A0A077ZBC7_TRITR Loading...

60S ribosomal protein L37a

AlphaFold DB , UniProt , Accession A0A077ZBC7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 338 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
1M34.7Very low37.9Very low236 Ų236171.2 Ų171.2100%1.16390%0.902SS**  0144.20-97165.147.900108.1
2V36.8Very low37.3Very low152 Ų152163.3 Ų163.392%0.92188%0.88SS**  trans86.6116.8179-160.90000115.6
3G37.5Very low37.1Very low70 Ų70159.8 Ų159.872%0.72287%0.868SS**  trans126.112.4138.100000122.4
4L40.7Very low36.9Very low175 Ų175156.4 Ų156.492%0.91686%0.862SS**  trans-132.464-178.2-79164.3000113.8
5R42.8Very low36.9Very low243 Ų243156.4 Ų156.492%0.91786%0.859SS**  trans-151.177.3168.4-66.4-172.1-172.6176.62.1110.7
6K46.2Very low36.9Very low209 Ų209155.4 Ų155.491%0.90985%0.852SS**  trans-156.26.3171.8-120.1169.9-172.4-178.60120.5
7V39.6Very low37Very low150 Ų150158.1 Ų158.191%0.90985%0.854SS**SBendtrans-119.95.9-170.4-163.50000115.8
8A35Very low37.1Very low103 Ų103156 Ų15685%0.85185%0.853SS**SBendtrans-110.617.4-174.300000116.9
9R32.1Very low38.1Very low241 Ų241152 Ų15291%0.90983%0.828SS**  trans-135.665.6-175.7-81.4-172.1179.8163-0.9114.9
10L32.9Very low39.6Very low165 Ų165156.4 Ų156.486%0.86483%0.831SS**  trans-134.956.8171.8-101.9154.2000111.4
11V38.3Very low41.7Very low139 Ų139157 Ų15784%0.84282%0.822SS**SBendtrans-138.963.5160.7-172.60000107.6
12A31.5Very low44.4Very low77 Ų77147.5 Ų147.564%0.63678%0.779SS**  trans-170.3153.2165.500000106.6
13T33.6Very low47.1Very low118 Ų118143.7 Ų143.772%0.72476%0.759SS**  trans82.976.2170.883.10000117.7L15T13-L15 HydrophobicContact CG2-CD1 4.17Å
14S35.4Very low49.9Very low112 Ų112141.6 Ų141.678%0.78373%0.73SS**  -11580.2124.1164.50000105.8D16S14-D16 PolarHBondContact O-N 3.37Å
15L36.2Very low52.5Low156 Ų156140.5 Ų140.582%0.81772%0.715SS**  trans-78.689.1165-99.8101.8000106.6T13T13-L15 HydrophobicContact CG2-CD1 4.17Å
16D36.7Very low55Low141 Ų141129 Ų12975%0.75467%0.672SS**  trans-105.8111.7157.3-91.6-35.6000107.4S14 S18S14-D16 PolarHBondContact O-N 3.37Å; D16-S18 PolarHBondContact O-N 3.26Å
17K39.1Very low57.4Low201 Ų201124.3 Ų124.387%0.87465%0.648SS**SBendtrans25.176.5164.7-67.7176.6178.8178.40116.9
18S39.1Very low60Low120 Ų120117.2 Ų117.284%0.83961%0.605SS**  trans41.267.8147.679.50000120.1D16D16-S18 PolarHBondContact O-N 3.26Å
19E56.1Low62.8Low80 Ų80112.9 Ų112.937%0.37457%0.567SS.*  trans-102126.8142.7-75.6176.3163.600107.4R21E19-R21 HydrophobicContact CB-CG 4.22Å; E19-R21 PolarHBondContact O-N 3.42Å; E19-R21 IonicContact OE2-CZ 2.77Å; E19-R21 IonicContact OE2-NE 3.04Å; E19-R21 PolarHBondContact OE2-NE 3.29Å; E19-R21 IonicContact OE2-NH2 2.8Å; E19-R21 PolarHBondContact OE2-NH2 3.01Å
20R68Low65.6Low239 Ų239101.4 Ų101.490%0.90252%0.524SS*.  trans-61100.5171.6-69.8-176.4-177.9178.80.5107.6
21R82.5Confident68.3Low170 Ų17094 Ų9464%0.64249%0.485SS*.  trans-108.2129.2177.5-67.4-178.1-176.2176.33.5109E19 I69E19-R21 HydrophobicContact CB-CG 4.22Å; E19-R21 PolarHBondContact O-N 3.42Å; E19-R21 IonicContact OE2-CZ 2.77Å; E19-R21 IonicContact OE2-NE 3.04Å; E19-R21 PolarHBondContact OE2-NE 3.29Å; E19-R21 IonicContact OE2-NH2 2.8Å; E19-R21 PolarHBondContact OE2-NH2 3.01Å; R21-I69 VanDerWaalsContact CA-O 3.25Å; R21-I69 WeakPolarHBondContact CA-O 3.46Å
22S91.5Very high70.8Confident37 Ų3790.1 Ų90.126%0.25946%0.457SS..EExtended strand (participates in β ladder)trans-109.3150.8170.554.10000109.6E68 I69S22-E68 CarbonylContact O-C 3.07Å; S22-E68 WeakPolarHBondContact O-CA 3.42Å; S22-I69 PolarHBondContact N-O 3.23Å; S22-I69 VanDerWaalsContact N-O 3.11Å; S22-I69 PolarHBondContact O-N 3.16Å; S22-I69 WeakPolarHBondContact OG-CB 3.34Å
23S94Very high73.4Confident72 Ų7289.7 Ų89.750%0.50345%0.446SS..EExtended strand (participates in β ladder)trans-136.5132.4-178.4-56.30000109.9L67S23-L67 CarbonylContact C-O 3.52Å; S23-L67 WeakPolarHBondContact CA-O 3.48Å
24F95.8Very high75.8Confident25 Ų2584.1 Ų84.111%0.1141%0.412CS..EExtended strand (participates in β ladder)trans-126.3138.5-177.4-61.6-94.1000109.8V26 T66 L67 I69 T145 L148 L149F24-V26 HydrophobicContact CB-CG1 4.08Å; F24-T66 CarbonylContact O-C 3.45Å; F24-T66 WeakPolarHBondContact O-CA 3.28Å; F24-L67 HydrophobicContact CD2-CD2 4.46Å; F24-L67 PolarHBondContact N-O 3.49Å; F24-L67 PolarHBondContact O-N 3.44Å; F24-I69 HydrophobicContact CD2-CD1 4.26Å; F24-I69 HydrophobicContact CE2-CD1 3.87Å; F24-I69 HydrophobicContact CE2-CG1 4.48Å; F24-T145 HydrophobicContact CD1-CG2 3.95Å; F24-T145 HydrophobicContact CE1-CG2 4.46Å; F24-L148 HydrophobicContact CE1-CB 4.2Å; F24-L149 HydrophobicContact CB-CD1 4.44Å; F24-L149 HydrophobicContact CD1-CB 4.15Å; F24-L149 HydrophobicContact CD1-CD1 4.42Å; F24-L149 HydrophobicContact CD2-CD1 3.61Å; F24-L149 HydrophobicContact CE1-CB 4.07Å; F24-L149 HydrophobicContact CE2-CD1 3.86Å; F24-L149 HydrophobicContact CG-CB 4.46Å; F24-L149 HydrophobicContact CG-CD1 3.91Å; F24-L149 HydrophobicContact CZ-CB 4.32Å; F24-L149 HydrophobicContact CZ-CD1 4.37Å
25Y95.4Very high77.8Confident153 Ų15383.8 Ų83.860%0.641%0.407SS*.EExtended strand (participates in β ladder)trans-91.9120.2170.7-65.9-73.4000109.1T66Y25-T66 HydrophobicContact CE1-CG2 4.48Å; Y25-T66 WeakPolarHBondContact CE1-OG1 3.44Å
26V96.3Very high79.6Confident1 Ų178 Ų781%0.00638%0.377CS..EExtended strand (participates in β ladder)trans-134.7157.6-171.4-60.40000112.4F24 L65 L67 V138 L149F24-V26 HydrophobicContact CB-CG1 4.08Å; V26-L65 HydrophobicContact CG2-CD1 3.45Å; V26-L65 VanDerWaalsContact CG2-CD1 3.45Å; V26-L65 HydrophobicContact CG2-CG 4.17Å; V26-L65 PolarHBondContact N-O 3.33Å; V26-L65 PolarHBondContact O-N 3.44Å; V26-L67 HydrophobicContact CG2-CB 3.97Å; V26-L67 HydrophobicContact CG2-CD1 4.48Å; V26-V138 HydrophobicContact CB-CB 4.15Å; V26-V138 HydrophobicContact CB-CG1 4.4Å; V26-V138 HydrophobicContact CG2-CB 4.19Å; V26-V138 HydrophobicContact CG2-CG1 3.89Å; V26-L149 HydrophobicContact CG1-CD2 4.23Å
27W95.9Very high81.4Confident110 Ų11074.4 Ų74.442%0.41736%0.357SS..EExtended strand (participates in β ladder)trans-93.2107.4166.8-64100.6000108.9F29 P62 K64 V138 R139W27-F29 HydrophobicContact CB-CE2 4.35Å; W27-P62 HydrophobicContact CB-CB 3.95Å; W27-P62 HydrophobicContact CD2-CG 4.44Å; W27-P62 HydrophobicContact CE3-CB 4.01Å; W27-P62 HydrophobicContact CE3-CG 3.83Å; W27-P62 HydrophobicContact CZ3-CG 4.47Å; W27-K64 HydrophobicContact CE3-CB 4.09Å; W27-K64 HydrophobicContact CH2-CB 4.45Å; W27-K64 HydrophobicContact CH2-CD 4.4Å; W27-K64 HydrophobicContact CZ3-CB 3.93Å; W27-V138 CarbonylContact O-C 3.6Å; W27-V138 VanDerWaalsContact O-CA 3.32Å; W27-V138 WeakPolarHBondContact O-CA 3.47Å; W27-R139 HydrophobicContact CB-CB 4.25Å; W27-R139 PolarHBondContact N-O 3Å; W27-R139 PolarHBondContact O-N 3.26Å
28F94.8Very high82.6Confident1 Ų165.3 Ų65.30%0.00432%0.32CS..EExtended strand (participates in β ladder)trans-91.4120.7-179.7-178.8-116000110.8F31 I63 L65 L76 A136 V138 F253F28-F31 HydrophobicContact CE1-CD2 4.38Å; F28-F31 HydrophobicContact CE1-CE2 4.09Å; F28-F31 HydrophobicContact CE2-CE2 4.47Å; F28-F31 HydrophobicContact CE2-CZ 4.42Å; F28-F31 AromaticContact CZ-CD2 3.79Å; F28-F31 HydrophobicContact CZ-CD2 3.79Å; F28-F31 HydrophobicContact CZ-CE1 4.34Å; F28-F31 AromaticContact CZ-CE2 3.43Å; F28-F31 HydrophobicContact CZ-CE2 3.43Å; F28-F31 VanDerWaalsContact CZ-CE2 3.43Å; F28-F31 HydrophobicContact CZ-CG 4.39Å; F28-F31 AromaticContact CZ-CZ 3.74Å; F28-F31 HydrophobicContact CZ-CZ 3.74Å; F28-I63 WeakPolarHBondContact CB-O 3.5Å; F28-I63 PolarHBondContact N-O 3.28Å; F28-I63 PolarHBondContact O-N 3.43Å; F28-L65 HydrophobicContact CB-CD1 4.43Å; F28-L65 HydrophobicContact CB-CD2 3.25Å; F28-L65 HydrophobicContact CB-CG 3.71Å; F28-L65 HydrophobicContact CD1-CD2 3.63Å; F28-L65 HydrophobicContact CD2-CD2 4.23Å; F28-L65 HydrophobicContact CE1-CD2 4.45Å; F28-L65 HydrophobicContact CG-CD2 3.48Å; F28-L65 VanDerWaalsContact CG-CD2 3.48Å; F28-L65 HydrophobicContact CG-CG 4.41Å; F28-L76 HydrophobicContact CD2-CD1 4.3Å; F28-L76 HydrophobicContact CE1-CD1 4.25Å; F28-L76 HydrophobicContact CE2-CD1 3.61Å; F28-L76 HydrophobicContact CZ-CD1 3.56Å; F28-A136 HydrophobicContact CE2-CB 4.32Å; F28-V138 HydrophobicContact CB-CG1 4.43Å; F28-V138 HydrophobicContact CD2-CG1 3.7Å; F28-F253 HydrophobicContact CD1-CD1 4.18Å; F28-F253 HydrophobicContact CD1-CE1 4.23Å; F28-F253 AromaticContact CE1-CD1 3.97Å; F28-F253 HydrophobicContact CE1-CD1 3.97Å; F28-F253 HydrophobicContact CE1-CE1 4.41Å
