbonylContact O-C 3.54Å; D252-G260 WeakPolarHBondContact O-CA 3.47Å; D252-S261 PolarHBondContact N-O 3.46Å; D252-S261 PolarHBondContact O-N 2.8Å
253Y94.1Very high92.5Very high2 Ų251 Ų511%0.00828%0.279CS..EExtended strand (participates in β ladder)trans-133.6124.9-177174.3-120.8000111.8I221 Q227 T230 E231 L234 V255 T259I221-Y253 HydrophobicContact CB-CE2 3.86Å; I221-Y253 HydrophobicContact CD1-CD2 3.68Å; I221-Y253 HydrophobicContact CD1-CE2 3.65Å; I221-Y253 HydrophobicContact CG1-CE2 4.37Å; I221-Y253 HydrophobicContact CG2-CE2 3.81Å; Q227-Y253 HydrophobicContact CG-CD1 4.08Å; Q227-Y253 PolarHBondContact NE2-O 2.8Å; Q227-Y253 VanDerWaalsContact NE2-O 3.07Å; T230-Y253 HydrophobicContact CG2-CD1 3.8Å; T230-Y253 HydrophobicContact CG2-CE1 3.64Å; T230-Y253 HydrophobicContact CG2-CG 4.31Å; E231-Y253 PolarHBondContact OE1-N 2.92Å; L234-Y253 HydrophobicContact CD1-CD2 4.43Å; L234-Y253 HydrophobicContact CD1-CG 4.45Å; Y253-V255 HydrophobicContact CD1-CG2 4.1Å; Y253-V255 HydrophobicContact CE1-CB 4.34Å; Y253-V255 HydrophobicContact CE1-CG2 3.68Å; Y253-T259 VanDerWaalsContact CD2-O 3.25Å; Y253-T259 WeakPolarHBondContact CD2-O 3.23Å
254D93.1Very high93Very high64 Ų6448.2 Ų48.234%0.34227%0.268SS..EExtended strand (participates in β ladder)trans-99.8109172.3176.916.3000111K256 T257 G258 T259D254-K256 PolarHBondContact O-N 2.98Å; D254-K256 WeakPolarHBondContact OD1-CB 3.47Å; D254-K256 PolarHBondContact OD1-N 3.03Å; D254-T257 WeakPolarHBondContact CB-OG1 3.19Å; D254-T257 VanDerWaalsContact CG-OG1 3.26Å; D254-T257 PolarHBondContact O-N 3.48Å; D254-T257 WeakPolarHBondContact OD2-CB 3.14Å; D254-T257 WeakPolarHBondContact OD2-CG2 3.37Å; D254-T257 PolarHBondContact OD2-OG1 2.59Å; D254-G258 WeakPolarHBondContact O-CA 3.38Å; D254-G258 PolarHBondContact O-N 3.32Å; D254-T259 PolarHBondContact N-O 3.19Å; D254-T259 PolarHBondContact O-N 3.37Å
255V89.1Confident93.2Very high62 Ų6251 Ų5138%0.37628%0.277SS..THydrogen-bonded Turntrans-59.4-33177.1-176.50000112.3Q227 Y253Q227-V255 HydrophobicContact CB-CG2 3.6Å; Q227-V255 HydrophobicContact CG-CG2 3.83Å; Y253-V255 HydrophobicContact CD1-CG2 4.1Å; Y253-V255 HydrophobicContact CE1-CB 4.34Å; Y253-V255 HydrophobicContact CE1-CG2 3.68Å
256K89.6Confident93.2Very high198 Ų19857.2 Ų57.286%0.86130%0.301SS*.THydrogen-bonded Turntrans-72.3-38.6-174.3-64.5177-177.6171.10111.9D254D254-K256 PolarHBondContact O-N 2.98Å; D254-K256 WeakPolarHBondContact OD1-CB 3.47Å; D254-K256 PolarHBondContact OD1-N 3.03Å
257T90.5Very high92.9Very high84 Ų8460.3 Ų60.352%0.51532%0.319SS..THydrogen-bonded Turntrans-94.3-16.3-179.857.10000112.6D254 T259D254-T257 WeakPolarHBondContact CB-OG1 3.19Å; D254-T257 VanDerWaalsContact CG-OG1 3.26Å; D254-T257 PolarHBondContact O-N 3.48Å; D254-T257 WeakPolarHBondContact OD2-CB 3.14Å; D254-T257 WeakPolarHBondContact OD2-CG2 3.37Å; D254-T257 PolarHBondContact OD2-OG1 2.59Å; T257-T259 PolarHBondContact O-N 2.99Å; T257-T259 PolarHBondContact OG1-OG1 2.84Å
258G91.6Very high92.5Very high12 Ų1255.8 Ų55.812%0.12430%0.304CS..THydrogen-bonded Turntrans65.231-173.700000111.7N220 I221 D254N220-G258 PolarHBondContact N-O 2.68Å; I221-G258 PolarHBondContact N-O 3.42Å; I221-G258 VanDerWaalsContact N-O 3.13Å; D254-G258 WeakPolarHBondContact O-CA 3.38Å; D254-G258 PolarHBondContact O-N 3.32Å
259T94.3Very high92.4Very high58 Ų5855.2 Ų55.236%0.35630%0.301SS..EExtended strand (participates in β ladder)trans-121.5152.7-179.768.50000110.6V218 Y253 D254 T257V218-T259 CarbonylContact O-C 3.54Å; V218-T259 VanDerWaalsContact O-CA 3.27Å; V218-T259 WeakPolarHBondContact O-CA 3.2Å; Y253-T259 VanDerWaalsContact CD2-O 3.25Å; Y253-T259 WeakPolarHBondContact CD2-O 3.23Å; D254-T259 PolarHBondContact N-O 3.19Å; D254-T259 PolarHBondContact O-N 3.37Å; T257-T259 PolarHBondContact O-N 2.99Å; T257-T259 PolarHBondContact OG1-OG1 2.84Å
260G93.5Very high92.2Very high5 Ų551.1 Ų51.15%0.05228%0.282CS..EExtended strand (participates in β ladder)trans-148.6167.217700000112.6V218 D252V218-G260 PolarHBondContact N-O 2.88Å; V218-G260 PolarHBondContact O-N 3.41Å; D252-G260 CarbonylContact O-C 3.54Å; D252-G260 WeakPolarHBondContact O-CA 3.47Å
261S95.3Very high92Very high14 Ų1455.7 Ų55.710%0.09829%0.29CS..EExtended strand (participates in β ladder)trans-121.6136175.6-3.40000109.7E215 L216 K217 V251 D252E215-S261 WeakPolarHBondContact OE1-CB 3.43Å; L216-S261 WeakPolarHBondContact O-CA 3.3Å; K217-S261 PolarHBondContact NZ-OG 3.36Å; V251-S261 WeakPolarHBondContact CA-O 3.34Å; D252-S261 PolarHBondContact N-O 3.46Å; D252-S261 PolarHBondContact O-N 2.8Å
262I96.2Very high91.8Very high1 Ų161.1 Ų61.11%0.00531%0.308CS..EExtended strand (participates in β ladder)trans-123.6113.8177.3-55.8-177.5000107.5E215 L216 V218 F238 V248 V251 F264E215-I262 CarbonylContact C-O 3.52Å; E215-I262 WeakPolarHBondContact CA-O 3.41Å; L216-I262 HydrophobicContact CB-CB 4.5Å; L216-I262 PolarHBondContact N-O 2.97Å; L216-I262 PolarHBondContact O-N 2.85Å; V218-I262 HydrophobicContact CG2-CD1 3.65Å; V218-I262 HydrophobicContact CG2-CG1 3.97Å; F238-I262 HydrophobicContact CB-CD1 3.94Å; F238-I262 HydrophobicContact CB-CG2 4.16Å; F238-I262 HydrophobicContact CD1-CD1 3.71Å; F238-I262 HydrophobicContact CD2-CD1 3Å; F238-I262 HydrophobicContact CD2-CG1 4.49Å; F238-I262 HydrophobicContact CE1-CD1 3.85Å; F238-I262 HydrophobicContact CE2-CD1 3.17Å; F238-I262 HydrophobicContact CG-CD1 3.27Å; F238-I262 HydrophobicContact CG-CG2 4.46Å; F238-I262 HydrophobicContact CZ-CD1 3.59Å; V248-I262 HydrophobicContact CG1-CG2 3.92Å; V248-I262 HydrophobicContact CG2-CG2 4.14Å; V251-I262 HydrophobicContact CG2-CG1 4.5Å; V251-I262 HydrophobicContact CG2-CG2 4.5Å; I262-F264 HydrophobicContact CB-CE2 4.35Å; I262-F264 HydrophobicContact CG2-CD2 4.39Å; I262-F264 HydrophobicContact CG2-CE1 4.14Å; I262-F264 HydrophobicContact CG2-CE2 3.82Å; I262-F264 HydrophobicContact CG2-CZ 3.68Å
263K95.2Very high91.7Very high60 Ų6056.5 Ų56.526%0.26128%0.283SS..EExtended strand (participates in β ladder)trans-95126.4175.8-163.8-178.3178.4-157.70108.8K214 E249 S250K214-K263 HydrophobicContact CB-CG 4.4Å; E249-K263 HydrophobicContact CB-CB 4.42Å; E249-K263 HydrophobicContact CB-CG 4.41Å; E249-K263 VanDerWaalsContact CD-NZ 3.33Å; E249-K263 HydrophobicContact CG-CD 4.46Å; E249-K263 PolarHBondContact N-O 2.94Å; E249-K263 IonicContact OE1-NZ 3.36Å; E249-K263 PolarHBondContact OE1-NZ 3.32Å; E249-K263 VanDerWaalsContact OE2-CD 3.25Å; E249-K263 WeakPolarHBondContact OE2-CD 3.48Å; E249-K263 WeakPolarHBondContact OE2-CE 3.26Å; E249-K263 IonicContact OE2-NZ 3.8Å; E249-K263 PolarHBondContact OE2-NZ 2.71Å; S250-K263 PolarHBondContact N-O 2.82Å; S250-K263 PolarHBondContact O-N 3.2Å; S250-K263 WeakPolarHBondContact OG-CB 3.42Å
264F94.7Very high91.6Very high0 Ų057 Ų570%029%0.288CS..EExtended strand (participates in β ladder)trans-100.1144.2177.2-65.8-83.2000110.8K214 L216 F238 G246 E247 V248 I262 K266 V269 A270 L273K214-F264 WeakPolarHBondContact CB-O 3.31Å; K214-F264 WeakPolarHBondContact CG-O 3.29Å; K214-F264 WeakPolarHBondContact O-CD2 3.19Å; K214-F264 PolarHBondContact O-N 2.84Å; L216-F264 HydrophobicContact CB-CE2 3.93Å; L216-F264 HydrophobicContact CD2-CE2 4.18Å; F238-F264 HydrophobicContact CB-CE1 4.2Å; F238-F264 HydrophobicContact CB-CZ 4.1Å; F238-F264 HydrophobicContact CD1-CZ 4.02Å; F238-F264 HydrophobicContact CG-CZ 4.49Å; G246-F264 WeakPolarHBondContact O-CD1 3.46Å; E247-F264 WeakPolarHBondContact O-CA 3.38Å; V248-F264 HydrophobicContact CG2-CD1 4.14Å; V248-F264 HydrophobicContact CG2-CE1 3.91Å; I262-F264 HydrophobicContact CB-CE2 4.35Å; I262-F264 HydrophobicContact CG2-CD2 4.39Å; I262-F264 HydrophobicContact CG2-CE1 4.14Å; I262-F264 HydrophobicContact CG2-CE2 3.82Å; I262-F264 HydrophobicContact CG2-CZ 3.68Å; F264-K266 VanDerWaalsContact C-N 3.32Å; F264-K266 PolarHBondContact O-N 3.2Å; F264-V269 HydrophobicContact CB-CB 4.26Å; F264-V269 HydrophobicContact CD1-CB 4.11Å; F264-V269 HydrophobicContact CD1-CG1 3.7Å; F264-V269 HydrophobicContact CD2-CB 4.27Å; F264-V269 HydrophobicContact CD2-CG1 4.22Å; F264-V269 HydrophobicContact CE1-CG1 3.69Å; F264-V269 HydrophobicContact CE2-CG1 4.22Å; F264-V269 HydrophobicContact CG-CB 3.95Å; F264-V269 HydrophobicContact CG-CG1 3.96Å; F264-V269 HydrophobicContact CZ-CG1 3.96Å; F264-A270 HydrophobicContact CD2-CB 3.99Å; F264-A270 HydrophobicContact CE2-CB 4.35Å; F264-L273 HydrophobicContact CE2-CD1 4.15Å; F264-L273 HydrophobicContact CZ-CD1 3.68Å
265L91.1Very high91.5Very high83 Ų8363.9 Ų63.944%0.43531%0.309SS..SBendtrans-63.6-39.9177.2-170.269.4000111.6E247E247-L265 HydrophobicContact CB-CB 4.28Å; E247-L265 VanDerWaalsContact CD-CD2 3.49Å; E247-L265 HydrophobicContact CG-CB 4.19Å; E247-L265 HydrophobicContact CG-CD2 4.1Å; E247-L265 PolarHBondContact O-N 3.07Å; E247-L265 WeakPolarHBondContact OE2-CD2 3.07Å
266K88.5Confident91.5Very high139 Ų13967.1 Ų67.160%0.60432%0.318SS*.SBendtrans-98.4128.7-179.3-68.2-175-178.5177.50111.9F264F264-K266 VanDerWaalsContact C-N 3.32Å; F264-K266 PolarHBondContact O-N 3.2Å
267P87.8Confident91.6Very high77 Ų7759.1 Ų59.150%0.529%0.291SS..THydrogen-bonded Turntrans-63.2149.4174.927.2-33.5000111.2R213 K214R213-P267 HydrophobicContact CB-CB 4.08Å; K214-P267 HydrophobicContact CG-CB 4.21Å
268G85.4Confident91.8Very high22 Ų2258.8 Ų58.823%0.22729%0.289CS..THydrogen-bonded Turntrans92.3-15.917500000115.5R213 R272R213-G268 PolarHBondContact O-N 2.76Å; G268-R272 WeakPolarHBondContact O-CG 3.39Å; G268-R272 PolarHBondContact O-N 2.82Å
269V91.8Very high91.9Very high8 Ų858.7 Ų58.75%0.04829%0.285CS..Hα-helixtrans-63.3-51.1168.4-178.10000109.5F264 W271 R272 L273F264-V269 HydrophobicContact CB-CB 4.26Å; F264-V269 HydrophobicContact CD1-CB 4.11Å; F264-V269 HydrophobicContact CD1-CG1 3.7Å; F264-V269 HydrophobicContact CD2-CB 4.27Å; F264-V269 HydrophobicContact CD2-CG1 4.22Å; F264-V269 HydrophobicContact CE1-CG1 3.69Å; F264-V269 HydrophobicContact CE2-CG1 4.22Å; F264-V269 HydrophobicContact CG-CB 3.95Å; F264-V269 HydrophobicContact CG-CG1 3.96Å; F264-V269 HydrophobicContact CZ-CG1 3.96Å; V269-W271 PolarHBondContact O-N 2.77Å; V269-R272 PolarHBondContact O-N 3.49Å; V269-L273 HydrophobicContact CG1-CD1 4.1Å; V269-L273 WeakPolarHBondContact O-CG 3.49Å; V269-L273 PolarHBondContact O-N 3.38Å; V269-L273 VanDerWaalsContact O-N 3.1Å
270A91.8Very high91.8Very high2 Ų260.7 Ų60.72%0.01729%0.289CS..Hα-helixtrans-53.1-51.7177.400000112L216 F264 R272 L273 A274L216-A270 HydrophobicContact CB-CB 4.11Å; L216-A270 WeakPolarHBondContact CD1-O 3.34Å; F264-A270 HydrophobicContact CD2-CB 3.99Å; F264-A270 HydrophobicContact CE2-CB 4.35Å; A270-R272 PolarHBondContact O-N 2.64Å; A270-L273 PolarHBondContact O-N 3.14Å; A270-L273 VanDerWaalsContact O-N 3.17Å; A270-A274 WeakPolarHBondContact O-CB 3.4Å; A270-A274 PolarHBondContact O-N 2.89Å
271W89Confident91.7Very high155 Ų15560.5 Ų60.559%0.58729%0.287SS*.Hα-helixtrans-57-45.4178.8174.2-111.6000113.4V269 L273 A274 R275V269-W271 PolarHBondContact O-N 2.77Å; W271-L273 VanDerWaalsContact C-N 3.3Å; W271-L273 PolarHBondContact O-N 2.97Å; W271-A274 PolarHBondContact O-N 2.96Å; W271-R275 WeakPolarHBondContact O-CB 3.36Å; W271-R275 PolarHBondContact O-N 2.9Å
272R90.3Very high91.4Very high140 Ų14062 Ų6253%0.52829%0.294SS..Hα-helixtrans-63.6-36.9178.9-73.7-171.4-58-98.62.6112.3G268 V269 A270G268-R272 WeakPolarHBondContact O-CG 3.39Å; G268-R272 PolarHBondContact O-N 2.82Å; V269-R272 PolarHBondContact O-N 3.49Å; A270-R272 PolarHBondContact O-N 2.64Å
273L93Very high91Very high1 Ų162.5 Ų62.51%0.00530%0.296CS..Hα-helixtrans-73-45.7177.3-67.1179.3000111.2L216 F238 F264 V269 A270 W271 R275 K276 G277 Y279 V291L216-L273 HydrophobicContact CD1-CB 4.11Å; L216-L273 HydrophobicContact CD2-CB 3.94Å; L216-L273 HydrophobicContact CD2-CD1 3.95Å; F238-L273 HydrophobicContact CD1-CD1 3.92Å; F238-L273 HydrophobicContact CE1-CD1 4.25Å; F264-L273 HydrophobicContact CE2-CD1 4.15Å; F264-L273 HydrophobicContact CZ-CD1 3.68Å; V269-L273 HydrophobicContact CG1-CD1 4.1Å; V269-L273 WeakPolarHBondContact O-CG 3.49Å; V269-L273 PolarHBondContact O-N 3.38Å; V269-L273 VanDerWaalsContact O-N 3.1Å; A270-L273 PolarHBondContact O-N 3.14Å; A270-L273 VanDerWaalsContact O-N 3.17Å; W271-L273 VanDerWaalsContact C-N 3.3Å; W271-L273 PolarHBondContact O-N 2.97Å; L273-R275 VanDerWaalsContact C-N 3.28Å; L273-R275 PolarHBondContact O-N 3.05Å; L273-K276 WeakPolarHBondContact O-CB 3.36Å; L273-K276 PolarHBondContact O-N 2.86Å; L273-G277 PolarHBondContact O-N 3.35Å; L273-Y279 HydrophobicContact CD1-CE2 4.49Å; L273-Y279 HydrophobicContact CD2-CD2 3.71Å; L273-Y279 HydrophobicContact CD2-CE2 3.6Å; L273-V291 VanDerWaalsContact O-CG2 3.28Å; L273-V291 WeakPolarHBondContact O-CG2 3.33Å
274A92.5Very high90.4Very high12 Ų1266 Ų6610%0.09931%0.313CS..Hα-helixtrans-54.2-43.6176.100000112.2L216 A270 W271 K276 G277 P293L216-A274 HydrophobicContact CD1-CB 3.82Å; A270-A274 WeakPolarHBondContact O-CB 3.4Å; A270-A274 PolarHBondContact O-N 2.89Å; W271-A274 PolarHBondContact O-N 2.96Å; A274-K276 PolarHBondContact O-N 3.42Å; A274-G277 PolarHBondContact O-N 2.77Å; A274-P293 HydrophobicContact CB-CB 4.32Å
275R89.9Confident89.9Confident208 Ų20869.5 Ų69.579%0.78534%0.338SS*.THydrogen-bonded Turntrans-62.8-24178.1-174174.7159.8-157.4-4.8113.8W271 L273W271-R275 WeakPolarHBondContact O-CB 3.36Å; W271-R275 PolarHBondContact O-N 2.9Å; L273-R275 VanDerWaalsContact C-N 3.28Å; L273-R275 PolarHBondContact O-N 3.05Å
276K90.5Very high89.8Confident130 Ų13070.1 Ų70.157%0.56534%0.339SS*.THydrogen-bonded Turntrans-77.8-23.8173.8-65.6178.8-178.6179.70112.5L273 A274 V278L273-K276 WeakPolarHBondContact O-CB 3.36Å; L273-K276 PolarHBondContact O-N 2.86Å; A274-K276 PolarHBondContact O-N 3.42Å; K276-V278 PolarHBondContact O-N 3.09Å
277G91.7Very high89.9Confident30 Ų3065 Ų6531%0.30932%0.319SS..  trans71.7-25.317900000115.9L273 A274 K290 V291L273-G277 PolarHBondContact O-N 3.35Å; A274-G277 PolarHBondContact O-N 2.77Å; G277-K290 WeakPolarHBondContact O-CA 3.34Å; G277-V291 CarbonylContact C-O 3.56Å; G277-V291 WeakPolarHBondContact CA-O 3.36Å; G277-V291 PolarHBondContact O-N 2.76Å
278V93.4Very high90.2Very high78 Ų7865.9 Ų65.947%0.47332%0.32SS..EExtended strand (participates in β ladder)trans-132.5139.3179.9-176.90000110.2K276 N288 V289K276-V278 PolarHBondContact O-N 3.09Å; V278-N288 HydrophobicContact CG1-CB 3.83Å; V278-V289 WeakPolarHBondContact CA-O 3.44Å
279Y93.6Very high90.6Very high10 Ų1064.9 Ų64.94%0.03931%0.309CS..EExtended strand (participates in β ladder)trans-134.1146.5177.7-167.1-103.1000111.8S237 F238 R243 L273 V281 N288 V289S237-Y279 PolarHBondContact O-OH 3.11Å; F238-Y279 AromaticContact CD1-CD1 3.83Å; F238-Y279 HydrophobicContact CD1-CD1 3.83Å; F238-Y279 AromaticContact CD1-CE1 3.6Å; F238-Y279 HydrophobicContact CD1-CE1 3.6Å; F238-Y279 HydrophobicContact CD1-CG 4.42Å; F238-Y279 HydrophobicContact CD2-CD1 4.29Å; F238-Y279 HydrophobicContact CD2-CE1 4.06Å; F238-Y279 AromaticContact CE1-CD1 3.29Å; F238-Y279 HydrophobicContact CE1-CD1 3.29Å; F238-Y279 HydrophobicContact CE1-CD2 4.36Å; F238-Y279 AromaticContact CE1-CE1 3.61Å; F238-Y279 HydrophobicContact CE1-CE1 3.61Å; F238-Y279 AromaticContact CE1-CG 3.7Å; F238-Y279 HydrophobicContact CE1-CG 3.7Å; F238-Y279 AromaticContact CE2-CD1 3.83Å; F238-Y279 HydrophobicContact CE2-CD1 3.83Å; F238-Y279 HydrophobicContact CE2-CE1 4.07Å; F238-Y279 HydrophobicContact CG-CD1 4.34Å; F238-Y279 AromaticContact CG-CE1 3.88Å; F238-Y279 HydrophobicContact CG-CE1 3.88Å; F238-Y279 AromaticContact CZ-CD1 3.32Å; F238-Y279 HydrophobicContact CZ-CD1 3.32Å; F238-Y279 AromaticContact CZ-CE1 3.87Å; F238-Y279 HydrophobicContact CZ-CE1 3.87Å; F238-Y279 AromaticContact CZ-CG 3.98Å; F238-Y279 HydrophobicContact CZ-CG 3.98Å; R243-Y279 HydrophobicContact CB-CE2 4Å; R243-Y279 VanDerWaalsContact CB-OH 3.27Å; R243-Y279 WeakPolarHBondContact CB-OH 3.44Å; R243-Y279 WeakPolarHBondContact O-CE2 3.41Å; L273-Y279 HydrophobicContact CD1-CE2 4.49Å; L273-Y279 HydrophobicContact CD2-CD2 3.71Å; L273-Y279 HydrophobicContact CD2-CE2 3.6Å; Y279-V281 HydrophobicContact CD1-CG2 3.84Å; Y279-V281 HydrophobicContact CE1-CG2 4.37Å; Y279-N288 WeakPolarHBondContact O-CA 3.24Å; Y279-V289 PolarHBondContact N-O 2.98Å; Y279-V289 WeakPolarHBondContact O-CG2 3.19Å; Y279-V289 PolarHBondContact O-N 2.75Å