29F94Very high83.8Confident13 Ų1363.2 Ų63.26%0.05731%0.31CS..EExtended strand (participates in β ladder)trans-91.5-29.7176.8-64.1-93.1000112W27 T57 P62 F116 L137 R139 R255 F256W27-F29 HydrophobicContact CB-CE2 4.35Å; F29-T57 HydrophobicContact CB-CG2 4.12Å; F29-T57 HydrophobicContact CD1-CG2 3.71Å; F29-T57 HydrophobicContact CD2-CG2 4.2Å; F29-T57 HydrophobicContact CE1-CG2 4.13Å; F29-T57 HydrophobicContact CG-CG2 3.73Å; F29-P62 HydrophobicContact CD1-CB 4Å; F29-P62 HydrophobicContact CE1-CB 3.75Å; F29-P62 HydrophobicContact CE1-CG 4.08Å; F29-P62 HydrophobicContact CE2-CB 4.32Å; F29-P62 HydrophobicContact CG-CB 4.43Å; F29-P62 HydrophobicContact CZ-CB 3.93Å; F29-P62 HydrophobicContact CZ-CG 4.29Å; F29-F116 HydrophobicContact CD2-CE1 4.05Å; F29-F116 HydrophobicContact CE2-CD1 4.3Å; F29-F116 AromaticContact CE2-CE1 3.48Å; F29-F116 HydrophobicContact CE2-CE1 3.48Å; F29-F116 VanDerWaalsContact CE2-CE1 3.48Å; F29-F116 HydrophobicContact CE2-CZ 4.14Å; F29-F116 AromaticContact CZ-CE1 3.81Å; F29-F116 HydrophobicContact CZ-CE1 3.81Å; F29-F116 HydrophobicContact CZ-CZ 4.08Å; F29-L137 PolarHBondContact N-O 3.32Å; F29-R139 HydrophobicContact CE2-CB 3.56Å; F29-R139 HydrophobicContact CZ-CB 4.26Å; F29-R255 CarbonylContact C-O 3.56Å; F29-R255 VanDerWaalsContact C-O 3.3Å; F29-R255 CarbonylContact O-C 3.57Å; F29-F256 HydrophobicContact CB-CD2 3.75Å; F29-F256 HydrophobicContact CB-CE2 3.33Å; F29-F256 HydrophobicContact CB-CZ 4.36Å; F29-F256 HydrophobicContact CG-CE2 4.29Å; F29-F256 WeakPolarHBondContact O-CD2 3.36Å
30G91.6Very high84.2Confident0 Ų063.4 Ų63.40%033%0.325CS..EExtended strand (participates in β ladder)trans113.1-147.8157.900000115.9L137 R255G30-L137 PolarHBondContact O-N 2.93Å; G30-R255 CarbonylContact C-O 3.56Å; G30-R255 WeakPolarHBondContact CA-O 3.41Å; G30-R255 PolarHBondContact N-O 3.18Å
31F89.6Confident84.4Confident8 Ų854.1 Ų54.14%0.03530%0.297CS..EExtended strand (participates in β ladder)trans-98.3131.7-166.2-61.9-78.5000112.5F28 L76 L98 E134 L135 A136 R255 F256F28-F31 HydrophobicContact CE1-CD2 4.38Å; F28-F31 HydrophobicContact CE1-CE2 4.09Å; F28-F31 HydrophobicContact CE2-CE2 4.47Å; F28-F31 HydrophobicContact CE2-CZ 4.42Å; F28-F31 AromaticContact CZ-CD2 3.79Å; F28-F31 HydrophobicContact CZ-CD2 3.79Å; F28-F31 HydrophobicContact CZ-CE1 4.34Å; F28-F31 AromaticContact CZ-CE2 3.43Å; F28-F31 HydrophobicContact CZ-CE2 3.43Å; F28-F31 VanDerWaalsContact CZ-CE2 3.43Å; F28-F31 HydrophobicContact CZ-CG 4.39Å; F28-F31 AromaticContact CZ-CZ 3.74Å; F28-F31 HydrophobicContact CZ-CZ 3.74Å; F31-L76 HydrophobicContact CE2-CD1 4.34Å; F31-L76 HydrophobicContact CZ-CD1 3.79Å; F31-L98 HydrophobicContact CE1-CD2 3.81Å; F31-L98 HydrophobicContact CZ-CD2 3.95Å; F31-E134 HydrophobicContact CB-CG 4.11Å; F31-E134 HydrophobicContact CD1-CG 4.06Å; F31-E134 HydrophobicContact CG-CG 4.5Å; F31-L135 CarbonylContact C-O 3.44Å; F31-L135 VanDerWaalsContact CA-O 3.29Å; F31-L135 WeakPolarHBondContact CA-O 3.35Å; F31-A136 HydrophobicContact CD1-CB 3.79Å; F31-A136 HydrophobicContact CE1-CB 3.65Å; F31-R255 PolarHBondContact N-O 3.27Å; F31-F256 WeakPolarHBondContact O-CB 3.32Å; F31-F256 PolarHBondContact O-N 3.09Å
32K89.3Confident84.2Confident59 Ų5949.4 Ų49.426%0.25729%0.29SS..EExtended strand (participates in β ladder)trans-128.3123.9173.9-176.4-178.4178.6-1720109.6L34 A53 L135 F256K32-L34 HydrophobicContact CD-CD2 4.31Å; K32-L34 HydrophobicContact CG-CD2 4.48Å; K32-A53 HydrophobicContact CD-CB 3.97Å; K32-L135 HydrophobicContact CB-CB 4.46Å; K32-L135 PolarHBondContact N-O 3.22Å; K32-L135 WeakPolarHBondContact O-CB 2.77Å; K32-L135 PolarHBondContact O-N 3.42Å; K32-F256 HydrophobicContact CB-CB 4.13Å
33T86.9Confident83.7Confident67 Ų6752.7 Ų52.741%0.41131%0.308SS..EExtended strand (participates in β ladder)trans-74.2128.8168.8-49.20000109.1L132 T133T33-L132 HydrophobicContact CG2-CB 3.92Å; T33-L132 HydrophobicContact CG2-CD1 4.02Å; T33-L132 HydrophobicContact CG2-CD2 4.41Å; T33-L132 HydrophobicContact CG2-CG 4.34Å; T33-T133 CarbonylContact C-O 3.6Å; T33-T133 WeakPolarHBondContact CA-O 3.31Å
34L84.7Confident83.2Confident1 Ų156.8 Ų56.81%0.00532%0.319CS..EExtended strand (participates in β ladder)trans-92.4141.8172.8-58.9-178.5000109.2K32 I36 L46 Q49 L120 T133 L135K32-L34 HydrophobicContact CD-CD2 4.31Å; K32-L34 HydrophobicContact CG-CD2 4.48Å; L34-I36 PolarHBondContact O-N 3.47Å; L34-L46 HydrophobicContact CD1-CD1 4.29Å; L34-Q49 HydrophobicContact CD1-CB 4.26Å; L34-Q49 HydrophobicContact CD2-CB 4.24Å; L34-L120 HydrophobicContact CD1-CD2 4.21Å; L34-T133 HydrophobicContact CB-CG2 4.45Å; L34-T133 HydrophobicContact CD1-CG2 3.99Å; L34-T133 HydrophobicContact CG-CG2 4.45Å; L34-T133 PolarHBondContact N-O 3.25Å; L34-L135 HydrophobicContact CD1-CB 4.28Å; L34-L135 HydrophobicContact CD2-CB 4.46Å; L34-L135 HydrophobicContact CD2-CD2 4.42Å; L34-L135 HydrophobicContact CG-CB 4.19Å
35P75.7Confident82.6Confident105 Ų10557.4 Ų57.468%0.68233%0.329SS*.SBendtrans-75.612.4179.233-35.7000113
36I73.8Confident82.2Confident36 Ų3650.5 Ų50.519%0.18530%0.303CS..SBendtrans-120.5138.7-169.6-57.9-171.7000108.7L34 A38 S41 Q49 T133L34-I36 PolarHBondContact O-N 3.47Å; I36-A38 PolarHBondContact O-N 2.96Å; I36-S41 VanDerWaalsContact CG2-CB 3.47Å; I36-S41 WeakPolarHBondContact CG2-OG 3.4Å; I36-Q49 HydrophobicContact CD1-CG 3.66Å; I36-T133 WeakPolarHBondContact O-CB 3.43Å; I36-T133 PolarHBondContact O-OG1 3.21Å
37N74.5Confident81.7Confident64 Ų6454.8 Ų54.834%0.34233%0.325SS..  trans-80.293.5162.8-173.1-8.9000108.2A39 A40 S41N37-A39 PolarHBondContact O-N 3.27Å; N37-A39 WeakPolarHBondContact OD1-CB 3.38Å; N37-A39 PolarHBondContact OD1-N 2.94Å; N37-A40 PolarHBondContact O-N 3.35Å; N37-S41 PolarHBondContact O-N 2.79Å; N37-S41 PolarHBondContact O-OG 3.2Å
38A66.1Low81.3Confident11 Ų1151.6 Ų51.69%0.09133%0.326CS..THydrogen-bonded Turntrans-65.4-17.5-174.900000113.2I36 A40 L46 F104 T133I36-A38 PolarHBondContact O-N 2.96Å; A38-A40 VanDerWaalsContact C-N 3.27Å; A38-A40 PolarHBondContact O-N 3.26Å; A38-L46 HydrophobicContact CB-CD1 3.56Å; A38-L46 HydrophobicContact CB-CD2 4.43Å; A38-F104 HydrophobicContact CB-CE2 3.52Å; A38-F104 HydrophobicContact CB-CZ 3.44Å; A38-F104 VanDerWaalsContact CB-CZ 3.44Å; A38-T133 HydrophobicContact CB-CG2 3.88Å; A38-T133 VanDerWaalsContact CB-OG1 3.31Å; A38-T133 WeakPolarHBondContact CB-OG1 3.32Å; A38-T133 PolarHBondContact N-OG1 2.88Å
39A63.4Low81Confident75 Ų7554.2 Ų54.262%0.6234%0.338SS*.THydrogen-bonded Turntrans-69.2-26.5172.100000112.6N37N37-A39 PolarHBondContact O-N 3.27Å; N37-A39 WeakPolarHBondContact OD1-CB 3.38Å; N37-A39 PolarHBondContact OD1-N 2.94Å
40A65.5Low80.8Confident84 Ų8453.7 Ų53.769%0.69434%0.336SS*.THydrogen-bonded Turntrans-106.9-4.1-178.100000113.6N37 A38N37-A40 PolarHBondContact O-N 3.35Å; A38-A40 VanDerWaalsContact C-N 3.27Å; A38-A40 PolarHBondContact O-N 3.26Å
41S71Confident80.8Confident45 Ų4555.7 Ų55.732%0.31535%0.352SS..SBendtrans-100.7153.8-170.3-60.20000112.3I36 N37I36-S41 VanDerWaalsContact CG2-CB 3.47Å; I36-S41 WeakPolarHBondContact CG2-OG 3.4Å; N37-S41 PolarHBondContact O-N 2.79Å; N37-S41 PolarHBondContact O-OG 3.2Å
42S78.4Confident80.8Confident71 Ų7157.7 Ų57.750%0.49737%0.371SS..  trans-59.6144.7176.463.70000111E44 A45 L46S42-E44 PolarHBondContact O-N 3.19Å; S42-A45 PolarHBondContact O-N 3.01Å; S42-A45 VanDerWaalsContact O-N 3.16Å; S42-A45 WeakPolarHBondContact OG-CB 2.83Å; S42-A45 PolarHBondContact OG-N 3.18Å; S42-L46 PolarHBondContact O-N 3.25Å