280K92.3Very high90.8Very high100 Ų10070.6 Ų70.644%0.43533%0.334SS..EExtended strand (participates in β ladder)trans-95.8114179.9-78.1-179.7165.6-1460111.2R243 E286 N288R243-K280 PolarHBondContact NH1-O 2.81Å; K280-E286 HydrophobicContact CB-CG 4.39Å; K280-E286 IonicContact NZ-OE2 3.44Å; K280-E286 PolarHBondContact NZ-OE2 2.64Å; K280-N288 WeakPolarHBondContact CG-OD1 3.19Å
281V92.1Very high91Very high0 Ų071 Ų710%034%0.335CS..EExtended strand (participates in β ladder)trans-109.2138.8179.8179.20000109.6L234 F238 Y279 L283 E286 V287 V289L234-V281 HydrophobicContact CD2-CG1 3.84Å; L234-V281 HydrophobicContact CD2-CG2 4.18Å; F238-V281 HydrophobicContact CD2-CG2 4.33Å; F238-V281 HydrophobicContact CE2-CG2 3.52Å; F238-V281 HydrophobicContact CZ-CG2 4.04Å; Y279-V281 HydrophobicContact CD1-CG2 3.84Å; Y279-V281 HydrophobicContact CE1-CG2 4.37Å; V281-L283 HydrophobicContact CG1-CD2 3.66Å; V281-L283 HydrophobicContact CG1-CG 3.89Å; V281-E286 WeakPolarHBondContact O-CA 3.42Å; V281-V287 HydrophobicContact CB-CG2 4.46Å; V281-V287 PolarHBondContact N-O 3.35Å; V281-V287 PolarHBondContact O-N 3.08Å; V281-V289 HydrophobicContact CB-CG1 4.34Å; V281-V289 HydrophobicContact CG2-CB 4.44Å; V281-V289 HydrophobicContact CG2-CG1 4.04Å; V281-V289 HydrophobicContact CG2-CG2 3.52Å
282N89.3Confident91.3Very high46 Ų4664.5 Ų64.525%0.24632%0.317CS..EExtended strand (participates in β ladder)trans-95.995.8173.4-66.5-10.3000108.9S237 R243 E286S237-N282 PolarHBondContact OG-N 3.13Å; S237-N282 VanDerWaalsContact OG-N 3.08Å; R243-N282 VanDerWaalsContact NH1-CG 3.33Å; R243-N282 PolarHBondContact NH1-ND2 2.8Å; R243-N282 PolarHBondContact NH1-OD1 2.87Å; R243-N282 PolarHBondContact NH2-ND2 2.78Å; R243-N282 PolarHBondContact NH2-OD1 2.94Å; N282-E286 PolarHBondContact OD1-OE1 3.19Å
283L87.2Confident91.4Very high11 Ų1160.1 Ų60.16%0.05831%0.306CS..SBendtrans-89.7-124.5171.2-61.1-178.7000108.9I221 M225 T230 R233 V281 S285 V287I221-L283 HydrophobicContact CG2-CD1 4.21Å; M225-L283 HydrophobicContact SD-CB 4.11Å; M225-L283 HydrophobicContact SD-CD2 4.16Å; T230-L283 HydrophobicContact CG2-CD2 4.3Å; R233-L283 HydrophobicContact CB-CD2 3.77Å; V281-L283 HydrophobicContact CG1-CD2 3.66Å; V281-L283 HydrophobicContact CG1-CG 3.89Å; L283-S285 VanDerWaalsContact C-N 3.26Å; L283-S285 PolarHBondContact N-O 2.8Å; L283-V287 HydrophobicContact CD1-CG2 3.75Å; L283-V287 HydrophobicContact CG-CG2 3.97Å
284E82.9Confident91.4Very high133 Ų13360.2 Ų60.262%0.62131%0.308SS*.SBendtrans-67.8-31.3164-65.2-167.7148.900112A224A224-E284 HydrophobicContact CB-CG 4.37Å
285S84.2Confident91.3Very high75 Ų7565.6 Ų65.652%0.52433%0.326SS..SBendtrans-137166.917257.70000110L283 V287L283-S285 VanDerWaalsContact C-N 3.26Å; L283-S285 PolarHBondContact N-O 2.8Å; S285-V287 PolarHBondContact O-N 3.39Å
286E88.3Confident91.4Very high96 Ų9662.7 Ų62.745%0.44932%0.322SS..EExtended strand (participates in β ladder)trans-72.1117.3175.1-173.7171.6-94.200109.5R243 K280 V281 N282R243-E286 IonicContact CZ-OE1 3.67Å; R243-E286 IonicContact NH1-OE1 3.93Å; R243-E286 IonicContact NH2-OE1 3.91Å; R243-E286 PolarHBondContact NH2-OE1 2.65Å; K280-E286 HydrophobicContact CB-CG 4.39Å; K280-E286 IonicContact NZ-OE2 3.44Å; K280-E286 PolarHBondContact NZ-OE2 2.64Å; V281-E286 WeakPolarHBondContact O-CA 3.42Å; N282-E286 PolarHBondContact OD1-OE1 3.19Å
287V91.8Very high91.3Very high30 Ų3063.4 Ų63.418%0.18232%0.322CS..EExtended strand (participates in β ladder)trans-125.5148.6-177.8-64.30000111.1P222 V281 L283 S285 V289P222-V287 HydrophobicContact CG-CG1 4.4Å; P222-V287 HydrophobicContact CG-CG2 4.43Å; V281-V287 HydrophobicContact CB-CG2 4.46Å; V281-V287 PolarHBondContact N-O 3.35Å; V281-V287 PolarHBondContact O-N 3.08Å; L283-V287 HydrophobicContact CD1-CG2 3.75Å; L283-V287 HydrophobicContact CG-CG2 3.97Å; S285-V287 PolarHBondContact O-N 3.39Å; V287-V289 HydrophobicContact CG2-CG1 4.4Å
288N93.1Very high91.3Very high96 Ų9667.9 Ų67.951%0.51333%0.334SS..EExtended strand (participates in β ladder)trans-89.9118.9173.5-70.5-38.4000109.5V278 Y279 K280V278-N288 HydrophobicContact CG1-CB 3.83Å; Y279-N288 WeakPolarHBondContact O-CA 3.24Å; K280-N288 WeakPolarHBondContact CG-OD1 3.19Å
289V93.9Very high91.1Very high2 Ų269.5 Ų69.51%0.01234%0.34CS..EExtended strand (participates in β ladder)trans-104.4152.5172.2-57.90000109.8V218 I221 F238 V278 Y279 V281 V287 V291V218-V289 HydrophobicContact CG1-CB 3.77Å; V218-V289 HydrophobicContact CG1-CG1 4.45Å; V218-V289 HydrophobicContact CG1-CG2 3.51Å; I221-V289 HydrophobicContact CG1-CG1 4.2Å; F238-V289 HydrophobicContact CZ-CG2 4.24Å; V278-V289 WeakPolarHBondContact CA-O 3.44Å; Y279-V289 PolarHBondContact N-O 2.98Å; Y279-V289 WeakPolarHBondContact O-CG2 3.19Å; Y279-V289 PolarHBondContact O-N 2.75Å; V281-V289 HydrophobicContact CB-CG1 4.34Å; V281-V289 HydrophobicContact CG2-CB 4.44Å; V281-V289 HydrophobicContact CG2-CG1 4.04Å; V281-V289 HydrophobicContact CG2-CG2 3.52Å; V287-V289 HydrophobicContact CG2-CG1 4.4Å; V289-V291 HydrophobicContact CG2-CG1 4.12Å
290K95.9Very high90.8Very high128 Ų12872.7 Ų72.756%0.55736%0.355SS*.EExtended strand (participates in β ladder)trans-85.1133.1173.8-72.9-176.4179.9-179.10108.9V218 S219 G277V218-K290 CarbonylContact C-O 3.57Å; V218-K290 WeakPolarHBondContact CA-O 3.37Å; S219-K290 PolarHBondContact N-O 2.87Å; S219-K290 PolarHBondContact O-N 3.41Å; S219-K290 WeakPolarHBondContact OG-CB 3.13Å; G277-K290 WeakPolarHBondContact O-CA 3.34Å
291V95.9Very high90.6Very high9 Ų973.5 Ų73.56%0.05536%0.359CS..EExtended strand (participates in β ladder)trans-123.5141.8179.2-62.70000110.2L216 K217 V218 F238 L273 G277 V289L216-V291 HydrophobicContact CD1-CB 4.21Å; L216-V291 HydrophobicContact CD2-CB 4.08Å; L216-V291 HydrophobicContact CD2-CG1 4.05Å; L216-V291 HydrophobicContact CG-CB 4.31Å; K217-V291 CarbonylContact O-C 3.52Å; K217-V291 WeakPolarHBondContact O-CA 3.39Å; V218-V291 HydrophobicContact CG1-CG1 4.31Å; V218-V291 HydrophobicContact CG2-CG1 4.17Å; F238-V291 HydrophobicContact CE1-CG1 4.07Å; F238-V291 HydrophobicContact CZ-CG1 3.97Å; L273-V291 VanDerWaalsContact O-CG2 3.28Å; L273-V291 WeakPolarHBondContact O-CG2 3.33Å; G277-V291 CarbonylContact C-O 3.56Å; G277-V291 WeakPolarHBondContact CA-O 3.36Å; G277-V291 PolarHBondContact O-N 2.76Å; V289-V291 HydrophobicContact CG2-CG1 4.12Å
292G94.8Very high90.2Very high19 Ų1979.3 Ų79.320%0.19638%0.384CS..EExtended strand (participates in β ladder)trans-152.8167.6-178.900000111.8L216 K217L216-G292 VanDerWaalsContact CD1-O 3.24Å; L216-G292 WeakPolarHBondContact CD1-O 3.25Å; K217-G292 PolarHBondContact N-O 2.82Å; K217-G292 PolarHBondContact O-N 2.86Å
293P92.6Very high89.9Confident48 Ų4881.6 Ų81.631%0.31239%0.394SS..EExtended strand (participates in β ladder)trans-64.5141.8177.428.5-31.1000109.8V211 A274 Y295V211-P293 HydrophobicContact CG1-CB 4.02Å; A274-P293 HydrophobicContact CB-CB 4.32Å; P293-Y295 HydrophobicContact CB-CD1 4.44Å; P293-Y295 HydrophobicContact CG-CD1 4.06Å; P293-Y295 HydrophobicContact CG-CE1 4.34Å; P293-Y295 WeakPolarHBondContact O-CD1 3.41Å
294A92.9Very high89.4Confident4 Ų484.2 Ų84.23%0.03341%0.41CS..EExtended strand (participates in β ladder)trans-80.4124.4164.300000108.3S212 E215 K217S212-A294 PolarHBondContact N-O 2.95Å; E215-A294 HydrophobicContact CB-CB 3.74Å; E215-A294 HydrophobicContact CG-CB 3.68Å; E215-A294 WeakPolarHBondContact O-CB 3.46Å; E215-A294 PolarHBondContact O-N 3.21Å; K217-A294 HydrophobicContact CG-CB 3.89Å