43T81.5Confident80.9Confident105 Ų10554.9 Ų54.964%0.64436%0.358SS*.Hα-helixtrans-55.2-38.2176.845.50000111.6L46 I47T43-L46 WeakPolarHBondContact O-CB 3.45Å; T43-L46 PolarHBondContact O-N 3.06Å; T43-I47 VanDerWaalsContact O-CG1 3.28Å; T43-I47 WeakPolarHBondContact O-CG1 3.46Å; T43-I47 PolarHBondContact O-N 3.21Å
44E83Confident81.1Confident158 Ų15852 Ų5274%0.73834%0.34SS*.Hα-helixtrans-62.8-44.5177-64.4-174.3166.800113.1S42 L46 I47 G48S42-E44 PolarHBondContact O-N 3.19Å; E44-L46 PolarHBondContact O-N 2.98Å; E44-I47 PolarHBondContact O-N 3.26Å; E44-G48 PolarHBondContact O-N 3.18Å
45A83.9Confident81.4Confident38 Ų3854.2 Ų54.231%0.31436%0.359SS..Hα-helixtrans-62.3-37.5177.700000111.1S42 G48 Q49S42-A45 PolarHBondContact O-N 3.01Å; S42-A45 VanDerWaalsContact O-N 3.16Å; S42-A45 WeakPolarHBondContact OG-CB 2.83Å; S42-A45 PolarHBondContact OG-N 3.18Å; A45-G48 PolarHBondContact O-N 2.81Å; A45-Q49 WeakPolarHBondContact O-CG 3.42Å; A45-Q49 PolarHBondContact O-N 3.11Å; A45-Q49 VanDerWaalsContact O-N 3.09Å
46L85.7Confident82.1Confident8 Ų851.1 Ų51.14%0.04234%0.342CS..Hα-helixtrans-65-47.1176.4-166.462.2000112L34 A38 S42 T43 E44 G48 Q49 V50 L120L34-L46 HydrophobicContact CD1-CD1 4.29Å; A38-L46 HydrophobicContact CB-CD1 3.56Å; A38-L46 HydrophobicContact CB-CD2 4.43Å; S42-L46 PolarHBondContact O-N 3.25Å; T43-L46 WeakPolarHBondContact O-CB 3.45Å; T43-L46 PolarHBondContact O-N 3.06Å; E44-L46 PolarHBondContact O-N 2.98Å; L46-G48 VanDerWaalsContact C-N 3.3Å; L46-G48 PolarHBondContact O-N 3.47Å; L46-Q49 PolarHBondContact O-N 3.42Å; L46-V50 WeakPolarHBondContact O-CG2 3.34Å; L46-V50 PolarHBondContact O-N 3.04Å; L46-L120 HydrophobicContact CD1-CD2 3.4Å; L46-L120 HydrophobicContact CD2-CD1 4.47Å; L46-L120 HydrophobicContact CD2-CD2 3.94Å; L46-L120 HydrophobicContact CG-CD2 3.92Å
47I86.9Confident82.8Confident92 Ų9249.9 Ų49.947%0.47234%0.336SS..Hα-helixtrans-58.6-44.4177.3-68.6163.9000110.1T43 E44 Q49 V50 A51T43-I47 VanDerWaalsContact O-CG1 3.28Å; T43-I47 WeakPolarHBondContact O-CG1 3.46Å; T43-I47 PolarHBondContact O-N 3.21Å; E44-I47 PolarHBondContact O-N 3.26Å; I47-Q49 PolarHBondContact O-N 2.88Å; I47-V50 PolarHBondContact O-N 3.26Å; I47-A51 WeakPolarHBondContact O-CB 3.37Å; I47-A51 PolarHBondContact O-N 2.7Å
48G87.5Confident83.2Confident42 Ų4253.1 Ų53.143%0.43335%0.352SS..Hα-helixtrans-59.4-42.4176.200000113.2E44 A45 L46 A51 A52E44-G48 PolarHBondContact O-N 3.18Å; A45-G48 PolarHBondContact O-N 2.81Å; L46-G48 VanDerWaalsContact C-N 3.3Å; L46-G48 PolarHBondContact O-N 3.47Å; G48-A51 PolarHBondContact O-N 3.43Å; G48-A52 WeakPolarHBondContact O-CB 3.31Å; G48-A52 PolarHBondContact O-N 2.86Å
49Q88.9Confident84.1Confident56 Ų5662.2 Ų62.226%0.26239%0.39SS..Hα-helixtrans-67.4-39176.4-71.6-62.4-25.300113L34 I36 A45 L46 I47 A52 A53L34-Q49 HydrophobicContact CD1-CB 4.26Å; L34-Q49 HydrophobicContact CD2-CB 4.24Å; I36-Q49 HydrophobicContact CD1-CG 3.66Å; A45-Q49 WeakPolarHBondContact O-CG 3.42Å; A45-Q49 PolarHBondContact O-N 3.11Å; A45-Q49 VanDerWaalsContact O-N 3.09Å; L46-Q49 PolarHBondContact O-N 3.42Å; I47-Q49 PolarHBondContact O-N 2.88Å; Q49-A52 PolarHBondContact O-N 3.45Å; Q49-A53 WeakPolarHBondContact O-CB 3.38Å; Q49-A53 PolarHBondContact O-N 2.86Å
50V90Very high85.1Confident3 Ų360 Ų602%0.01837%0.368CS..Hα-helixtrans-64.5-46.1175.6170.90000110.2L46 I47 A52 A53 I54 V107 A118 L135L46-V50 WeakPolarHBondContact O-CG2 3.34Å; L46-V50 PolarHBondContact O-N 3.04Å; I47-V50 PolarHBondContact O-N 3.26Å; V50-A52 VanDerWaalsContact C-N 3.35Å; V50-A52 PolarHBondContact O-N 3.38Å; V50-A53 WeakPolarHBondContact O-CB 3.29Å; V50-A53 PolarHBondContact O-N 2.91Å; V50-A53 VanDerWaalsContact O-N 3.11Å; V50-I54 HydrophobicContact CG1-CD1 3.94Å; V50-I54 HydrophobicContact CG1-CG1 4.47Å; V50-I54 WeakPolarHBondContact O-CG1 3.44Å; V50-I54 PolarHBondContact O-N 3.27Å; V50-V107 HydrophobicContact CG1-CB 4.43Å; V50-V107 HydrophobicContact CG1-CG1 4.09Å; V50-V107 HydrophobicContact CG2-CB 4.39Å; V50-V107 HydrophobicContact CG2-CG1 4.5Å; V50-V107 HydrophobicContact CG2-CG2 4.48Å; V50-A118 HydrophobicContact CB-CB 4.49Å; V50-A118 HydrophobicContact CG1-CB 3.55Å; V50-A118 HydrophobicContact CG2-CB 4.07Å; V50-L135 HydrophobicContact CG2-CD1 4.16Å
51A90.6Very high86.2Confident41 Ų4162.5 Ų62.534%0.33937%0.37SS..Hα-helixtrans-59.3-44.3175.900000111.9I47 G48 A53 I54 A55I47-A51 WeakPolarHBondContact O-CB 3.37Å; I47-A51 PolarHBondContact O-N 2.7Å; G48-A51 PolarHBondContact O-N 3.43Å; A51-A53 VanDerWaalsContact C-N 3.32Å; A51-A53 PolarHBondContact O-N 2.9Å; A51-I54 PolarHBondContact O-N 3.1Å; A51-A55 PolarHBondContact O-N 3.28Å
52A90.3Very high87.1Confident51 Ų5162.2 Ų62.242%0.42137%0.367SS..Hα-helixtrans-63.7-36.5175.100000112.5G48 Q49 V50 A56G48-A52 WeakPolarHBondContact O-CB 3.31Å; G48-A52 PolarHBondContact O-N 2.86Å; Q49-A52 PolarHBondContact O-N 3.45Å; V50-A52 VanDerWaalsContact C-N 3.35Å; V50-A52 PolarHBondContact O-N 3.38Å; A52-A56 WeakPolarHBondContact O-CB 3.43Å; A52-A56 PolarHBondContact O-N 2.78Å; A52-A56 VanDerWaalsContact O-N 3.1Å
53A90.6Very high87.7Confident0 Ų060.3 Ų60.30%035%0.35CS..Hα-helixtrans-67.4-41.1174.600000112.1K32 Q49 V50 A51 A56 T57 L135 F256K32-A53 HydrophobicContact CD-CB 3.97Å; Q49-A53 WeakPolarHBondContact O-CB 3.38Å; Q49-A53 PolarHBondContact O-N 2.86Å; V50-A53 WeakPolarHBondContact O-CB 3.29Å; V50-A53 PolarHBondContact O-N 2.91Å; V50-A53 VanDerWaalsContact O-N 3.11Å; A51-A53 VanDerWaalsContact C-N 3.32Å; A51-A53 PolarHBondContact O-N 2.9Å; A53-A56 PolarHBondContact O-N 3.39Å; A53-T57 PolarHBondContact O-N 3.09Å; A53-L135 HydrophobicContact CB-CD2 3.32Å; A53-F256 WeakPolarHBondContact O-CZ 3.5Å
54I92.3Very high88.1Confident5 Ų561.5 Ų61.53%0.02635%0.347CS..Hα-helixtrans-61-47.6173.6-67.4166.4000110.2V50 A51 A56 T57 Y113 F116 L137V50-I54 HydrophobicContact CG1-CD1 3.94Å; V50-I54 HydrophobicContact CG1-CG1 4.47Å; V50-I54 WeakPolarHBondContact O-CG1 3.44Å; V50-I54 PolarHBondContact O-N 3.27Å; A51-I54 PolarHBondContact O-N 3.1Å; I54-A56 PolarHBondContact O-N 3.26Å; I54-T57 VanDerWaalsContact O-CB 3.23Å; I54-T57 WeakPolarHBondContact O-CB 3.45Å; I54-T57 VanDerWaalsContact O-CG2 3.25Å; I54-T57 WeakPolarHBondContact O-CG2 3.39Å; I54-T57 PolarHBondContact O-N 3.26Å; I54-T57 PolarHBondContact O-OG1 3.22Å; I54-Y113 HydrophobicContact CG2-CD1 3.76Å; I54-Y113 HydrophobicContact CG2-CD2 3.84Å; I54-Y113 HydrophobicContact CG2-CE1 4.26Å; I54-Y113 HydrophobicContact CG2-CE2 4.32Å; I54-Y113 HydrophobicContact CG2-CG 3.52Å; I54-F116 HydrophobicContact CD1-CB 3.94Å; I54-F116 HydrophobicContact CD1-CG 4.42Å; I54-F116 HydrophobicContact CG1-CB 4.25Å; I54-F116 HydrophobicContact CG1-CD1 4.21Å; I54-F116 HydrophobicContact CG1-CG 4.31Å; I54-F116 HydrophobicContact CG2-CD1 4.19Å; I54-F116 HydrophobicContact CG2-CD2 4.24Å; I54-F116 HydrophobicContact CG2-CE1 4.29Å; I54-F116 HydrophobicContact CG2-CE2 4.35Å; I54-F116 HydrophobicContact CG2-CG 4.15Å; I54-F116 HydrophobicContact CG2-CZ 4.36Å; I54-L137 HydrophobicContact CG1-CD1 3.88Å; I54-L137 HydrophobicContact CG1-CD2 3.94Å
55A89.9Confident88.6Confident48 Ų4854.1 Ų54.140%0.39731%0.312SS..Hα-helixtrans-59.2-35.6177.400000112.6A51 T57 I58A51-A55 PolarHBondContact O-N 3.28Å; A55-T57 PolarHBondContact O-N 3.5Å; A55-I58 WeakPolarHBondContact O-CD1 3.38Å; A55-I58 WeakPolarHBondContact O-CG1 3.5Å
56A89.8Confident89.1Confident41 Ų4153.6 Ų53.634%0.33931%0.305SS..Hα-helixtrans-68.6-15.9177.100000113.8A52 A53 I54 I58 K59 F256A52-A56 WeakPolarHBondContact O-CB 3.43Å; A52-A56 PolarHBondContact O-N 2.78Å; A52-A56 VanDerWaalsContact O-N 3.1Å; A53-A56 PolarHBondContact O-N 3.39Å; I54-A56 PolarHBondContact O-N 3.26Å; A56-I58 PolarHBondContact O-N 2.86Å; A56-K59 PolarHBondContact O-N 3.46Å; A56-F256 HydrophobicContact CB-CE1 3.81Å; A56-F256 HydrophobicContact CB-CZ 4.31Å
57T88.4Confident89.6Confident10 Ų1053.2 Ų53.26%0.06130%0.303CS..G310 helixtrans-64.7-24.2179.964.20000113.3F29 A53 I54 A55 K59 V60 F116 L137 F256F29-T57 HydrophobicContact CB-CG2 4.12Å; F29-T57 HydrophobicContact CD1-CG2 3.71Å; F29-T57 HydrophobicContact CD2-CG2 4.2Å; F29-T57 HydrophobicContact CE1-CG2 4.13Å; F29-T57 HydrophobicContact CG-CG2 3.73Å; A53-T57 PolarHBondContact O-N 3.09Å; I54-T57 VanDerWaalsContact O-CB 3.23Å; I54-T57 WeakPolarHBondContact O-CB 3.45Å; I54-T57 VanDerWaalsContact O-CG2 3.25Å; I54-T57 WeakPolarHBondContact O-CG2 3.39Å; I54-T57 PolarHBondContact O-N 3.26Å; I54-T57 PolarHBondContact O-OG1 3.22Å; A55-T57 PolarHBondContact O-N 3.5Å; T57-K59 PolarHBondContact O-N 3.04Å; T57-V60 PolarHBondContact O-N 3.02Å; T57-F116 HydrophobicContact CG2-CE1 4.05Å; T57-L137 HydrophobicContact CG2-CD2 3.29Å; T57-L137 HydrophobicContact CG2-CG 4.42Å; T57-F256 HydrophobicContact CG2-CE2 3.63Å; T57-F256 HydrophobicContact CG2-CZ 3.44Å; T57-F256 VanDerWaalsContact CG2-CZ 3.44Å
58I84.5Confident89.9Confident132 Ų13251.4 Ų51.468%0.67729%0.293SS*.G310 helixtrans-56-28.5-176.9-62.2170.2000111.5A55 A56A55-I58 WeakPolarHBondContact O-CD1 3.38Å; A55-I58 WeakPolarHBondContact O-CG1 3.5Å; A56-I58 PolarHBondContact O-N 2.86Å
59K84.5Confident90.3Very high201 Ų20149.8 Ų49.887%0.87427%0.274SS*.G310 helixtrans-92.5-3.4-179.9-59.5179.4-177.4176.80113.6A56 T57A56-K59 PolarHBondContact O-N 3.46Å; T57-K59 PolarHBondContact O-N 3.04Å
60V84.9Confident90.4Very high28 Ų2848.3 Ų48.317%0.1727%0.27CS..SBendtrans-112.7126.6-171.7-177.20000109.8T57 P62 F256T57-V60 PolarHBondContact O-N 3.02Å; V60-P62 WeakPolarHBondContact O-CD 3.28Å; V60-F256 HydrophobicContact CG2-CD1 4.05Å; V60-F256 HydrophobicContact CG2-CE1 3.71Å; V60-F256 HydrophobicContact CG2-CZ 4.1Å
61L87.4Confident90.3Very high138 Ų13852.3 Ų52.372%0.72329%0.288SS*.  trans-73.5119.1171.8-173.373000109.4
62P91.3Very high90.1Very high39 Ų3951.9 Ų51.925%0.25329%0.285SS..  trans-71.2157.8-179.828.6-34.6000112.3W27 F29 V60W27-P62 HydrophobicContact CB-CB 3.95Å; W27-P62 HydrophobicContact CD2-CG 4.44Å; W27-P62 HydrophobicContact CE3-CB 4.01Å; W27-P62 HydrophobicContact CE3-CG 3.83Å; W27-P62 HydrophobicContact CZ3-CG 4.47Å; F29-P62 HydrophobicContact CD1-CB 4Å; F29-P62 HydrophobicContact CE1-CB 3.75Å; F29-P62 HydrophobicContact CE1-CG 4.08Å; F29-P62 HydrophobicContact CE2-CB 4.32Å; F29-P62 HydrophobicContact CG-CB 4.43Å; F29-P62 HydrophobicContact CZ-CB 3.93Å; F29-P62 HydrophobicContact CZ-CG 4.29Å; V60-P62 WeakPolarHBondContact O-CD 3.28Å
63I89.2Confident90.2Very high30 Ų3049.6 Ų49.615%0.15427%0.266CS..EExtended strand (participates in β ladder)trans-107.2122.8175.5-60174.6000108.5F28 L65 Q78 F253F28-I63 WeakPolarHBondContact CB-O 3.5Å; F28-I63 PolarHBondContact N-O 3.28Å; F28-I63 PolarHBondContact O-N 3.43Å; I63-L65 PolarHBondContact O-N 3.28Å; I63-Q78 VanDerWaalsContact CG2-CD 3.45Å; I63-Q78 VanDerWaalsContact CG2-NE2 3.25Å; I63-Q78 VanDerWaalsContact CG2-OE1 3.28Å; I63-F253 HydrophobicContact CG2-CE1 4.29Å
64K91.6Very high90.3Very high131 Ų13149.6 Ų49.657%0.5727%0.266SS*.EExtended strand (participates in β ladder)trans-75.2124.8172.5-170.2172.6-177.9173.70110W27W27-K64 HydrophobicContact CE3-CB 4.09Å; W27-K64 HydrophobicContact CH2-CB 4.45Å; W27-K64 HydrophobicContact CH2-CD 4.4Å; W27-K64 HydrophobicContact CZ3-CB 3.93Å
65L93.2Very high90.4Very high3 Ų352 Ų522%0.01628%0.277CS..EExtended strand (participates in β ladder)trans-146.4169.3178.363.678.5000111.9V26 F28 I63 L67 L76 V77 Q78 F253V26-L65 HydrophobicContact CG2-CD1 3.45Å; V26-L65 VanDerWaalsContact CG2-CD1 3.45Å; V26-L65 HydrophobicContact CG2-CG 4.17Å; V26-L65 PolarHBondContact N-O 3.33Å; V26-L65 PolarHBondContact O-N 3.44Å; F28-L65 HydrophobicContact CB-CD1 4.43Å; F28-L65 HydrophobicContact CB-CD2 3.25Å; F28-L65 HydrophobicContact CB-CG 3.71Å; F28-L65 HydrophobicContact CD1-CD2 3.63Å; F28-L65 HydrophobicContact CD2-CD2 4.23Å; F28-L65 HydrophobicContact CE1-CD2 4.45Å; F28-L65 HydrophobicContact CG-CD2 3.48Å; F28-L65 VanDerWaalsContact CG-CD2 3.48Å; F28-L65 HydrophobicContact CG-CG 4.41Å; I63-L65 PolarHBondContact O-N 3.28Å; L65-L67 HydrophobicContact CD1-CB 4.27Å; L65-L76 HydrophobicContact CD1-CB 4.36Å; L65-L76 HydrophobicContact CD1-CD2 3.82Å; L65-L76 HydrophobicContact CD2-CB 4.22Å; L65-L76 HydrophobicContact CD2-CD2 4.44Å; L65-V77 WeakPolarHBondContact CB-O 3.36Å; L65-Q78 HydrophobicContact CB-CB 4.25Å; L65-F253 HydrophobicContact CB-CZ 4.4Å; L65-F253 HydrophobicContact CD2-CD1 4.47Å; L65-F253 HydrophobicContact CD2-CE1 3.44Å; L65-F253 VanDerWaalsContact CD2-CE1 3.44Å; L65-F253 HydrophobicContact CD2-CZ 3.7Å
66T94.2Very high90.6Very high26 Ų2649.8 Ų49.816%0.1626%0.259CS..EExtended strand (participates in β ladder)trans-98128.6169-53.50000109F24 Y25 E68 V77F24-T66 CarbonylContact O-C 3.45Å; F24-T66 WeakPolarHBondContact O-CA 3.28Å; Y25-T66 HydrophobicContact CE1-CG2 4.48Å; Y25-T66 WeakPolarHBondContact CE1-OG1 3.44Å; T66-E68 HydrophobicContact CG2-CG 4.06Å; T66-V77 PolarHBondContact N-O 3.37Å; T66-V77 PolarHBondContact O-N 2.82Å
67L95.6Very high90.6Very high0 Ų048.2 Ų48.20%025%0.245CC..EExtended strand (participates in β ladder)trans-103.3114.3172.6-173.9159.2000108.1S23 F24 V26 L65 I69 V74 Q75 L76 I119 V138 L149S23-L67 CarbonylContact C-O 3.52Å; S23-L67 WeakPolarHBondContact CA-O 3.48Å; F24-L67 HydrophobicContact CD2-CD2 4.46Å; F24-L67 PolarHBondContact N-O 3.49Å; F24-L67 PolarHBondContact O-N 3.44Å; V26-L67 HydrophobicContact CG2-CB 3.97Å; V26-L67 HydrophobicContact CG2-CD1 4.48Å; L65-L67 HydrophobicContact CD1-CB 4.27Å; L67-I69 HydrophobicContact CD2-CD1 3.91Å; L67-I69 HydrophobicContact CD2-CG1 3.47Å; L67-I69 VanDerWaalsContact CD2-CG1 3.47Å; L67-V74 HydrophobicContact CD1-CG1 3.98Å; L67-V74 HydrophobicContact CD2-CG1 3.59Å; L67-V74 HydrophobicContact CG-CG1 3.58Å; L67-Q75 WeakPolarHBondContact CA-O 3.3Å; L67-L76 HydrophobicContact CB-CD2 4.32Å; L67-L76 HydrophobicContact CD1-CD2 3.98Å; L67-L76 HydrophobicContact CG-CD2 4.02Å; L67-I119 HydrophobicContact CD1-CD1 4.06Å; L67-V138 HydrophobicContact CD1-CG1 4.27Å; L67-L149 HydrophobicContact CD1-CD1 4.36Å; L67-L149 HydrophobicContact CD1-CD2 4.49Å; L67-L149 HydrophobicContact CD2-CD1 3.73Å
68E94.6Very high90.7Very high54 Ų5448.9 Ų48.925%0.25225%0.247SC..EExtended strand (participates in β ladder)trans-103.2133.1178.5-60.4176.8-177.600109.6S22 T66 V74 Q75 V77S22-E68 CarbonylContact O-C 3.07Å; S22-E68 WeakPolarHBondContact O-CA 3.42Å; T66-E68 HydrophobicContact CG2-CG 4.06Å; E68-V74 CarbonylContact O-C 3.3Å; E68-V74 WeakPolarHBondContact O-CA 3.04Å; E68-Q75 HydrophobicContact CB-CB 4.33Å; E68-Q75 PolarHBondContact N-O 3.49Å; E68-Q75 PolarHBondContact O-N 3.33Å; E68-V77 HydrophobicContact CG-CG2 4.38Å
69I93.8Very high90.6Very high9 Ų946.1 Ų46.15%0.04624%0.238CC..EExtended strand (participates in β ladder)trans-114.3131.7177.6-51.7-178.8000108.3R21 S22 F24 L67 V74 L149 I153 L156R21-I69 VanDerWaalsContact CA-O 3.25Å; R21-I69 WeakPolarHBondContact CA-O 3.46Å; S22-I69 PolarHBondContact N-O 3.23Å; S22-I69 VanDerWaalsContact N-O 3.11Å; S22-I69 PolarHBondContact O-N 3.16Å; S22-I69 WeakPolarHBondContact OG-CB 3.34Å; F24-I69 HydrophobicContact CD2-CD1 4.26Å; F24-I69 HydrophobicContact CE2-CD1 3.87Å; F24-I69 HydrophobicContact CE2-CG1 4.48Å; L67-I69 HydrophobicContact CD2-CD1 3.91Å; L67-I69 HydrophobicContact CD2-CG1 3.47Å; L67-I69 VanDerWaalsContact CD2-CG1 3.47Å; I69-V74 HydrophobicContact CG1-CG2 4.4Å; I69-L149 HydrophobicContact CD1-CD1 3.71Å; I69-I153 HydrophobicContact CD1-CD1 4.41Å; I69-I153 HydrophobicContact CD1-CG1 3.67Å; I69-L156 HydrophobicContact CG2-CD2 4.21Å
70S91.4Very high90.4Very high24 Ų2439.7 Ų39.717%0.16821%0.209CC..EExtended strand (participates in β ladder)trans-138.2173.8171.171.90000109.5A72 G73 L156S70-A72 PolarHBondContact O-N 3.11Å; S70-A72 WeakPolarHBondContact OG-CB 3.3Å; S70-A72 PolarHBondContact OG-N 2.84Å; S70-G73 PolarHBondContact N-O 3.06Å; S70-G73 PolarHBondContact O-N 3.03Å; S70-G73 VanDerWaalsContact O-O 3.07Å; S70-L156 WeakPolarHBondContact O-CD1 3.36Å