295Y91.6Very high88.8Confident125 Ų12579.9 Ų79.949%0.4940%0.395SS..EExtended strand (participates in β ladder)trans-145.7148176.261.7-90000110.7M209 D210 P293 Y297M209-Y295 HydrophobicContact CG-CD2 4.28Å; M209-Y295 HydrophobicContact SD-CD2 4.08Å; M209-Y295 HydrophobicContact SD-CG 4.3Å; D210-Y295 CarbonylContact O-C 3.53Å; D210-Y295 WeakPolarHBondContact O-CA 3.16Å; P293-Y295 HydrophobicContact CB-CD1 4.44Å; P293-Y295 HydrophobicContact CG-CD1 4.06Å; P293-Y295 HydrophobicContact CG-CE1 4.34Å; P293-Y295 WeakPolarHBondContact O-CD1 3.41Å; Y295-Y297 HydrophobicContact CD2-CD1 4.23Å; Y295-Y297 AromaticContact CE2-CD1 3.97Å; Y295-Y297 HydrophobicContact CE2-CD1 3.97Å
296E90.6Very high87.8Confident147 Ų14779.9 Ų79.969%0.68739%0.394SS*.EExtended strand (participates in β ladder)trans-108.9149167.1-65.7-173.8178.500108.6M209 D210M209-E296 CarbonylContact C-O 3.52Å; M209-E296 WeakPolarHBondContact CA-O 3.35Å; D210-E296 PolarHBondContact N-O 2.9Å; D210-E296 PolarHBondContact O-N 3.23Å
297Y89.9Confident86.9Confident145 Ų14577.2 Ų77.257%0.56939%0.392SS*.EExtended strand (participates in β ladder)trans-141.7148.4175.473-87.1000112H208 Y295H208-Y297 CarbonylContact O-C 3.56Å; H208-Y297 WeakPolarHBondContact O-CA 3.39Å; Y295-Y297 HydrophobicContact CD2-CD1 4.23Å; Y295-Y297 AromaticContact CE2-CD1 3.97Å; Y295-Y297 HydrophobicContact CE2-CD1 3.97Å
298Q90.2Very high86Confident123 Ų12379.6 Ų79.658%0.57541%0.41SS*.EExtended strand (participates in β ladder)trans-131.6141.8175.8-61.7-174.51.300109.2H208H208-Q298 PolarHBondContact N-O 2.91Å; H208-Q298 PolarHBondContact O-N 2.86Å
299L89Confident85.5Confident113 Ų11376 Ų7659%0.59239%0.393SS*.EExtended strand (participates in β ladder)trans-98.3117.9174.6-60.3-178.5000108.4F205 E206 V207F205-L299 HydrophobicContact CD2-CD2 3.98Å; F205-L299 HydrophobicContact CE2-CD2 3.95Å; E206-L299 CarbonylContact O-C 3.58Å; E206-L299 WeakPolarHBondContact O-CA 3.45Å; V207-L299 HydrophobicContact CB-CD2 4.33Å; V207-L299 HydrophobicContact CG1-CD2 4.32Å; V207-L299 HydrophobicContact CG2-CD2 3.72Å
300E88.5Confident85.1Confident76 Ų7683.8 Ų83.836%0.35542%0.421SS..EExtended strand (participates in β ladder)trans-120.5169.5-179.5-63.9-161.3167.300112E206 H208 F302E206-E300 PolarHBondContact N-O 2.83Å; E206-E300 PolarHBondContact O-N 3.03Å; H208-E300 IonicContact CD2-OE2 2.86Å; H208-E300 IonicContact CE1-OE2 3.66Å; H208-E300 PolarHBondContact CE1-OE2 3.42Å; H208-E300 IonicContact NE2-OE2 2.76Å; H208-E300 PolarHBondContact NE2-OE2 2.95Å; E300-F302 PolarHBondContact O-N 3.01Å
301K87.6Confident84.9Confident118 Ų11879.9 Ų79.951%0.51340%0.403SS..EExtended strand (participates in β ladder)trans48.640.5173.4-52.8-166-161.5144.90113.8E206 Q303E206-K301 VanDerWaalsContact CD-CD 3.49Å; E206-K301 HydrophobicContact CG-CB 4.36Å; E206-K301 HydrophobicContact CG-CD 4.43Å; E206-K301 WeakPolarHBondContact OE1-CD 3.33Å; E206-K301 IonicContact OE1-NZ 3.94Å; E206-K301 PolarHBondContact OE1-NZ 3.28Å; E206-K301 WeakPolarHBondContact OE2-CD 3.29Å; E206-K301 WeakPolarHBondContact OE2-CE 3.49Å; E206-K301 IonicContact OE2-NZ 2.72Å; E206-K301 PolarHBondContact OE2-NZ 3.28Å; K301-Q303 PolarHBondContact O-N 3.38Å
302F84.5Confident84.6Confident121 Ų12179.7 Ų79.753%0.53140%0.402SS..EExtended strand (participates in β ladder)trans-65.8116.3176.9-174.1-98.5000110.4I114 V203 F205 E300 T304I114-F302 HydrophobicContact CD1-CE2 3.63Å; I114-F302 HydrophobicContact CD1-CZ 3.86Å; V203-F302 HydrophobicContact CG1-CD2 4.11Å; V203-F302 HydrophobicContact CG1-CE2 3.4Å; V203-F302 VanDerWaalsContact CG1-CE2 3.4Å; V203-F302 HydrophobicContact CG1-CZ 3.78Å; F205-F302 HydrophobicContact CB-CB 4.44Å; F205-F302 HydrophobicContact CB-CD2 3.94Å; F205-F302 HydrophobicContact CG-CD2 4.46Å; E300-F302 PolarHBondContact O-N 3.01Å; F302-T304 HydrophobicContact CD1-CG2 4.13Å; F302-T304 HydrophobicContact CE1-CG2 3.25Å; F302-T304 HydrophobicContact CE2-CG2 4.49Å; F302-T304 HydrophobicContact CZ-CG2 3.46Å; F302-T304 VanDerWaalsContact CZ-CG2 3.46Å
303Q82.1Confident84.6Confident95 Ų9578.8 Ų78.844%0.44439%0.393SS..EExtended strand (participates in β ladder)trans-125.2126.5-179.1-68.4174.43.300108.6V203 K204 K301V203-Q303 WeakPolarHBondContact CA-O 3.43Å; K204-Q303 HydrophobicContact CB-CB 4.41Å; K204-Q303 PolarHBondContact N-O 3.06Å; K204-Q303 PolarHBondContact O-N 3.39Å; K301-Q303 PolarHBondContact O-N 3.38Å
304T76.6Confident84.6Confident66 Ų6677.2 Ų77.241%0.40538%0.382SS..EExtended strand (participates in β ladder)trans-116.3124.8172.655.90000109.1F112 V203 F302F112-T304 HydrophobicContact CD1-CG2 4.31Å; F112-T304 HydrophobicContact CE1-CG2 4.45Å; V203-T304 HydrophobicContact CG1-CG2 4.23Å; V203-T304 HydrophobicContact CG2-CG2 4.21Å; F302-T304 HydrophobicContact CD1-CG2 4.13Å; F302-T304 HydrophobicContact CE1-CG2 3.25Å; F302-T304 HydrophobicContact CE2-CG2 4.49Å; F302-T304 HydrophobicContact CZ-CG2 3.46Å; F302-T304 VanDerWaalsContact CZ-CG2 3.46Å
305S71.1Confident84.6Confident42 Ų4277 Ų7729%0.29438%0.38SS..EExtended strand (participates in β ladder)trans-108121.2170.632.80000108.5T201 S202T201-S305 WeakPolarHBondContact CA-O 3.36Å; S202-S305 PolarHBondContact N-O 2.84Å; S202-S305 PolarHBondContact O-N 2.78Å; S202-S305 PolarHBondContact OG-O 2.92Å; S202-S305 PolarHBondContact OG-OG 3.39Å
306C63.2Low84.6Confident75 Ų7573.5 Ų73.551%0.50737%0.368SS..  trans-129.2116.5173.8177.70000106.4K111 T201K111-C306 PolarHBondContact NZ-SG 2.77Å; T201-C306 HydrophobicContact CG2-CB 4.48Å
307G68.4Low84.5Confident40 Ų4068.9 Ų68.941%0.41236%0.36SS..  trans-169.4167.7-175.900000113L199L199-G307 WeakPolarHBondContact CB-O 3.46Å; L199-G307 PolarHBondContact N-O 3.39Å; L199-G307 VanDerWaalsContact N-O 3.11Å
308S73.5Confident84.5Confident79 Ų7962 Ų6255%0.55233%0.333SS*.EExtended strand (participates in β ladder)trans-80.9143.8162.150.90000109.3L197 R310L197-S308 CarbonylContact O-C 3.56Å; L197-S308 WeakPolarHBondContact O-CA 3.48Å; L197-S308 WeakPolarHBondContact O-CB 3.32Å; S308-R310 PolarHBondContact O-N 2.92Å
309S82.7Confident84.3Confident22 Ų2260 Ų6015%0.15433%0.326CS..EExtended strand (participates in β ladder)trans-62.4134.1164.8-175.80000108.4L197 T312L197-S309 PolarHBondContact O-N 2.92Å; S309-T312 WeakPolarHBondContact OG-CB 3.34Å; S309-T312 PolarHBondContact OG-N 3.35Å; S309-T312 PolarHBondContact OG-OG1 3.26Å
310R86Confident84.2Confident164 Ų16457.8 Ų57.862%0.61932%0.315SS*.EExtended strand (participates in β ladder)trans-91.8-26.9179.7-67.3-179178.3-161.95.2112.2E169 A172 S308E169-R310 HydrophobicContact CB-CB 4.49Å; E169-R310 VanDerWaalsContact CD-CB 3.49Å; E169-R310 HydrophobicContact CG-CB 3.88Å; E169-R310 WeakPolarHBondContact OE1-CD 3.43Å; E169-R310 WeakPolarHBondContact OE2-CD 3.25Å; E169-R310 IonicContact OE2-NH1 3.87Å; A172-R310 WeakPolarHBondContact CB-O 3.31Å; S308-R310 PolarHBondContact O-N 2.92Å
311R90.3Very high83.9Confident46 Ų4656.6 Ų56.617%0.17431%0.313CS..EExtended strand (participates in β ladder)trans-103.4-19.7-177.9-57.6-161.3-67.7127.48.6112.8T165 F166 E167 E169 E346 D364T165-R311 HydrophobicContact CG2-CB 4.41Å; F166-R311 PolarHBondContact N-O 2.92Å; F166-R311 WeakPolarHBondContact O-CB 3.38Å; F166-R311 PolarHBondContact O-NH1 2.97Å; E167-R311 WeakPolarHBondContact O-CD 3.15Å; E167-R311 PolarHBondContact O-NH1 2.9Å; E167-R311 VanDerWaalsContact O-NH1 3.11Å; E169-R311 HydrophobicContact CB-CG 4Å; R311-E346 IonicContact CZ-OE2 3.39Å; R311-E346 IonicContact NH1-OE2 2.79Å; R311-E346 PolarHBondContact NH1-OE2 3.26Å; R311-E346 IonicContact NH2-OE2 3.14Å; R311-E346 PolarHBondContact NH2-OE2 2.88Å; R311-E346 VanDerWaalsContact NH2-OE2 3.14Å; R311-D364 IonicContact CZ-OD1 3.03Å; R311-D364 IonicContact CZ-OD2 3.51Å; R311-D364 IonicContact NE-OD1 2.97Å; R311-D364 IonicContact NE-OD2 3.15Å; R311-D364 PolarHBondContact NE-OD2 3.46Å; R311-D364 VanDerWaalsContact NE-OD2 3.15Å; R311-D364 IonicContact NH2-OD1 3.75Å; R311-D364 PolarHBondContact NH2-OD1 3.4Å; R311-D364 IonicContact NH2-OD2 3.23Å; R311-D364 PolarHBondContact NH2-OD2 3.23Å
312T91.2Very high83.7Confident6 Ų653.2 Ų53.24%0.03730%0.299CS..EExtended strand (participates in β ladder)trans-102.2135.7-179.9-43.40000112.4L163 I164 T165 L197 S309 F361L163-T312 HydrophobicContact CD2-CG2 3.48Å; L163-T312 VanDerWaalsContact CD2-CG2 3.48Å; I164-T312 CarbonylContact O-C 3.53Å; I164-T312 VanDerWaalsContact O-CA 3.25Å; I164-T312 WeakPolarHBondContact O-CA 3.42Å; I164-T312 WeakPolarHBondContact O-CG2 3Å; T165-T312 WeakPolarHBondContact OG1-CG2 3.38Å; T165-T312 PolarHBondContact OG1-OG1 3.43Å; L197-T312 HydrophobicContact CD2-CG2 3.92Å; S309-T312 WeakPolarHBondContact OG-CB 3.34Å; S309-T312 PolarHBondContact OG-N 3.35Å; S309-T312 PolarHBondContact OG-OG1 3.26Å; T312-F361 HydrophobicContact CG2-CE1 4.04Å; T312-F361 HydrophobicContact CG2-CZ 4.41Å
313I93.1Very high83.9Confident0 Ų053.3 Ų53.30%031%0.305CS..EExtended strand (participates in β ladder)trans-118.9153.9172.469.1170.2000110.7I164 F166 A172 V175 L176 P194 L315I164-I313 HydrophobicContact CB-CG1 3.98Å; I164-I313 PolarHBondContact N-O 2.72Å; I164-I313 PolarHBondContact O-N 3.26Å; F166-I313 HydrophobicContact CE2-CD1 3.69Å; F166-I313 HydrophobicContact CE2-CG1 3.88Å; F166-I313 HydrophobicContact CE2-CG2 4.4Å; F166-I313 HydrophobicContact CZ-CD1 4.18Å; A172-I313 HydrophobicContact CB-CG2 3.97Å; V175-I313 HydrophobicContact CB-CD1 4.22Å; V175-I313 HydrophobicContact CG1-CD1 3.51Å; L176-I313 HydrophobicContact CD1-CG2 4.07Å; L176-I313 HydrophobicContact CD2-CB 4.17Å; L176-I313 HydrophobicContact CD2-CG2 3.74Å; L176-I313 HydrophobicContact CG-CG2 3.7Å; P194-I313 HydrophobicContact CB-CD1 4.27Å; I313-L315 HydrophobicContact CD1-CD2 3.87Å
314L93.7Very high84.2Confident15 Ų1550.8 Ų50.88%0.07929%0.293CS..EExtended strand (participates in β ladder)trans-103.5127169.7-178.868.7000108.8L157 Q161 L163 P194 K195 L197 E316L157-L314 HydrophobicContact CD1-CD1 3.46Å; L157-L314 VanDerWaalsContact CD1-CD1 3.46Å; Q161-L314 HydrophobicContact CB-CD1 4.04Å; L163-L314 HydrophobicContact CG-CD1 4.32Å; P194-L314 CarbonylContact C-O 3.37Å; K195-L314 PolarHBondContact N-O 2.98Å; K195-L314 PolarHBondContact O-N 3.4Å; L197-L314 HydrophobicContact CD1-CB 4.36Å; L314-E316 HydrophobicContact CD2-CG 4.03Å; L314-E316 HydrophobicContact CG-CG 4.15Å
315L93.3Very high84.8Confident0 Ų055 Ų550%031%0.308CS..EExtended strand (participates in β ladder)trans-94.3128.8167.6-59.4-174.6000109.2Q161 A162 I164 P194 I313 I318 L331 F335Q161-L315 WeakPolarHBondContact CA-O 3.41Å; Q161-L315 WeakPolarHBondContact CB-O 3.28Å; A162-L315 HydrophobicContact CB-CB 4.22Å; A162-L315 HydrophobicContact CB-CD1 4.37Å; A162-L315 PolarHBondContact N-O 3.37Å; A162-L315 PolarHBondContact O-N 2.96Å; I164-L315 HydrophobicContact CD1-CD1 3.45Å; I164-L315 VanDerWaalsContact CD1-CD1 3.45Å; I164-L315 HydrophobicContact CD1-CG 4.07Å; I164-L315 HydrophobicContact CG1-CD1 4.2Å; I164-L315 HydrophobicContact CG1-CG 4.46Å; P194-L315 HydrophobicContact CB-CD2 3.99Å; I313-L315 HydrophobicContact CD1-CD2 3.87Å; L315-I318 HydrophobicContact CB-CD1 4.02Å; L315-L331 HydrophobicContact CD1-CD2 4.01Å; L315-F335 HydrophobicContact CD1-CD2 4.12Å; L315-F335 HydrophobicContact CD1-CE2 3.43Å; L315-F335 VanDerWaalsContact CD1-CE2 3.43Å; L315-F335 HydrophobicContact CD1-CZ 3.94Å; L315-F335 HydrophobicContact CD2-CE2 4.27Å; L315-F335 HydrophobicContact CD2-CZ 3.91Å; L315-F335 HydrophobicContact CG-CE2 4.5Å
316E92.1Very high85.7Confident51 Ų5156.9 Ų56.924%0.23832%0.315CS..EExtended strand (participates in β ladder)trans-116.4153.1175.5-65-179.716300110.5Q161 K193 K195 L314Q161-E316 HydrophobicContact CG-CG 4.45Å; K193-E316 PolarHBondContact N-O 3.35Å; K193-E316 PolarHBondContact O-N 3.35Å; K195-E316 WeakPolarHBondContact CD-OE1 3.42Å; K195-E316 WeakPolarHBondContact CD-OE2 3.5Å; K195-E316 IonicContact NZ-OE1 3.7Å; K195-E316 PolarHBondContact NZ-OE1 3.07Å; K195-E316 IonicContact NZ-OE2 2.82Å; K195-E316 PolarHBondContact NZ-OE2 2.96Å; L314-E316 HydrophobicContact CD2-CG 4.03Å; L314-E316 HydrophobicContact CG-CG 4.15Å
317G87Confident87Confident49 Ų4953.3 Ų53.351%0.50529%0.291SS..  trans84.827.8173.100000114.2G160G160-G317 PolarHBondContact O-N 3.26Å
318I89.8Confident88.2Confident0 Ų053.1 Ų53.10%028%0.279CS..  trans-80.3128.4176.3-58.7161.9000108.7G160 A162 L190 V192 L315 L327 L331 Y350 K353G160-I318 WeakPolarHBondContact CA-O 3.47Å; G160-I318 PolarHBondContact O-N 2.88Å; G160-I318 VanDerWaalsContact O-N 3.08Å; A162-I318 HydrophobicContact CB-CD1 3.58Å; L190-I318 HydrophobicContact CD1-CG2 4.4Å; V192-I318 HydrophobicContact CB-CG1 4.42Å; V192-I318 HydrophobicContact CG1-CG1 3.59Å; L315-I318 HydrophobicContact CB-CD1 4.02Å; I318-L327 HydrophobicContact CG2-CD2 3.69Å; I318-L327 HydrophobicContact CG2-CG 4.3Å; I318-L331 HydrophobicContact CD1-CD1 3.92Å; I318-Y350 HydrophobicContact CB-CD2 4.49Å; I318-Y350 HydrophobicContact CB-CE2 3.86Å; I318-Y350 HydrophobicContact CD1-CD2 3.77Å; I318-Y350 HydrophobicContact CD1-CE2 4.02Å; I318-Y350 HydrophobicContact CG2-CD2 4.14Å; I318-Y350 HydrophobicContact CG2-CE2 3.46Å; I318-Y350 VanDerWaalsContact CG2-CE2 3.46Å; I318-K353 VanDerWaalsContact O-CE 3.24Å; I318-K353 WeakPolarHBondContact O-CE 3.39Å
319D87.1Confident89.2Confident83 Ų8353.3 Ų53.344%0.44427%0.274SS..  trans-93.3136.9172.6-69.5-40.8000110.3L190 V321 K353L190-D319 HydrophobicContact CD2-CB 4.08Å; D319-V321 VanDerWaalsContact C-N 3.27Å; D319-V321 HydrophobicContact CB-CG1 4.27Å; D319-V321 PolarHBondContact O-N 3.25Å; D319-K353 IonicContact OD1-NZ 2.83Å; D319-K353 PolarHBondContact OD1-NZ 3.02Å
320D85.4Confident89.6Confident65 Ų6554.1 Ų54.135%0.34828%0.275SS..  trans-76.878.4-179.5-57.311.9000109.5Y350 K353D320-Y350 VanDerWaalsContact CG-OH 3.3Å; D320-Y350 PolarHBondContact OD1-OH 3.06Å; D320-K353 WeakPolarHBondContact OD1-CG 3.23Å; D320-K353 PolarHBondContact OD1-N 2.93Å; D320-K353 WeakPolarHBondContact OD2-CA 3.35Å; D320-K353 VanDerWaalsContact OD2-CB 3.23Å; D320-K353 WeakPolarHBondContact OD2-CB 3.34Å; D320-K353 PolarHBondContact OD2-N 3.3Å
321V83.9Confident89.9Confident51 Ų5146.3 Ų46.331%0.30925%0.246SC..  trans-88.5-24.5-179.1-67.60000113.1C185 I188 L190 D319 L327C185-V321 HydrophobicContact CB-CG2 4.42Å; I188-V321 HydrophobicContact CD1-CB 4.15Å; I188-V321 HydrophobicContact CD1-CG1 4.21Å; I188-V321 HydrophobicContact CG2-CG1 4.16Å; L190-V321 HydrophobicContact CD1-CG2 3.96Å; L190-V321 HydrophobicContact CD2-CB 4.5Å; L190-V321 HydrophobicContact CD2-CG1 3.71Å; L190-V321 HydrophobicContact CD2-CG2 3.94Å; L190-V321 HydrophobicContact CG-CG2 4.26Å; D319-V321 VanDerWaalsContact C-N 3.27Å; D319-V321 HydrophobicContact CB-CG1 4.27Å; D319-V321 PolarHBondContact O-N 3.25Å; V321-L327 HydrophobicContact CG2-CD1 4.44Å
322E83.2Confident90Very high47 Ų4746.7 Ų46.722%0.2225%0.249CC..SBendtrans-138.3178.6-177.7-73.1173.3-169.100109.5D326 H330E322-D326 HydrophobicContact CB-CB 4.34Å; E322-H330 IonicContact OE1-CE1 3.22Å; E322-H330 IonicContact OE2-CE1 2.68Å; E322-H330 PolarHBondContact OE2-CE1 3.44Å; E322-H330 IonicContact OE2-ND1 2.77Å; E322-H330 PolarHBondContact OE2-ND1 3.19Å
323D88Confident90.1Very high124 Ų12450.4 Ų50.466%0.66327%0.268SS*.  trans-65156.7174.5-72.7-34.2000111.7E325 D326 L327D323-E325 VanDerWaalsContact C-N 3.26Å; D323-E325 PolarHBondContact O-N 2.99Å; D323-D326 PolarHBondContact O-N 2.97Å; D323-L327 WeakPolarHBondContact O-CB 3.29Å; D323-L327 PolarHBondContact O-N 2.8Å
324E87.7Confident90Very high41 Ų4151.3 Ų51.319%0.19227%0.273CS..Hα-helixtrans-60-34.1-170.8-171.1-177.713500113Q328 K349 Y350 K355E324-Q328 WeakPolarHBondContact O-CB 3.25Å; E324-Q328 PolarHBondContact O-N 2.83Å; E324-K349 IonicContact OE1-NZ 3.98Å; E324-K349 PolarHBondContact OE1-NZ 3.27Å; E324-Y350 HydrophobicContact CB-CD1 4.48Å; E324-Y350 HydrophobicContact CG-CD1 3.8Å; E324-Y350 HydrophobicContact CG-CE1 4.16Å; E324-K355 IonicContact OE2-NZ 2.95Å; E324-K355 PolarHBondContact OE2-NZ 3.2Å