71Q88.2Confident90.1Very high88 Ų8841.9 Ų41.941%0.41122%0.219SC..THydrogen-bonded Turntrans-56.2-25.5172.3-62.8-177.40.800112.5G73 M159Q71-G73 VanDerWaalsContact C-N 3.31Å; Q71-G73 PolarHBondContact O-N 2.86Å; Q71-M159 HydrophobicContact CB-CE 4.43Å; Q71-M159 HydrophobicContact CG-CE 4.18Å; Q71-M159 HydrophobicContact CG-SD 4.33Å
72A87.2Confident89.6Confident32 Ų3239.7 Ų39.726%0.26421%0.208SC..THydrogen-bonded Turntrans-81-11.2-176.900000113.2S70 R97 A100S70-A72 PolarHBondContact O-N 3.11Å; S70-A72 WeakPolarHBondContact OG-CB 3.3Å; S70-A72 PolarHBondContact OG-N 2.84Å; A72-R97 PolarHBondContact O-NH2 2.85Å; A72-A100 PolarHBondContact O-N 3.49Å
73G91.3Very high89Confident3 Ų340.3 Ų40.33%0.03121%0.211CC..EExtended strand (participates in β ladder)trans137-161.1-177.500000114.4S70 Q71 L98S70-G73 PolarHBondContact N-O 3.06Å; S70-G73 PolarHBondContact O-N 3.03Å; S70-G73 VanDerWaalsContact O-O 3.07Å; Q71-G73 VanDerWaalsContact C-N 3.31Å; Q71-G73 PolarHBondContact O-N 2.86Å; G73-L98 CarbonylContact C-O 3.56Å; G73-L98 VanDerWaalsContact CA-O 3.24Å; G73-L98 WeakPolarHBondContact CA-O 3.37Å
74V93.6Very high88.4Confident0 Ų041.7 Ų41.70%022%0.218CC..EExtended strand (participates in β ladder)trans-107.3132.4174.91780000109.3L67 E68 I69 R97 L98 I103 I153 L156L67-V74 HydrophobicContact CD1-CG1 3.98Å; L67-V74 HydrophobicContact CD2-CG1 3.59Å; L67-V74 HydrophobicContact CG-CG1 3.58Å; E68-V74 CarbonylContact O-C 3.3Å; E68-V74 WeakPolarHBondContact O-CA 3.04Å; I69-V74 HydrophobicContact CG1-CG2 4.4Å; V74-R97 CarbonylContact O-C 3.51Å; V74-L98 HydrophobicContact CB-CB 4.24Å; V74-L98 HydrophobicContact CB-CD1 4.39Å; V74-L98 HydrophobicContact CG1-CD1 4.46Å; V74-L98 PolarHBondContact N-O 3.37Å; V74-L98 PolarHBondContact O-N 2.91Å; V74-I103 HydrophobicContact CB-CD1 4.31Å; V74-I103 HydrophobicContact CG2-CD1 3.79Å; V74-I153 HydrophobicContact CG2-CG1 4.42Å; V74-L156 HydrophobicContact CG2-CD2 4.22Å
75Q93.5Very high87.7Confident54 Ų5445.2 Ų45.225%0.25223%0.228SC..EExtended strand (participates in β ladder)trans-118.8121.4177.6-174.1167.548.700110.6L67 E68 V77 K95 R96L67-Q75 WeakPolarHBondContact CA-O 3.3Å; E68-Q75 HydrophobicContact CB-CB 4.33Å; E68-Q75 PolarHBondContact N-O 3.49Å; E68-Q75 PolarHBondContact O-N 3.33Å; Q75-V77 HydrophobicContact CG-CG2 3.85Å; Q75-K95 HydrophobicContact CG-CB 4.36Å; Q75-R96 CarbonylContact C-O 3.59Å; Q75-R96 WeakPolarHBondContact CA-O 3.41Å
76L93.8Very high87.2Confident2 Ų255 Ų551%0.0127%0.265CS..EExtended strand (participates in β ladder)trans-90.7118.7173.8-55.2176.5000108.6F28 F31 L65 L67 K95 R96F28-L76 HydrophobicContact CD2-CD1 4.3Å; F28-L76 HydrophobicContact CE1-CD1 4.25Å; F28-L76 HydrophobicContact CE2-CD1 3.61Å; F28-L76 HydrophobicContact CZ-CD1 3.56Å; F31-L76 HydrophobicContact CE2-CD1 4.34Å; F31-L76 HydrophobicContact CZ-CD1 3.79Å; L65-L76 HydrophobicContact CD1-CB 4.36Å; L65-L76 HydrophobicContact CD1-CD2 3.82Å; L65-L76 HydrophobicContact CD2-CB 4.22Å; L65-L76 HydrophobicContact CD2-CD2 4.44Å; L67-L76 HydrophobicContact CB-CD2 4.32Å; L67-L76 HydrophobicContact CD1-CD2 3.98Å; L67-L76 HydrophobicContact CG-CD2 4.02Å; L76-K95 CarbonylContact O-C 3.51Å; L76-K95 VanDerWaalsContact O-CA 3.26Å; L76-K95 WeakPolarHBondContact O-CA 3.15Å; L76-R96 HydrophobicContact CB-CB 4.47Å; L76-R96 PolarHBondContact N-O 3.08Å; L76-R96 PolarHBondContact O-N 3.25Å
77V91.3Very high86.5Confident8 Ų855.7 Ų55.75%0.04828%0.277CS..EExtended strand (participates in β ladder)trans-120.3120-176.4-175.60000109.5L65 T66 E68 Q75 L93 V94 K95L65-V77 WeakPolarHBondContact CB-O 3.36Å; T66-V77 PolarHBondContact N-O 3.37Å; T66-V77 PolarHBondContact O-N 2.82Å; E68-V77 HydrophobicContact CG-CG2 4.38Å; Q75-V77 HydrophobicContact CG-CG2 3.85Å; V77-L93 HydrophobicContact CG1-CB 4.42Å; V77-L93 HydrophobicContact CG1-CD2 4.21Å; V77-V94 WeakPolarHBondContact CA-O 3.08Å; V77-K95 HydrophobicContact CG1-CG 4.26Å; V77-K95 HydrophobicContact CG2-CD 4.35Å; V77-K95 HydrophobicContact CG2-CG 4.11Å
78Q89.3Confident85.8Confident25 Ų2563.5 Ų63.512%0.11731%0.306CS..EExtended strand (participates in β ladder)trans-121.4126.5172.8177.7175.613.400111.5I63 L65 Y80 V94 F253I63-Q78 VanDerWaalsContact CG2-CD 3.45Å; I63-Q78 VanDerWaalsContact CG2-NE2 3.25Å; I63-Q78 VanDerWaalsContact CG2-OE1 3.28Å; L65-Q78 HydrophobicContact CB-CB 4.25Å; Q78-Y80 HydrophobicContact CB-CD2 4.44Å; Q78-Y80 HydrophobicContact CB-CE2 3.98Å; Q78-Y80 HydrophobicContact CG-CD2 3.97Å; Q78-Y80 HydrophobicContact CG-CE2 3.49Å; Q78-Y80 VanDerWaalsContact CG-CE2 3.49Å; Q78-Y80 PolarHBondContact NE2-OH 2.88Å; Q78-Y80 VanDerWaalsContact NE2-OH 3.08Å; Q78-Y80 PolarHBondContact OE1-OH 2.91Å; Q78-V94 PolarHBondContact N-O 2.84Å; Q78-V94 PolarHBondContact O-N 3.26Å; Q78-F253 HydrophobicContact CB-CE1 4.1Å; Q78-F253 HydrophobicContact CB-CE2 3.9Å; Q78-F253 HydrophobicContact CB-CZ 3.29Å; Q78-F253 HydrophobicContact CG-CZ 4.36Å
79P82.1Confident85.1Confident74 Ų7463.4 Ų63.448%0.48131%0.309SS..EExtended strand (participates in β ladder)trans-76.9128.3170.630.6-31.8000110.9T91 L93P79-T91 HydrophobicContact CB-CG2 3.71Å; P79-L93 HydrophobicContact CB-CD2 3.93Å
80Y80.4Confident84.5Confident66 Ų6668.4 Ų68.426%0.25933%0.327SS..EExtended strand (participates in β ladder)trans-113.7129.8172.8-82.2-83.6000110.2Q78 T91 L92 V94 P252Q78-Y80 HydrophobicContact CB-CD2 4.44Å; Q78-Y80 HydrophobicContact CB-CE2 3.98Å; Q78-Y80 HydrophobicContact CG-CD2 3.97Å; Q78-Y80 HydrophobicContact CG-CE2 3.49Å; Q78-Y80 VanDerWaalsContact CG-CE2 3.49Å; Q78-Y80 PolarHBondContact NE2-OH 2.88Å; Q78-Y80 VanDerWaalsContact NE2-OH 3.08Å; Q78-Y80 PolarHBondContact OE1-OH 2.91Å; Y80-T91 CarbonylContact O-C 3.5Å; Y80-T91 WeakPolarHBondContact O-CA 3.41Å; Y80-L92 PolarHBondContact N-O 2.83Å; Y80-L92 PolarHBondContact O-N 3.47Å; Y80-V94 HydrophobicContact CD2-CB 3.91Å; Y80-V94 HydrophobicContact CD2-CG2 3.49Å; Y80-V94 VanDerWaalsContact CD2-CG2 3.49Å; Y80-V94 HydrophobicContact CE2-CB 4.04Å; Y80-V94 HydrophobicContact CE2-CG2 3.97Å; Y80-V94 HydrophobicContact CG-CG2 4.38Å; Y80-P252 HydrophobicContact CD2-CG 3.98Å; Y80-P252 HydrophobicContact CE1-CB 4.09Å; Y80-P252 HydrophobicContact CE1-CG 4.16Å; Y80-P252 HydrophobicContact CE2-CB 3.67Å; Y80-P252 HydrophobicContact CE2-CG 3.4Å; Y80-P252 VanDerWaalsContact CE2-CG 3.4Å; Y80-P252 WeakPolarHBondContact OH-CB 3.25Å
81L78.7Confident83.8Confident74 Ų7471.4 Ų71.439%0.38735%0.345SS..EExtended strand (participates in β ladder)trans-86.6117.8173-60.2178.8000109.5V89 T91 L210L81-V89 HydrophobicContact CB-CG1 4.09Å; L81-V89 HydrophobicContact CD2-CG1 3.96Å; L81-V89 HydrophobicContact CG-CG1 4.42Å; L81-T91 HydrophobicContact CD2-CG2 4.37Å; L81-T91 WeakPolarHBondContact CD2-OG1 3.49Å; L81-L210 HydrophobicContact CD1-CD1 3.88Å
82L77.4Confident83.6Confident92 Ų9269.7 Ų69.748%0.48234%0.338SS..EExtended strand (participates in β ladder)trans-104.7125.6172.2-62.7-177.7000109.1V89 R90 L92L82-V89 CarbonylContact O-C 3.56Å; L82-V89 WeakPolarHBondContact O-CA 3.29Å; L82-R90 PolarHBondContact N-O 3.02Å; L82-R90 PolarHBondContact O-N 3.24Å; L82-L92 HydrophobicContact CD1-CB 3.73Å; L82-L92 HydrophobicContact CD1-CD2 3.82Å; L82-L92 HydrophobicContact CD1-CG 4.33Å; L82-L92 HydrophobicContact CG-CB 4.06Å
83V78.6Confident83.3Confident52 Ų5272.2 Ų72.232%0.31535%0.347SS..EExtended strand (participates in β ladder)trans-95.6121.2171.8-173.60000107.6V89 L206 M209V83-V89 HydrophobicContact CG2-CG2 4.32Å; V83-L206 HydrophobicContact CG2-CD2 3.5Å; V83-M209 HydrophobicContact CG1-CE 4.32Å
84N77.1Confident83Confident59 Ų5972.9 Ų72.932%0.31635%0.35SS..  trans-79.3171.6176.577.48.8000111.4R86 G87 R88N84-R86 PolarHBondContact O-N 2.58Å; N84-R86 WeakPolarHBondContact OD1-CA 3.49Å; N84-R86 WeakPolarHBondContact OD1-CB 3.23Å; N84-R86 PolarHBondContact OD1-N 2.97Å; N84-G87 PolarHBondContact O-N 3.24Å; N84-G87 PolarHBondContact OD1-N 3.4Å; N84-R88 PolarHBondContact N-O 2.84Å; N84-R88 PolarHBondContact OD1-N 3.26Å; N84-R88 PolarHBondContact OD1-O 2.79Å
85R76.3Confident82.8Confident204 Ų20475.3 Ų75.377%0.7736%0.361SS*.THydrogen-bonded Turntrans-58.4-17.6178.7-62.3-176.7-174.3175.22114.4P246R85-P246 HydrophobicContact CG-CG 4.47Å
86R83Confident82.6Confident209 Ų20973.9 Ų73.979%0.78935%0.353SS*.THydrogen-bonded Turntrans-98.613.1179.6-59.5-174.9-179.5-174.7-0.1112.4N84 R88N84-R86 PolarHBondContact O-N 2.58Å; N84-R86 WeakPolarHBondContact OD1-CA 3.49Å; N84-R86 WeakPolarHBondContact OD1-CB 3.23Å; N84-R86 PolarHBondContact OD1-N 2.97Å; R86-R88 PolarHBondContact O-N 2.83Å
87G80.3Confident82.5Confident40 Ų4079.5 Ų79.541%0.41237%0.374SS..SBendtrans73.3-0.4-177.100000114.9N84 V89N84-G87 PolarHBondContact O-N 3.24Å; N84-G87 PolarHBondContact OD1-N 3.4Å; G87-V89 PolarHBondContact O-N 3.14Å
88R79.9Confident82.4Confident165 Ų16579.1 Ų79.162%0.62337%0.372SS*.  trans-75.4124.8177.8-55.3-175.6177.7178.3-3.4109.7N84 R86N84-R88 PolarHBondContact N-O 2.84Å; N84-R88 PolarHBondContact OD1-N 3.26Å; N84-R88 PolarHBondContact OD1-O 2.79Å; R86-R88 PolarHBondContact O-N 2.83Å
89V79.9Confident82.5Confident51 Ų5180.7 Ų80.731%0.30938%0.383SS..EExtended strand (participates in β ladder)trans-76.8127.8171.6-170.50000109.1L81 L82 V83 G87 L210L81-V89 HydrophobicContact CB-CG1 4.09Å; L81-V89 HydrophobicContact CD2-CG1 3.96Å; L81-V89 HydrophobicContact CG-CG1 4.42Å; L82-V89 CarbonylContact O-C 3.56Å; L82-V89 WeakPolarHBondContact O-CA 3.29Å; V83-V89 HydrophobicContact CG2-CG2 4.32Å; G87-V89 PolarHBondContact O-N 3.14Å; V89-L210 HydrophobicContact CG1-CD1 4.47Å
90R80.5Confident82.8Confident114 Ų11477.5 Ų77.543%0.4336%0.363SS..EExtended strand (participates in β ladder)trans-122.4134.8170-61.2-172.689.9178.95.8108.7L82L82-R90 PolarHBondContact N-O 3.02Å; L82-R90 PolarHBondContact O-N 3.24Å
91T78.4Confident83Confident88 Ų8879.4 Ų79.454%0.5437%0.374SS..EExtended strand (participates in β ladder)trans-84.5121.3171.6-50.50000109.2P79 Y80 L81 L93P79-T91 HydrophobicContact CB-CG2 3.71Å; Y80-T91 CarbonylContact O-C 3.5Å; Y80-T91 WeakPolarHBondContact O-CA 3.41Å; L81-T91 HydrophobicContact CD2-CG2 4.37Å; L81-T91 WeakPolarHBondContact CD2-OG1 3.49Å; T91-L93 HydrophobicContact CG2-CD2 4.44Å
92L82.2Confident83.4Confident52 Ų5278.3 Ų78.327%0.27237%0.371SS..EExtended strand (participates in β ladder)trans-98.6123.9167.8176.667.2000108.4Y80 L82 V94 L271Y80-L92 PolarHBondContact N-O 2.83Å; Y80-L92 PolarHBondContact O-N 3.47Å; L82-L92 HydrophobicContact CD1-CB 3.73Å; L82-L92 HydrophobicContact CD1-CD2 3.82Å; L82-L92 HydrophobicContact CD1-CG 4.33Å; L82-L92 HydrophobicContact CG-CB 4.06Å; L92-V94 HydrophobicContact CD2-CG2 4.18Å; L92-V94 HydrophobicContact CG-CG2 4.31Å; L92-L271 HydrophobicContact CD1-CD2 3.59Å
93L82.4Confident84Confident85 Ų8574 Ų7445%0.44535%0.348SS..EExtended strand (participates in β ladder)trans-85.9120.1170.3-62.3179.7000108.9V77 P79 T91V77-L93 HydrophobicContact CG1-CB 4.42Å; V77-L93 HydrophobicContact CG1-CD2 4.21Å; P79-L93 HydrophobicContact CB-CD2 3.93Å; T91-L93 HydrophobicContact CG2-CD2 4.44Å
94V84.3Confident84.4Confident16 Ų1673.2 Ų73.210%0.09734%0.34CS..EExtended strand (participates in β ladder)trans-96.9123.1169.8-179.90000107.3V77 Q78 Y80 L92 P252 F253V77-V94 WeakPolarHBondContact CA-O 3.08Å; Q78-V94 PolarHBondContact N-O 2.84Å; Q78-V94 PolarHBondContact O-N 3.26Å; Y80-V94 HydrophobicContact CD2-CB 3.91Å; Y80-V94 HydrophobicContact CD2-CG2 3.49Å; Y80-V94 VanDerWaalsContact CD2-CG2 3.49Å; Y80-V94 HydrophobicContact CE2-CB 4.04Å; Y80-V94 HydrophobicContact CE2-CG2 3.97Å; Y80-V94 HydrophobicContact CG-CG2 4.38Å; L92-V94 HydrophobicContact CD2-CG2 4.18Å; L92-V94 HydrophobicContact CG-CG2 4.31Å; V94-P252 HydrophobicContact CB-CG 4.3Å; V94-P252 HydrophobicContact CG1-CG 4.08Å; V94-P252 WeakPolarHBondContact CG1-O 3.43Å; V94-P252 HydrophobicContact CG2-CG 3.83Å; V94-F253 HydrophobicContact CB-CE2 4.41Å; V94-F253 HydrophobicContact CG1-CD2 3.87Å; V94-F253 HydrophobicContact CG1-CE2 4.06Å
95K89.8Confident85Confident52 Ų5273 Ų7323%0.22634%0.34CS..EExtended strand (participates in β ladder)trans-118.8134.4-176-55.7-170.1179.7-1740109.4Q75 L76 V77Q75-K95 HydrophobicContact CG-CB 4.36Å; L76-K95 CarbonylContact O-C 3.51Å; L76-K95 VanDerWaalsContact O-CA 3.26Å; L76-K95 WeakPolarHBondContact O-CA 3.15Å; V77-K95 HydrophobicContact CG1-CG 4.26Å; V77-K95 HydrophobicContact CG2-CD 4.35Å; V77-K95 HydrophobicContact CG2-CG 4.11Å
96R89.6Confident85.7Confident23 Ų2363.5 Ų63.59%0.08730%0.304CS..EExtended strand (participates in β ladder)trans-126.4130169.8-173.8165.9178.6-175.3-14.8109.1Q75 L76 R121 F253 E267Q75-R96 CarbonylContact C-O 3.59Å; Q75-R96 WeakPolarHBondContact CA-O 3.41Å; L76-R96 HydrophobicContact CB-CB 4.47Å; L76-R96 PolarHBondContact N-O 3.08Å; L76-R96 PolarHBondContact O-N 3.25Å; R96-R121 VanDerWaalsContact NH2-NH2 3.11Å; R96-F253 HydrophobicContact CB-CD2 4.16Å; R96-F253 PolarHBondContact NH1-O 2.95Å; R96-E267 IonicContact NE-OE2 2.69Å
97R90.4Very high86.2Confident120 Ų12054.6 Ų54.645%0.45327%0.273SS..EExtended strand (participates in β ladder)trans-107.6131.6-174.9-175.4176.1175-168.4-6.8110.5A72 V74A72-R97 PolarHBondContact O-NH2 2.85Å; V74-R97 CarbonylContact O-C 3.51Å
98L91Very high86.8Confident1 Ų155.4 Ų55.41%0.00527%0.268CS..EExtended strand (participates in β ladder)trans-103.4108.4166.8-46-178.8000106.6F31 G73 V74 I103 A136F31-L98 HydrophobicContact CE1-CD2 3.81Å; F31-L98 HydrophobicContact CZ-CD2 3.95Å; G73-L98 CarbonylContact C-O 3.56Å; G73-L98 VanDerWaalsContact CA-O 3.24Å; G73-L98 WeakPolarHBondContact CA-O 3.37Å; V74-L98 HydrophobicContact CB-CB 4.24Å; V74-L98 HydrophobicContact CB-CD1 4.39Å; V74-L98 HydrophobicContact CG1-CD1 4.46Å; V74-L98 PolarHBondContact N-O 3.37Å; V74-L98 PolarHBondContact O-N 2.91Å; L98-I103 HydrophobicContact CB-CD1 4.08Å; L98-I103 HydrophobicContact CB-CG1 4.41Å; L98-A136 HydrophobicContact CD1-CB 4.4Å
99V89.6Confident87.4Confident57 Ų5748 Ų4835%0.34524%0.242SC..EExtended strand (participates in β ladder)trans-67.2134.2-177.8-1780000109.4Q101 T102V99-Q101 HydrophobicContact CG1-CB 4.28Å; V99-Q101 PolarHBondContact O-N 3.19Å; V99-Q101 VanDerWaalsContact O-N 3.12Å; V99-T102 HydrophobicContact CB-CG2 4.42Å; V99-T102 PolarHBondContact O-N 3.17Å; V99-T102 PolarHBondContact O-OG1 2.81Å
100A88.4Confident87.8Confident7 Ų749.1 Ų49.16%0.05825%0.252CS..G310 helixtrans-49.6-42.2-176.800000113.1A72 T102 I103 L156A72-A100 PolarHBondContact O-N 3.49Å; A100-T102 PolarHBondContact O-N 2.85Å; A100-I103 PolarHBondContact O-N 3.03Å; A100-I103 VanDerWaalsContact O-N 3.12Å; A100-L156 HydrophobicContact CB-CD1 3.9Å; A100-L156 HydrophobicContact CB-CD2 4.2Å; A100-L156 HydrophobicContact CB-CG 4.06Å
101Q85.6Confident88.1Confident107 Ų10748.7 Ų48.750%0.526%0.262SS..G310 helixtrans-61.1-24.3179.2-71.5176.42.900114.6V99 A165V99-Q101 HydrophobicContact CG1-CB 4.28Å; V99-Q101 PolarHBondContact O-N 3.19Å; V99-Q101 VanDerWaalsContact O-N 3.12Å; Q101-A165 HydrophobicContact CB-CB 3.58Å; Q101-A165 HydrophobicContact CG-CB 4.02Å; Q101-A165 WeakPolarHBondContact O-CB 3.47Å
102T86.8Confident88.6Confident51 Ų5149.1 Ų49.131%0.31327%0.266SS..G310 helixtrans-88.2-17.7179.8620000112.3V99 A100 R121 G122V99-T102 HydrophobicContact CB-CG2 4.42Å; V99-T102 PolarHBondContact O-N 3.17Å; V99-T102 PolarHBondContact O-OG1 2.81Å; A100-T102 PolarHBondContact O-N 2.85Å; T102-R121 CarbonylContact O-C 3.55Å; T102-R121 WeakPolarHBondContact O-CA 3.28Å; T102-R121 VanDerWaalsContact O-CB 3.3Å; T102-R121 WeakPolarHBondContact O-CB 3.45Å; T102-G122 PolarHBondContact O-N 3.43Å