325E90.1Very high89.9Confident156 Ų15650.6 Ų50.673%0.72927%0.269SS*.Hα-helixtrans-75.6-49.7179.8-63.8-173.7168.500111.2D323 L327 Q328 D329D323-E325 VanDerWaalsContact C-N 3.26Å; D323-E325 PolarHBondContact O-N 2.99Å; E325-L327 VanDerWaalsContact C-N 3.31Å; E325-L327 PolarHBondContact O-N 2.95Å; E325-Q328 WeakPolarHBondContact O-CB 3.32Å; E325-Q328 PolarHBondContact O-N 3.03Å; E325-Q328 VanDerWaalsContact O-N 3.07Å; E325-D329 PolarHBondContact O-N 2.87Å
326D90.8Very high89.9Confident81 Ų8154.6 Ų54.643%0.43329%0.287SS..Hα-helixtrans-60-42.6179.2-61.8-39.3000111.6E322 D323 Q328 D329 H330E322-D326 HydrophobicContact CB-CB 4.34Å; D323-D326 PolarHBondContact O-N 2.97Å; D326-Q328 VanDerWaalsContact C-N 3.31Å; D326-Q328 PolarHBondContact O-N 2.96Å; D326-D329 PolarHBondContact O-N 3.42Å; D326-H330 PolarHBondContact O-N 2.84Å; D326-H330 PolarHBondContact O-ND1 3.17Å
327L90.6Very high89.8Confident0 Ų057.4 Ų57.40%030%0.299CS..Hα-helixtrans-68.1-33.5177.9-176.151.3000112.1L190 I318 V321 D323 E325 L331 Y350L190-L327 HydrophobicContact CD1-CD1 3.42Å; L190-L327 VanDerWaalsContact CD1-CD1 3.42Å; I318-L327 HydrophobicContact CG2-CD2 3.69Å; I318-L327 HydrophobicContact CG2-CG 4.3Å; V321-L327 HydrophobicContact CG2-CD1 4.44Å; D323-L327 WeakPolarHBondContact O-CB 3.29Å; D323-L327 PolarHBondContact O-N 2.8Å; E325-L327 VanDerWaalsContact C-N 3.31Å; E325-L327 PolarHBondContact O-N 2.95Å; L327-L331 WeakPolarHBondContact O-CD1 3.2Å; L327-L331 VanDerWaalsContact O-CG 3.23Å; L327-L331 WeakPolarHBondContact O-CG 3.41Å; L327-L331 PolarHBondContact O-N 3.01Å; L327-L331 VanDerWaalsContact O-N 3.11Å; L327-Y350 HydrophobicContact CB-CD1 4.34Å; L327-Y350 HydrophobicContact CB-CE1 4.21Å; L327-Y350 HydrophobicContact CD2-CD1 4.28Å; L327-Y350 HydrophobicContact CD2-CE1 3.56Å; L327-Y350 HydrophobicContact CD2-CE2 4.29Å; L327-Y350 WeakPolarHBondContact CD2-OH 3.36Å; L327-Y350 HydrophobicContact CG-CD1 4.28Å; L327-Y350 HydrophobicContact CG-CE1 4.04Å
328Q93.1Very high89.7Confident35 Ų3560.1 Ų60.116%0.16431%0.308CS..Hα-helixtrans-64.5-44.1173.3-168.2180-73.900111E324 E325 D326 L331 E332 I348E324-Q328 WeakPolarHBondContact O-CB 3.25Å; E324-Q328 PolarHBondContact O-N 2.83Å; E325-Q328 WeakPolarHBondContact O-CB 3.32Å; E325-Q328 PolarHBondContact O-N 3.03Å; E325-Q328 VanDerWaalsContact O-N 3.07Å; D326-Q328 VanDerWaalsContact C-N 3.31Å; D326-Q328 PolarHBondContact O-N 2.96Å; Q328-L331 WeakPolarHBondContact O-CB 3.31Å; Q328-L331 PolarHBondContact O-N 3.44Å; Q328-E332 PolarHBondContact O-N 3.11Å; Q328-I348 HydrophobicContact CG-CD1 4.21Å; Q328-I348 HydrophobicContact CG-CG1 3.94Å; Q328-I348 HydrophobicContact CG-CG2 4.04Å; Q328-I348 PolarHBondContact NE2-O 3.19Å
329D93.3Very high89.4Confident83 Ų8367.8 Ų67.844%0.44435%0.348SS..Hα-helixtrans-63.4-42.6178.2-74.10.3000111.5E325 D326 L331 E332 I333E325-D329 PolarHBondContact O-N 2.87Å; D326-D329 PolarHBondContact O-N 3.42Å; D329-L331 VanDerWaalsContact C-N 3.34Å; D329-L331 PolarHBondContact O-N 2.88Å; D329-E332 PolarHBondContact O-N 2.79Å; D329-I333 WeakPolarHBondContact O-CB 3.47Å; D329-I333 VanDerWaalsContact O-CG1 3.28Å; D329-I333 WeakPolarHBondContact O-CG1 3.36Å; D329-I333 PolarHBondContact O-N 2.78Å
330H92Very high89.3Confident40 Ų4066.2 Ų66.219%0.18534%0.34CS..Hα-helixtrans-59.5-42.6174.4-78.5109.2000112.6C185 E322 D326 H334C185-H330 HydrophobicContact CB-CB 4.49Å; E322-H330 IonicContact OE1-CE1 3.22Å; E322-H330 IonicContact OE2-CE1 2.68Å; E322-H330 PolarHBondContact OE2-CE1 3.44Å; E322-H330 IonicContact OE2-ND1 2.77Å; E322-H330 PolarHBondContact OE2-ND1 3.19Å; D326-H330 PolarHBondContact O-N 2.84Å; D326-H330 PolarHBondContact O-ND1 3.17Å; H330-H334 VanDerWaalsContact O-CB 3.29Å; H330-H334 WeakPolarHBondContact O-CB 3.4Å; H330-H334 PolarHBondContact O-N 2.78Å
331L91.4Very high89.3Confident0 Ų065.2 Ų65.20%034%0.338CS..Hα-helixtrans-64.3-45.8174.6-69.8167.6000110.8A162 V183 V192 L315 I318 L327 Q328 D329 H334 F335 I348 Y350A162-L331 HydrophobicContact CB-CD1 4.06Å; V183-L331 HydrophobicContact CB-CD2 4.5Å; V183-L331 HydrophobicContact CG1-CD2 4.18Å; V183-L331 HydrophobicContact CG2-CD2 3.98Å; V192-L331 HydrophobicContact CG1-CD2 4.38Å; L315-L331 HydrophobicContact CD1-CD2 4.01Å; I318-L331 HydrophobicContact CD1-CD1 3.92Å; L327-L331 WeakPolarHBondContact O-CD1 3.2Å; L327-L331 VanDerWaalsContact O-CG 3.23Å; L327-L331 WeakPolarHBondContact O-CG 3.41Å; L327-L331 PolarHBondContact O-N 3.01Å; L327-L331 VanDerWaalsContact O-N 3.11Å; Q328-L331 WeakPolarHBondContact O-CB 3.31Å; Q328-L331 PolarHBondContact O-N 3.44Å; D329-L331 VanDerWaalsContact C-N 3.34Å; D329-L331 PolarHBondContact O-N 2.88Å; L331-H334 PolarHBondContact O-N 2.87Å; L331-F335 HydrophobicContact CD2-CE2 4.25Å; L331-F335 VanDerWaalsContact O-CD2 3.23Å; L331-F335 WeakPolarHBondContact O-CD2 3.29Å; L331-F335 PolarHBondContact O-N 2.79Å; L331-I348 HydrophobicContact CB-CD1 3.73Å; L331-Y350 HydrophobicContact CD1-CD2 4.5Å; L331-Y350 HydrophobicContact CD1-CG 4.46Å
332E93.5Very high89.4Confident53 Ų5363.3 Ų63.325%0.24833%0.329CS..Hα-helixtrans-59-52.3179.7-162.6177.2157.700111.3Q328 D329 H334 F335 Q336 I345 I348Q328-E332 PolarHBondContact O-N 3.11Å; D329-E332 PolarHBondContact O-N 2.79Å; E332-H334 VanDerWaalsContact C-N 3.28Å; E332-H334 PolarHBondContact O-N 2.91Å; E332-F335 CarbonylContact O-C 3.58Å; E332-F335 PolarHBondContact O-N 2.85Å; E332-Q336 HydrophobicContact CG-CG 4.43Å; E332-Q336 WeakPolarHBondContact O-CB 3.34Å; E332-Q336 WeakPolarHBondContact O-CG 2.92Å; E332-Q336 PolarHBondContact O-N 2.89Å; E332-Q336 PolarHBondContact OE1-NE2 2.8Å; E332-I345 HydrophobicContact CG-CD1 3.86Å; E332-I348 HydrophobicContact CB-CD1 4.19Å; E332-I348 HydrophobicContact CB-CG2 4.16Å; E332-I348 HydrophobicContact CG-CG2 3.99Å; E332-I348 VanDerWaalsContact OE2-CG2 3.32Å; E332-I348 WeakPolarHBondContact OE2-CG2 3.49Å
333I92.2Very high89.8Confident85 Ų8561.8 Ų61.844%0.43633%0.326SS..Hα-helixtrans-59.4-39.9178.1-67.6166.3000111.1D329 K337D329-I333 WeakPolarHBondContact O-CB 3.47Å; D329-I333 VanDerWaalsContact O-CG1 3.28Å; D329-I333 WeakPolarHBondContact O-CG1 3.36Å; D329-I333 PolarHBondContact O-N 2.78Å; I333-K337 WeakPolarHBondContact O-CG 3.45Å; I333-K337 PolarHBondContact O-N 3.32Å
334H91.1Very high89.9Confident19 Ų1962.2 Ų62.29%0.08832%0.324CS..Hα-helixtrans-64.6-44.2178.9177.5-81.9000112.1R182 V183 H330 L331 E332 N340R182-H334 PolarHBondContact O-NE2 3.24Å; V183-H334 HydrophobicContact CG1-CB 3.88Å; V183-H334 HydrophobicContact CG2-CB 4.34Å; H330-H334 VanDerWaalsContact O-CB 3.29Å; H330-H334 WeakPolarHBondContact O-CB 3.4Å; H330-H334 PolarHBondContact O-N 2.78Å; L331-H334 PolarHBondContact O-N 2.87Å; E332-H334 VanDerWaalsContact C-N 3.28Å; E332-H334 PolarHBondContact O-N 2.91Å; H334-N340 PolarHBondContact CD2-ND2 3.15Å; H334-N340 VanDerWaalsContact CD2-ND2 3.28Å; H334-N340 PolarHBondContact NE2-ND2 3.14Å; H334-N340 WeakPolarHBondContact O-CB 3.28Å; H334-N340 PolarHBondContact O-ND2 3.23Å
335F92.1Very high90.1Very high0 Ų061.2 Ų61.20%032%0.319CS..Hα-helixtrans-87.1-7.2-177.5-73.2-74.8000114.1I164 F166 V175 C181 V183 V192 L315 L331 E332 G342 G343 I345I164-F335 HydrophobicContact CD1-CB 4.23Å; I164-F335 HydrophobicContact CD1-CD2 3.51Å; I164-F335 HydrophobicContact CD1-CE2 4.07Å; I164-F335 HydrophobicContact CD1-CG 3.92Å; F166-F335 HydrophobicContact CE1-CB 4.18Å; F166-F335 HydrophobicContact CZ-CB 4.17Å; F166-F335 HydrophobicContact CZ-CD1 4.33Å; V175-F335 HydrophobicContact CG1-CD1 4.09Å; V175-F335 HydrophobicContact CG1-CE1 3.63Å; V175-F335 HydrophobicContact CG2-CD1 4.29Å; C181-F335 HydrophobicContact CB-CE1 4.35Å; C181-F335 HydrophobicContact CB-CZ 3.92Å; V183-F335 HydrophobicContact CG2-CE2 4.23Å; V192-F335 HydrophobicContact CG2-CE2 4.33Å; V192-F335 HydrophobicContact CG2-CZ 4.1Å; L315-F335 HydrophobicContact CD1-CD2 4.12Å; L315-F335 HydrophobicContact CD1-CE2 3.43Å; L315-F335 VanDerWaalsContact CD1-CE2 3.43Å; L315-F335 HydrophobicContact CD1-CZ 3.94Å; L315-F335 HydrophobicContact CD2-CE2 4.27Å; L315-F335 HydrophobicContact CD2-CZ 3.91Å; L315-F335 HydrophobicContact CG-CE2 4.5Å; L331-F335 HydrophobicContact CD2-CE2 4.25Å; L331-F335 VanDerWaalsContact O-CD2 3.23Å; L331-F335 WeakPolarHBondContact O-CD2 3.29Å; L331-F335 PolarHBondContact O-N 2.79Å; E332-F335 CarbonylContact O-C 3.58Å; E332-F335 PolarHBondContact O-N 2.85Å; F335-G342 CarbonylContact O-C 3.59Å; F335-G342 WeakPolarHBondContact O-CA 3.46Å; F335-G343 PolarHBondContact O-N 3.39Å; F335-I345 HydrophobicContact CB-CD1 3.84Å