103I90.1Very high89Confident2 Ų250.5 Ų50.51%0.0127%0.269CS..EExtended strand (participates in β ladder)trans-85.5119.6-179.5-54.8172.2000107.9V74 L98 A100 I119 L120 I153 L156 I157V74-I103 HydrophobicContact CB-CD1 4.31Å; V74-I103 HydrophobicContact CG2-CD1 3.79Å; L98-I103 HydrophobicContact CB-CD1 4.08Å; L98-I103 HydrophobicContact CB-CG1 4.41Å; A100-I103 PolarHBondContact O-N 3.03Å; A100-I103 VanDerWaalsContact O-N 3.12Å; I103-I119 HydrophobicContact CD1-CG2 4.27Å; I103-I119 HydrophobicContact CG1-CG2 4.37Å; I103-I119 HydrophobicContact CG2-CG2 3.8Å; I103-L120 WeakPolarHBondContact CA-O 3.4Å; I103-I153 HydrophobicContact CG2-CG2 4.32Å; I103-L156 HydrophobicContact CD1-CD2 4.49Å; I103-I157 HydrophobicContact CB-CG1 4.48Å; I103-I157 HydrophobicContact CG2-CD1 3.87Å; I103-I157 HydrophobicContact CG2-CG1 3.87Å
104F87.5Confident89.6Confident34 Ų3450.9 Ų50.915%0.14927%0.268CS..EExtended strand (participates in β ladder)trans-113.1-19.8-176.764.2-96.3000113.5A38 L120 T133 L166A38-F104 HydrophobicContact CB-CE2 3.52Å; A38-F104 HydrophobicContact CB-CZ 3.44Å; A38-F104 VanDerWaalsContact CB-CZ 3.44Å; F104-L120 HydrophobicContact CE1-CB 3.97Å; F104-L120 HydrophobicContact CE2-CB 3.8Å; F104-L120 HydrophobicContact CE2-CD2 4.42Å; F104-L120 HydrophobicContact CZ-CB 3.44Å; F104-L120 VanDerWaalsContact CZ-CB 3.44Å; F104-L120 HydrophobicContact CZ-CD2 4.18Å; F104-L120 HydrophobicContact CZ-CG 4.47Å; F104-L120 PolarHBondContact N-O 3.47Å; F104-L120 VanDerWaalsContact N-O 3.08Å; F104-T133 HydrophobicContact CE1-CG2 3.97Å; F104-T133 HydrophobicContact CZ-CG2 3.55Å; F104-L166 HydrophobicContact CB-CD2 3.28Å
105N89.2Confident90.1Very high56 Ų5651.2 Ų51.230%0.29927%0.269SS..EExtended strand (participates in β ladder)trans-154.6155179.4-158.1-11.4000111.3L120N105-L120 HydrophobicContact CB-CB 4.36Å; N105-L120 HydrophobicContact CB-CD1 4.09Å; N105-L120 PolarHBondContact O-N 3.4Å
106C91.9Very high90.5Very high4 Ų449.2 Ų49.23%0.02726%0.261CS..EExtended strand (participates in β ladder)trans-136.1130.7171.5-164.20000109.4V117 A118 H150 I153 I157C106-V117 WeakPolarHBondContact SG-CG1 3.34Å; C106-A118 CarbonylContact C-O 3.55Å; C106-A118 VanDerWaalsContact CA-O 3.3Å; C106-A118 WeakPolarHBondContact CA-O 3.4Å; C106-A118 PolarHBondContact SG-O 2.89Å; C106-A118 VanDerWaalsContact SG-O 3.37Å; C106-H150 PolarHBondContact O-NE2 3.36Å; C106-I153 HydrophobicContact CB-CB 4.28Å; C106-I153 HydrophobicContact CB-CG2 3.73Å; C106-I157 HydrophobicContact CB-CD1 4.21Å
107V92.8Very high90.8Very high21 Ų2148.1 Ų48.113%0.12726%0.257CS..EExtended strand (participates in β ladder)trans-120.2125.8-175.2178.50000109.2V50 A118 L120V50-V107 HydrophobicContact CG1-CB 4.43Å; V50-V107 HydrophobicContact CG1-CG1 4.09Å; V50-V107 HydrophobicContact CG2-CB 4.39Å; V50-V107 HydrophobicContact CG2-CG1 4.5Å; V50-V107 HydrophobicContact CG2-CG2 4.48Å; V107-A118 HydrophobicContact CB-CB 4.16Å; V107-A118 PolarHBondContact N-O 3.49Å; V107-A118 PolarHBondContact O-N 3.34Å; V107-L120 HydrophobicContact CB-CD1 4.41Å; V107-L120 HydrophobicContact CG2-CD1 3.76Å
108L93.6Very high91Very high58 Ų5842.5 Ų42.530%0.30424%0.235SC..EExtended strand (participates in β ladder)trans-80138.5169-17066.6000109.5V117 A146 F147 H150L108-V117 HydrophobicContact CD1-CG2 3.98Å; L108-A146 HydrophobicContact CD1-CB 3.72Å; L108-F147 HydrophobicContact CD2-CD2 4.45Å; L108-H150 HydrophobicContact CD1-CB 4.42Å
109G90.8Very high91.2Very high8 Ų842.6 Ų42.68%0.08224%0.236CC..PPolyproline II helixtrans-63.5148.1175.900000112.2Y113 Q114 F116G109-Y113 WeakPolarHBondContact CA-O 3.11Å; G109-Q114 WeakPolarHBondContact O-CA 3.5Å; G109-F116 PolarHBondContact N-O 2.61Å
110S88Confident91.3Very high75 Ų7539.9 Ų39.952%0.52422%0.219SC..PPolyproline II helixtrans-88.4164.6172.956.60000111Y113S110-Y113 CarbonylContact O-C 3.39Å; S110-Y113 VanDerWaalsContact O-CA 3.29Å; S110-Y113 WeakPolarHBondContact O-CA 3.42Å; S110-Y113 WeakPolarHBondContact O-CB 3.42Å; S110-Y113 PolarHBondContact O-N 3.27Å
111V87.3Confident91.4Very high106 Ų10640.3 Ų40.364%0.64222%0.219SC*.THydrogen-bonded Turntrans-49.6132174.5179.20000110.4Q114V111-Q114 HydrophobicContact CG2-CG 4.09Å
112P88.5Confident91.3Very high96 Ų9636.3 Ų36.362%0.62321%0.207SC*.THydrogen-bonded Turncis-91.811.44.437.2-37.2000115.3
113Y92.2Very high90.9Very high82 Ų8237.3 Ų37.332%0.32221%0.207SC..  trans-102.735.3-172.4-52.6-66.7000113.5I54 G109 S110 D115 F116I54-Y113 HydrophobicContact CG2-CD1 3.76Å; I54-Y113 HydrophobicContact CG2-CD2 3.84Å; I54-Y113 HydrophobicContact CG2-CE1 4.26Å; I54-Y113 HydrophobicContact CG2-CE2 4.32Å; I54-Y113 HydrophobicContact CG2-CG 3.52Å; G109-Y113 WeakPolarHBondContact CA-O 3.11Å; S110-Y113 CarbonylContact O-C 3.39Å; S110-Y113 VanDerWaalsContact O-CA 3.29Å; S110-Y113 WeakPolarHBondContact O-CA 3.42Å; S110-Y113 WeakPolarHBondContact O-CB 3.42Å; S110-Y113 PolarHBondContact O-N 3.27Å; Y113-D115 PolarHBondContact O-N 3.05Å; Y113-D115 VanDerWaalsContact O-N 3.11Å; Y113-F116 HydrophobicContact CD1-CD2 4.27Å; Y113-F116 AromaticContact CD1-CE2 3.98Å; Y113-F116 HydrophobicContact CD1-CE2 3.98Å; Y113-F116 HydrophobicContact CG-CD2 4.45Å; Y113-F116 WeakPolarHBondContact O-CB 3.44Å; Y113-F116 PolarHBondContact O-N 2.91Å
114Q94.2Very high89.8Confident92 Ų9241.9 Ų41.943%0.4325%0.245SC..THydrogen-bonded Turntrans-63.3-16.6-177.2-65.6177.2-21.300113.8G109 V111 F116 P143 A146G109-Q114 WeakPolarHBondContact O-CA 3.5Å; V111-Q114 HydrophobicContact CG2-CG 4.09Å; Q114-F116 VanDerWaalsContact C-N 3.31Å; Q114-P143 HydrophobicContact CB-CB 3.93Å; Q114-A146 WeakPolarHBondContact O-CB 3.26Å
115D95.7Very high88.7Confident23 Ų2344.5 Ų44.512%0.12326%0.257CS..THydrogen-bonded Turntrans-85.31.317660.8-17.7000113.4Y113 R139 C140Y113-D115 PolarHBondContact O-N 3.05Å; Y113-D115 VanDerWaalsContact O-N 3.11Å; D115-R139 HydrophobicContact CB-CG 4.41Å; D115-R139 CarbonylContact O-C 3.52Å; D115-R139 WeakPolarHBondContact O-CA 3.45Å; D115-R139 IonicContact OD2-CZ 2.86Å; D115-R139 VanDerWaalsContact OD2-CZ 3.24Å; D115-R139 IonicContact OD2-NE 3.89Å; D115-R139 PolarHBondContact OD2-NE 3.49Å; D115-R139 IonicContact OD2-NH2 3.46Å; D115-R139 PolarHBondContact OD2-NH2 2.81Å; D115-C140 PolarHBondContact O-N 3.14Å
116F96.4Very high87.1Confident11 Ų1146.8 Ų46.85%0.04828%0.284CS..EExtended strand (participates in β ladder)trans-95.6140.9176-75.5-101.3000112.3F29 I54 T57 G109 Y113 Q114 L137 V138 R139F29-F116 HydrophobicContact CD2-CE1 4.05Å; F29-F116 HydrophobicContact CE2-CD1 4.3Å; F29-F116 AromaticContact CE2-CE1 3.48Å; F29-F116 HydrophobicContact CE2-CE1 3.48Å; F29-F116 VanDerWaalsContact CE2-CE1 3.48Å; F29-F116 HydrophobicContact CE2-CZ 4.14Å; F29-F116 AromaticContact CZ-CE1 3.81Å; F29-F116 HydrophobicContact CZ-CE1 3.81Å; F29-F116 HydrophobicContact CZ-CZ 4.08Å; I54-F116 HydrophobicContact CD1-CB 3.94Å; I54-F116 HydrophobicContact CD1-CG 4.42Å; I54-F116 HydrophobicContact CG1-CB 4.25Å; I54-F116 HydrophobicContact CG1-CD1 4.21Å; I54-F116 HydrophobicContact CG1-CG 4.31Å; I54-F116 HydrophobicContact CG2-CD1 4.19Å; I54-F116 HydrophobicContact CG2-CD2 4.24Å; I54-F116 HydrophobicContact CG2-CE1 4.29Å; I54-F116 HydrophobicContact CG2-CE2 4.35Å; I54-F116 HydrophobicContact CG2-CG 4.15Å; I54-F116 HydrophobicContact CG2-CZ 4.36Å; T57-F116 HydrophobicContact CG2-CE1 4.05Å; G109-F116 PolarHBondContact N-O 2.61Å; Y113-F116 HydrophobicContact CD1-CD2 4.27Å; Y113-F116 AromaticContact CD1-CE2 3.98Å; Y113-F116 HydrophobicContact CD1-CE2 3.98Å; Y113-F116 HydrophobicContact CG-CD2 4.45Å; Y113-F116 WeakPolarHBondContact O-CB 3.44Å; Y113-F116 PolarHBondContact O-N 2.91Å; Q114-F116 VanDerWaalsContact C-N 3.31Å; F116-L137 HydrophobicContact CD1-CD1 4.16Å; F116-L137 HydrophobicContact CD1-CD2 4.32Å; F116-L137 HydrophobicContact CD1-CG 4.17Å; F116-V138 WeakPolarHBondContact CA-O 3.46Å; F116-R139 HydrophobicContact CD1-CB 3.95Å; F116-R139 HydrophobicContact CD1-CG 4.5Å; F116-R139 HydrophobicContact CD2-CB 4.45Å; F116-R139 HydrophobicContact CD2-CG 4.15Å; F116-R139 HydrophobicContact CE1-CB 3.83Å; F116-R139 HydrophobicContact CE1-CG 4.29Å; F116-R139 HydrophobicContact CE2-CB 4.33Å; F116-R139 HydrophobicContact CE2-CG 3.91Å; F116-R139 HydrophobicContact CG-CB 4.29Å; F116-R139 HydrophobicContact CG-CG 4.45Å; F116-R139 HydrophobicContact CZ-CB 4.04Å; F116-R139 HydrophobicContact CZ-CG 4.01Å