336Q93.4Very high90.2Very high83 Ų8359 Ų5939%0.38831%0.309SS..Hα-helixtrans-79-26.8164.8-78177.1-4.400112.8E332 P338 G343 I345E332-Q336 HydrophobicContact CG-CG 4.43Å; E332-Q336 WeakPolarHBondContact O-CB 3.34Å; E332-Q336 WeakPolarHBondContact O-CG 2.92Å; E332-Q336 PolarHBondContact O-N 2.89Å; E332-Q336 PolarHBondContact OE1-NE2 2.8Å; Q336-P338 WeakPolarHBondContact O-CD 3.23Å; Q336-G343 WeakPolarHBondContact CA-O 3.47Å; Q336-I345 HydrophobicContact CG-CB 4.44Å; Q336-I345 HydrophobicContact CG-CD1 3.86Å; Q336-I345 HydrophobicContact CG-CG1 3.96Å
337K90.2Very high90.3Very high111 Ų11160 Ų6048%0.48331%0.314SS..  trans-70.1122.9-176.4-76.2168.7-175.5174.50112I333 N339 N340 G342I333-K337 WeakPolarHBondContact O-CG 3.45Å; I333-K337 PolarHBondContact O-N 3.32Å; K337-N339 PolarHBondContact O-N 3.11Å; K337-N340 PolarHBondContact O-N 2.95Å; K337-G342 WeakPolarHBondContact O-CA 3.43Å; K337-G342 PolarHBondContact O-N 2.99Å
338P84.4Confident90.4Very high106 Ų10660.4 Ų60.469%0.68832%0.317SS*.G310 helixtrans-60.1-32.7178.3-25.234.2000113.8Q336 N340 S341Q336-P338 WeakPolarHBondContact O-CD 3.23Å; P338-N340 PolarHBondContact O-N 3.09Å; P338-N340 VanDerWaalsContact O-N 3.16Å; P338-S341 PolarHBondContact O-N 2.88Å
339N84.1Confident90.5Very high160 Ų16062.3 Ų62.386%0.85632%0.324SS*.G310 helixtrans-62-21.5177.7-70.2-10.5000113K337 S341K337-N339 PolarHBondContact O-N 3.11Å; N339-S341 VanDerWaalsContact C-N 3.34Å
340N85.4Confident90.5Very high51 Ų5158.4 Ų58.427%0.27330%0.303SS..G310 helixtrans-97.217.9177.3-64.8-24000112.4H334 K337 P338 G342H334-N340 PolarHBondContact CD2-ND2 3.15Å; H334-N340 VanDerWaalsContact CD2-ND2 3.28Å; H334-N340 PolarHBondContact NE2-ND2 3.14Å; H334-N340 WeakPolarHBondContact O-CB 3.28Å; H334-N340 PolarHBondContact O-ND2 3.23Å; K337-N340 PolarHBondContact O-N 2.95Å; P338-N340 PolarHBondContact O-N 3.09Å; P338-N340 VanDerWaalsContact O-N 3.16Å; N340-G342 PolarHBondContact O-N 3.16Å
341S84.4Confident90.5Very high43 Ų4356.9 Ų56.930%0.30130%0.297SS..THydrogen-bonded Turntrans61.917.6-169.2-50.90000114V175 P338 N339V175-S341 WeakPolarHBondContact CG2-O 3.39Å; P338-S341 PolarHBondContact O-N 2.88Å; N339-S341 VanDerWaalsContact C-N 3.34Å
342G86Confident90.5Very high11 Ų1157.7 Ų57.711%0.11330%0.303CS..  trans-79.9-176.7178.500000114.4V171 F335 K337 N340V171-G342 VanDerWaalsContact CG1-C 3.48Å; F335-G342 CarbonylContact O-C 3.59Å; F335-G342 WeakPolarHBondContact O-CA 3.46Å; K337-G342 WeakPolarHBondContact O-CA 3.43Å; K337-G342 PolarHBondContact O-N 2.99Å; N340-G342 PolarHBondContact O-N 3.16Å
343G91.1Very high90.3Very high15 Ų1560.3 Ų60.316%0.15531%0.313CS..  trans-177-171.4-179.600000111.2F335 Q336 I345F335-G343 PolarHBondContact O-N 3.39Å; Q336-G343 WeakPolarHBondContact CA-O 3.47Å; G343-I345 PolarHBondContact O-N 3.04Å
344E91.2Very high90Very high134 Ų13460.4 Ų60.463%0.62634%0.335SS*.  trans-61.2131.4-177.7-67.9176.5170.600111.6F166 E167F166-E344 WeakPolarHBondContact CA-O 3.41Å; E167-E344 HydrophobicContact CB-CB 4.27Å; E167-E344 HydrophobicContact CG-CB 4.03Å; E167-E344 PolarHBondContact N-O 2.92Å
345I92.6Very high89.9Confident19 Ų1965 Ų6510%0.09736%0.355CS..EExtended strand (participates in β ladder)trans-105.2123.6-176.4-64-179.5000107.8I164 F166 E332 F335 Q336 G343 I348I164-I345 HydrophobicContact CG2-CD1 4.01Å; I164-I345 HydrophobicContact CG2-CG1 4.2Å; I164-I345 HydrophobicContact CG2-CG2 4.09Å; F166-I345 HydrophobicContact CD1-CG1 3.96Å; F166-I345 HydrophobicContact CE1-CD1 4.34Å; F166-I345 HydrophobicContact CE1-CG1 3.92Å; E332-I345 HydrophobicContact CG-CD1 3.86Å; F335-I345 HydrophobicContact CB-CD1 3.84Å; Q336-I345 HydrophobicContact CG-CB 4.44Å; Q336-I345 HydrophobicContact CG-CD1 3.86Å; Q336-I345 HydrophobicContact CG-CG1 3.96Å; G343-I345 PolarHBondContact O-N 3.04Å; I345-I348 HydrophobicContact CG2-CB 4.25Å; I345-I348 HydrophobicContact CG2-CG2 4.5Å
346E91.6Very high89.8Confident109 Ų10968.8 Ų68.851%0.50938%0.382SS..EExtended strand (participates in β ladder)trans-80.9-39.7175.8-173.2-177158.200110.7T165 E167 R311T165-E346 HydrophobicContact CG2-CB 4.25Å; T165-E346 PolarHBondContact O-N 3.3Å; E167-E346 HydrophobicContact CG-CB 4.16Å; R311-E346 IonicContact CZ-OE2 3.39Å; R311-E346 IonicContact NH1-OE2 2.79Å; R311-E346 PolarHBondContact NH1-OE2 3.26Å; R311-E346 IonicContact NH2-OE2 3.14Å; R311-E346 PolarHBondContact NH2-OE2 2.88Å; R311-E346 VanDerWaalsContact NH2-OE2 3.14Å
347N91.8Very high89.8Confident103 Ų10368.3 Ų68.355%0.55138%0.382SS*.EExtended strand (participates in β ladder)trans-157140.5-179.2-165.1-6.3000111.5T165T165-N347 PolarHBondContact N-O 2.92Å; T165-N347 PolarHBondContact O-N 3.21Å
348I93.5Very high89.7Confident9 Ų968.5 Ų68.55%0.04638%0.384CS..EExtended strand (participates in β ladder)trans-133.9138.3171.7-179.7166000110L163 I164 Q328 L331 E332 I345L163-I348 CarbonylContact O-C 3.55Å; L163-I348 VanDerWaalsContact O-CA 3.31Å; L163-I348 WeakPolarHBondContact O-CA 3.43Å; I164-I348 HydrophobicContact CD1-CD1 3.87Å; I164-I348 HydrophobicContact CG1-CD1 3.82Å; I164-I348 HydrophobicContact CG1-CG1 3.92Å; Q328-I348 HydrophobicContact CG-CD1 4.21Å; Q328-I348 HydrophobicContact CG-CG1 3.94Å; Q328-I348 HydrophobicContact CG-CG2 4.04Å; Q328-I348 PolarHBondContact NE2-O 3.19Å; L331-I348 HydrophobicContact CB-CD1 3.73Å; E332-I348 HydrophobicContact CB-CD1 4.19Å; E332-I348 HydrophobicContact CB-CG2 4.16Å; E332-I348 HydrophobicContact CG-CG2 3.99Å; E332-I348 VanDerWaalsContact OE2-CG2 3.32Å; E332-I348 WeakPolarHBondContact OE2-CG2 3.49Å; I345-I348 HydrophobicContact CG2-CB 4.25Å; I345-I348 HydrophobicContact CG2-CG2 4.5Å
349K94.8Very high89.9Confident75 Ų7564.4 Ų64.433%0.32636%0.359SS..EExtended strand (participates in β ladder)trans-142120.6169.3-173.265.3-165.9149.50111.3A162 L163 E324 I351 L357A162-K349 CarbonylContact C-O 3.57Å; A162-K349 VanDerWaalsContact CA-O 3.25Å; A162-K349 WeakPolarHBondContact CA-O 3.43Å; L163-K349 PolarHBondContact N-O 2.83Å; L163-K349 PolarHBondContact O-N 2.99Å; E324-K349 IonicContact OE1-NZ 3.98Å; E324-K349 PolarHBondContact OE1-NZ 3.27Å; K349-I351 HydrophobicContact CG-CD1 4.47Å; K349-L357 HydrophobicContact CG-CD2 4.03Å
350Y93.3Very high90Very high1 Ų162.8 Ų62.80%0.00435%0.345CS..EExtended strand (participates in β ladder)trans-101151.3171.1167-111.8000111Q161 A162 I318 D320 E324 L327 L331 A352Q161-Y350 WeakPolarHBondContact O-CD2 3.38Å; A162-Y350 HydrophobicContact CB-CD2 4.16Å; I318-Y350 HydrophobicContact CB-CD2 4.49Å; I318-Y350 HydrophobicContact CB-CE2 3.86Å; I318-Y350 HydrophobicContact CD1-CD2 3.77Å; I318-Y350 HydrophobicContact CD1-CE2 4.02Å; I318-Y350 HydrophobicContact CG2-CD2 4.14Å; I318-Y350 HydrophobicContact CG2-CE2 3.46Å; I318-Y350 VanDerWaalsContact CG2-CE2 3.46Å; D320-Y350 VanDerWaalsContact CG-OH 3.3Å; D320-Y350 PolarHBondContact OD1-OH 3.06Å; E324-Y350 HydrophobicContact CB-CD1 4.48Å; E324-Y350 HydrophobicContact CG-CD1 3.8Å; E324-Y350 HydrophobicContact CG-CE1 4.16Å; L327-Y350 HydrophobicContact CB-CD1 4.34Å; L327-Y350 HydrophobicContact CB-CE1 4.21Å; L327-Y350 HydrophobicContact CD2-CD1 4.28Å; L327-Y350 HydrophobicContact CD2-CE1 3.56Å; L327-Y350 HydrophobicContact CD2-CE2 4.29Å; L327-Y350 WeakPolarHBondContact CD2-OH 3.36Å; L327-Y350 HydrophobicContact CG-CD1 4.28Å; L327-Y350 HydrophobicContact CG-CE1 4.04Å; L331-Y350 HydrophobicContact CD1-CD2 4.5Å; L331-Y350 HydrophobicContact CD1-CG 4.46Å; Y350-A352 HydrophobicContact CE1-CB 4.43Å
351I92.9Very high89.9Confident8 Ų862.1 Ų62.14%0.04134%0.339CS..EExtended strand (participates in β ladder)trans-130.7122.4175.8-60.3-65.9000109.2L157 G159 G160 Q161 K349 K355 L357L157-I351 HydrophobicContact CB-CG1 4.5Å; L157-I351 HydrophobicContact CD2-CB 4.32Å; L157-I351 HydrophobicContact CD2-CG1 3.46Å; L157-I351 VanDerWaalsContact CD2-CG1 3.46Å; L157-I351 HydrophobicContact CG-CB 4.49Å; L157-I351 HydrophobicContact CG-CG1 3.96Å; G159-I351 CarbonylContact C-O 3.56Å; G159-I351 WeakPolarHBondContact CA-O 3.49Å; G160-I351 PolarHBondContact N-O 3.36Å; Q161-I351 PolarHBondContact O-N 3.29Å; Q161-I351 VanDerWaalsContact O-N 3.09Å; K349-I351 HydrophobicContact CG-CD1 4.47Å; I351-K355 HydrophobicContact CG2-CB 3.58Å; I351-L357 HydrophobicContact CD1-CB 3.65Å; I351-L357 HydrophobicContact CD1-CD2 3.91Å; I351-L357 HydrophobicContact CD1-CG 4.34Å; I351-L357 HydrophobicContact CG1-CB 3.99Å
352A90.8Very high89.6Confident16 Ų1663.5 Ų63.513%0.13235%0.349CS..  trans-63.9153.2175.200000112.6G159 Y350 K355G159-A352 WeakPolarHBondContact CA-O 3.48Å; Y350-A352 HydrophobicContact CE1-CB 4.43Å; A352-K355 PolarHBondContact O-N 2.98Å
353K89.3Confident88.9Confident108 Ų10868.6 Ų68.647%0.4737%0.37SS..THydrogen-bonded Turntrans-55.8140.2177.8-69.9171.3-174.5179.60111.1I318 D319 D320 K355I318-K353 VanDerWaalsContact O-CE 3.24Å; I318-K353 WeakPolarHBondContact O-CE 3.39Å; D319-K353 IonicContact OD1-NZ 2.83Å; D319-K353 PolarHBondContact OD1-NZ 3.02Å; D320-K353 WeakPolarHBondContact OD1-CG 3.23Å; D320-K353 PolarHBondContact OD1-N 2.93Å; D320-K353 WeakPolarHBondContact OD2-CA 3.35Å; D320-K353 VanDerWaalsContact OD2-CB 3.23Å; D320-K353 WeakPolarHBondContact OD2-CB 3.34Å; D320-K353 PolarHBondContact OD2-N 3.3Å; K353-K355 VanDerWaalsContact C-N 3.31Å; K353-K355 PolarHBondContact O-N 3.26Å
354G85.2Confident87.8Confident87 Ų8772.5 Ų72.590%0.89739%0.388SS*.THydrogen-bonded Turntrans86.3-9.2-176.700000115
355K90.2Very high86.2Confident116 Ų11675.3 Ų75.350%0.50440%0.398SS..  trans-102.9163.8170.7-60-178.8-167.5171.50111.3G159 E324 I351 A352 K353G159-K355 WeakPolarHBondContact CA-O 3.33Å; G159-K355 PolarHBondContact N-O 3.33Å; E324-K355 IonicContact OE2-NZ 2.95Å; E324-K355 PolarHBondContact OE2-NZ 3.2Å; I351-K355 HydrophobicContact CG2-CB 3.58Å; A352-K355 PolarHBondContact O-N 2.98Å; K353-K355 VanDerWaalsContact C-N 3.31Å; K353-K355 PolarHBondContact O-N 3.26Å
356S90.6Very high83.9Confident79 Ų7980.4 Ų80.455%0.55243%0.43SS*.EExtended strand (participates in β ladder)trans-144.5150.9168.561.60000110.4L157L157-S356 CarbonylContact O-C 3.52Å; L157-S356 VanDerWaalsContact O-CA 3.26Å; L157-S356 WeakPolarHBondContact O-CA 3.37Å
357L91.6Very high81.3Confident74 Ų7481.7 Ų81.739%0.38744%0.44SS..EExtended strand (participates in β ladder)trans-137.8138.6179.7-175.773.4000109.8L157 K349 I351L157-L357 WeakPolarHBondContact CB-O 3.46Å; L157-L357 PolarHBondContact N-O 2.98Å; L157-L357 PolarHBondContact O-N 3.28Å; K349-L357 HydrophobicContact CG-CD2 4.03Å; I351-L357 HydrophobicContact CD1-CB 3.65Å; I351-L357 HydrophobicContact CD1-CD2 3.91Å; I351-L357 HydrophobicContact CD1-CG 4.34Å; I351-L357 HydrophobicContact CG1-CB 3.99Å
358Q89.4Confident78.5Confident114 Ų11480.6 Ų80.653%0.53345%0.445SS..EExtended strand (participates in β ladder)trans-91.4115.2170.9-168.4168.527.300109.8A154 F360A154-Q358 HydrophobicContact CB-CG 4.12Å; Q358-F360 HydrophobicContact CB-CE2 4.39Å; Q358-F360 HydrophobicContact CG-CE1 4.36Å; Q358-F360 HydrophobicContact CG-CE2 4.08Å; Q358-F360 HydrophobicContact CG-CZ 3.86Å
359A87.6Confident75.4Confident21 Ų2186.6 Ų86.617%0.17448%0.483CS..EExtended strand (participates in β ladder)trans-94.4131.6176.600000110.2A154 V155 L163 F361A154-A359 CarbonylContact C-O 3.37Å; A154-A359 WeakPolarHBondContact CA-O 3.29Å; V155-A359 PolarHBondContact N-O 2.81Å; V155-A359 PolarHBondContact O-N 3.27Å; L163-A359 HydrophobicContact CD1-CB 3.68Å; A359-F361 HydrophobicContact CB-CE2 4.16Å
360F86.6Confident72.5Confident126 Ų12693.9 Ų93.955%0.55352%0.523SS*.EExtended strand (participates in β ladder)trans-108.6133.7178.3-64.1-84.5000111R152 A154 Q358R152-F360 HydrophobicContact CB-CD1 4.43Å; A154-F360 HydrophobicContact CB-CD1 3.88Å; A154-F360 HydrophobicContact CB-CE1 3.94Å; Q358-F360 HydrophobicContact CB-CE2 4.39Å; Q358-F360 HydrophobicContact CG-CE1 4.36Å; Q358-F360 HydrophobicContact CG-CE2 4.08Å; Q358-F360 HydrophobicContact CG-CZ 3.86Å
361F84.3Confident71.5Confident36 Ų3698.5 Ų98.516%0.15855%0.549CS..EExtended strand (participates in β ladder)trans-104.3141.4-179.1-67.4-96.3000110.6R152 A153 V155 L163 L197 L199 T312 A359R152-F361 WeakPolarHBondContact CB-O 3.43Å; A153-F361 HydrophobicContact CB-CB 4.32Å; A153-F361 PolarHBondContact O-N 3.24Å; V155-F361 HydrophobicContact CB-CE2 4.11Å; V155-F361 HydrophobicContact CG2-CD2 4.43Å; V155-F361 HydrophobicContact CG2-CE2 3.83Å; L163-F361 HydrophobicContact CD1-CZ 4.37Å; L163-F361 HydrophobicContact CD2-CZ 4.1Å; L197-F361 HydrophobicContact CD2-CE1 3.75Å; L197-F361 HydrophobicContact CD2-CE2 4.05Å; L197-F361 HydrophobicContact CD2-CZ 3.33Å; L199-F361 HydrophobicContact CD1-CB 4.25Å; L199-F361 HydrophobicContact CD1-CD1 4.18Å; L199-F361 HydrophobicContact CD1-CG 4.09Å; L199-F361 HydrophobicContact CD2-CD1 4.02Å; L199-F361 HydrophobicContact CD2-CD2 3.47Å; L199-F361 VanDerWaalsContact CD2-CD2 3.47Å; L199-F361 HydrophobicContact CD2-CE1 4.12Å; L199-F361 HydrophobicContact CD2-CE2 3.6Å; L199-F361 HydrophobicContact CD2-CG 3.71Å; L199-F361 HydrophobicContact CD2-CZ 3.94Å; T312-F361 HydrophobicContact CG2-CE1 4.04Å; T312-F361 HydrophobicContact CG2-CZ 4.41Å; A359-F361 HydrophobicContact CB-CE2 4.16Å
362S77Confident70.4Confident73 Ų73103.3 Ų103.351%0.5158%0.575SS.*  trans-121.4156.3174.9-54.40000109
363E72.1Confident69.2Low117 Ų117108.1 Ų108.155%0.54760%0.6SS.*  trans-65.8143.6172.2-69.9173.7172.100110K365E363-K365 PolarHBondContact O-N 2.96Å
364D66.9Low68Low98 Ų98108.1 Ų108.152%0.52461%0.607SS.*  trans-56.7126.8173.7-69.2-15.2000108.3R311 V366R311-D364 IonicContact CZ-OD1 3.03Å; R311-D364 IonicContact CZ-OD2 3.51Å; R311-D364 IonicContact NE-OD1 2.97Å; R311-D364 IonicContact NE-OD2 3.15Å; R311-D364 PolarHBondContact NE-OD2 3.46Å; R311-D364 VanDerWaalsContact NE-OD2 3.15Å; R311-D364 IonicContact NH2-OD1 3.75Å; R311-D364 PolarHBondContact NH2-OD1 3.4Å; R311-D364 IonicContact NH2-OD2 3.23Å; R311-D364 PolarHBondContact NH2-OD2 3.23Å; D364-V366 PolarHBondContact O-N 3.16Å
365K57.5Low67Low192 Ų192109.4 Ų109.484%0.83559%0.589SS**  trans-68.893.2166.8-68.7-176.6-177177.30105.9E363 D367E363-K365 PolarHBondContact O-N 2.96Å; K365-D367 PolarHBondContact O-N 3.01Å
366V45.1Very low65.4Low127 Ų127109 Ų10977%0.7760%0.595SS**  trans-65.4100.5162.7-172.40000104.1D364 A368D364-V366 PolarHBondContact O-N 3.16Å; V366-A368 PolarHBondContact O-N 3.21Å
367D38Very low63.6Low135 Ų135111.1 Ų111.172%0.72260%0.598SS**  trans-58.596.7162.9-80-26.5000105.1K365 T369K365-D367 PolarHBondContact O-N 3.01Å; D367-T369 PolarHBondContact O-N 3Å
368A31.2Very low61.5Low81 Ų81114 Ų11467%0.66961%0.614SS**  trans-6884.2167.900000105.5V366 I370V366-A368 PolarHBondContact O-N 3.21Å; A368-I370 VanDerWaalsContact C-N 3.29Å; A368-I370 PolarHBondContact O-N 3.19Å
369T30.1Very low59.1Low135 Ų135114 Ų11483%0.82862%0.621SS**  trans-61.3100.7160.9-44.40000105.6D367D367-T369 PolarHBondContact O-N 3Å
370I33.4Very low56.6Low227 Ų227122.5 Ų122.5100%1.16466%0.662SS**  trans-64.60170.4-64.4175.1000109A368A368-I370 VanDerWaalsContact C-N 3.29Å; A368-I370 PolarHBondContact O-N 3.19Å

Retrieved 370 of 370 residues in 219.1 ms (Link to these results)