117V96.5Very high85.8Confident0 Ų051.9 Ų51.90%031%0.31CS..EExtended strand (participates in β ladder)trans-126.7127.1171.9-177.40000109.3C106 L108 I119 V138 A146 L149C106-V117 WeakPolarHBondContact SG-CG1 3.34Å; L108-V117 HydrophobicContact CD1-CG2 3.98Å; V117-I119 HydrophobicContact CG1-CG1 4.49Å; V117-V138 HydrophobicContact CB-CG2 3.83Å; V117-V138 PolarHBondContact N-O 3.31Å; V117-V138 VanDerWaalsContact O-CG2 3.31Å; V117-V138 WeakPolarHBondContact O-CG2 3.05Å; V117-V138 PolarHBondContact O-N 3.03Å; V117-A146 HydrophobicContact CG2-CB 3.82Å; V117-A146 WeakPolarHBondContact CG2-O 3.3Å; V117-L149 HydrophobicContact CB-CD2 4.14Å; V117-L149 HydrophobicContact CG1-CD2 4.39Å; V117-L149 HydrophobicContact CG1-CG 4.48Å; V117-L149 HydrophobicContact CG2-CD2 4.05Å; V117-L149 HydrophobicContact CG2-CG 4.4Å
118A95.2Very high84.2Confident1 Ų155.9 Ų55.91%0.00834%0.339CS..EExtended strand (participates in β ladder)trans-104.9118.7177.200000109.6V50 C106 V107 L135 L137V50-A118 HydrophobicContact CB-CB 4.49Å; V50-A118 HydrophobicContact CG1-CB 3.55Å; V50-A118 HydrophobicContact CG2-CB 4.07Å; C106-A118 CarbonylContact C-O 3.55Å; C106-A118 VanDerWaalsContact CA-O 3.3Å; C106-A118 WeakPolarHBondContact CA-O 3.4Å; C106-A118 PolarHBondContact SG-O 2.89Å; C106-A118 VanDerWaalsContact SG-O 3.37Å; V107-A118 HydrophobicContact CB-CB 4.16Å; V107-A118 PolarHBondContact N-O 3.49Å; V107-A118 PolarHBondContact O-N 3.34Å; A118-L135 HydrophobicContact CB-CD1 3.5Å; A118-L135 VanDerWaalsContact CB-CD1 3.5Å; A118-L137 HydrophobicContact CB-CD1 4.1Å
119I94.9Very high82.7Confident3 Ų360.3 Ų60.32%0.01536%0.363CS..EExtended strand (participates in β ladder)trans-103.2123.4176.9-51172.4000107.7L67 I103 V117 A136 I153L67-I119 HydrophobicContact CD1-CD1 4.06Å; I103-I119 HydrophobicContact CD1-CG2 4.27Å; I103-I119 HydrophobicContact CG1-CG2 4.37Å; I103-I119 HydrophobicContact CG2-CG2 3.8Å; V117-I119 HydrophobicContact CG1-CG1 4.49Å; I119-A136 HydrophobicContact CB-CB 4.3Å; I119-A136 PolarHBondContact N-O 3.31Å; I119-A136 PolarHBondContact O-N 3.03Å; I119-I153 HydrophobicContact CD1-CD1 3.51Å; I119-I153 HydrophobicContact CG1-CD1 3.72Å
120L92.1Very high81.4Confident0 Ų063.5 Ų63.50%038%0.381CS..EExtended strand (participates in β ladder)trans-108.3127.3-177.4-59.8102.8000111L34 L46 I103 F104 N105 V107 T133 L135L34-L120 HydrophobicContact CD1-CD2 4.21Å; L46-L120 HydrophobicContact CD1-CD2 3.4Å; L46-L120 HydrophobicContact CD2-CD1 4.47Å; L46-L120 HydrophobicContact CD2-CD2 3.94Å; L46-L120 HydrophobicContact CG-CD2 3.92Å; I103-L120 WeakPolarHBondContact CA-O 3.4Å; F104-L120 HydrophobicContact CE1-CB 3.97Å; F104-L120 HydrophobicContact CE2-CB 3.8Å; F104-L120 HydrophobicContact CE2-CD2 4.42Å; F104-L120 HydrophobicContact CZ-CB 3.44Å; F104-L120 VanDerWaalsContact CZ-CB 3.44Å; F104-L120 HydrophobicContact CZ-CD2 4.18Å; F104-L120 HydrophobicContact CZ-CG 4.47Å; F104-L120 PolarHBondContact N-O 3.47Å; F104-L120 VanDerWaalsContact N-O 3.08Å; N105-L120 HydrophobicContact CB-CB 4.36Å; N105-L120 HydrophobicContact CB-CD1 4.09Å; N105-L120 PolarHBondContact O-N 3.4Å; V107-L120 HydrophobicContact CB-CD1 4.41Å; V107-L120 HydrophobicContact CG2-CD1 3.76Å; L120-T133 HydrophobicContact CB-CG2 4.37Å; L120-T133 HydrophobicContact CD2-CG2 3.94Å; L120-L135 HydrophobicContact CD2-CD1 4.39Å; L120-L135 HydrophobicContact CG-CD1 4.02Å
121R89.7Confident80.4Confident16 Ų1664.3 Ų64.36%0.0638%0.376CS..EExtended strand (participates in β ladder)trans-127.1145.3177.174.2173.6-175.7158.16.6113.1R96 T102 E134 E267R96-R121 VanDerWaalsContact NH2-NH2 3.11Å; T102-R121 CarbonylContact O-C 3.55Å; T102-R121 WeakPolarHBondContact O-CA 3.28Å; T102-R121 VanDerWaalsContact O-CB 3.3Å; T102-R121 WeakPolarHBondContact O-CB 3.45Å; R121-E134 HydrophobicContact CG-CB 4.02Å; R121-E134 IonicContact CZ-OE2 3.67Å; R121-E134 PolarHBondContact N-O 2.98Å; R121-E134 IonicContact NE-OE2 3.47Å; R121-E134 PolarHBondContact NE-OE2 3.03Å; R121-E134 IonicContact NH2-OE2 3.28Å; R121-E134 PolarHBondContact NH2-OE2 2.85Å; R121-E134 PolarHBondContact O-N 3.43Å; R121-E267 IonicContact CZ-OE1 3.57Å; R121-E267 IonicContact NH1-OE1 2.9Å; R121-E267 PolarHBondContact NH1-OE1 3.3Å; R121-E267 IonicContact NH2-OE1 3.24Å
122G84.8Confident79.8Confident24 Ų2461.3 Ų61.325%0.24736%0.357CS..EExtended strand (participates in β ladder)trans-72.9125.4168.600000109.1T102T102-G122 PolarHBondContact O-N 3.43Å
123K76.6Confident79.7Confident72 Ų7256.9 Ų56.931%0.31333%0.328SS..EExtended strand (participates in β ladder)trans-103.2117.3173.8-171.3173.5-177.8173.90108.3F125 L132 E134K123-F125 PolarHBondContact O-N 2.86Å; K123-F125 VanDerWaalsContact O-N 3.14Å; K123-L132 WeakPolarHBondContact CB-O 3.42Å; K123-L132 PolarHBondContact N-O 3.08Å; K123-E134 HydrophobicContact CB-CB 4.35Å; K123-E134 HydrophobicContact CD-CB 4.48Å; K123-E134 IonicContact NZ-OE1 3.22Å
124A67.1Low79.6Confident97 Ų9753.2 Ų53.280%0.80231%0.314SS*.PPolyproline II helixtrans-63116.117100000108.5
125F65.4Low79.4Confident90 Ų9048.9 Ų48.940%0.39529%0.293SS..PPolyproline II helixtrans-90.5161.1168.3-153.8-105.3000109.2K123 D127 V130 L132K123-F125 PolarHBondContact O-N 2.86Å; K123-F125 VanDerWaalsContact O-N 3.14Å; F125-D127 HydrophobicContact CD1-CB 4.37Å; F125-D127 PolarHBondContact O-N 3.39Å; F125-V130 WeakPolarHBondContact CB-O 3.36Å; F125-L132 HydrophobicContact CD2-CD1 4.01Å; F125-L132 HydrophobicContact CE2-CD1 4.41Å; F125-L132 HydrophobicContact CG-CD1 4.48Å
126A56.3Low79.4Confident104 Ų10448 Ų4886%0.8629%0.289SS*.SBendtrans-62.3-28.4-179.900000112.3
127D62.9Low79.3Confident110 Ų11047.6 Ų47.659%0.58829%0.287SS*.SBendtrans-85.7117.7169.6-76.3-38.2000110.1F125 D129 V130F125-D127 HydrophobicContact CD1-CB 4.37Å; F125-D127 PolarHBondContact O-N 3.39Å; D127-D129 PolarHBondContact O-N 2.87Å; D127-D129 VanDerWaalsContact O-N 3.09Å; D127-V130 PolarHBondContact O-N 3.38Å
128S60.5Low79.3Confident105 Ų10547.6 Ų47.673%0.73429%0.288SS*.THydrogen-bonded Turntrans-59-22.1-177.451.60000114.1
129D62.3Low79.4Confident151 Ų15152.7 Ų52.781%0.80731%0.306SS*.THydrogen-bonded Turntrans-88.4-14.4-174.2-72.2-6000113.4D127D127-D129 PolarHBondContact O-N 2.87Å; D127-D129 VanDerWaalsContact O-N 3.09Å
130V62.8Low79.4Confident75 Ų7552.6 Ų52.646%0.45531%0.306SS..  trans-11793.2-177.1-170.60000110.3F125 D127 L132F125-V130 WeakPolarHBondContact CB-O 3.36Å; D127-V130 PolarHBondContact O-N 3.38Å; V130-L132 HydrophobicContact CG1-CD2 4.13Å; V130-L132 HydrophobicContact CG1-CG 4.14Å; V130-L132 PolarHBondContact O-N 3.07Å
131Q66.5Low79.5Confident92 Ų9258.3 Ų58.343%0.4334%0.337SS..  trans-81.2109.2167.2-66.9-170.49.400109.5
132L75.2Confident79.7Confident44 Ų4458.9 Ų58.923%0.2334%0.343CS..EExtended strand (participates in β ladder)trans-86.4139.6173.6-70172.1000110T33 K123 F125 V130T33-L132 HydrophobicContact CG2-CB 3.92Å; T33-L132 HydrophobicContact CG2-CD1 4.02Å; T33-L132 HydrophobicContact CG2-CD2 4.41Å; T33-L132 HydrophobicContact CG2-CG 4.34Å; K123-L132 WeakPolarHBondContact CB-O 3.42Å; K123-L132 PolarHBondContact N-O 3.08Å; F125-L132 HydrophobicContact CD2-CD1 4.01Å; F125-L132 HydrophobicContact CE2-CD1 4.41Å; F125-L132 HydrophobicContact CG-CD1 4.48Å; V130-L132 HydrophobicContact CG1-CD2 4.13Å; V130-L132 HydrophobicContact CG1-CG 4.14Å; V130-L132 PolarHBondContact O-N 3.07Å
133T86Confident80.2Confident2 Ų260.2 Ų60.21%0.01235%0.347CS..EExtended strand (participates in β ladder)trans-85.9126.6173.3-60.20000109.3T33 L34 I36 A38 F104 L120T33-T133 CarbonylContact C-O 3.6Å; T33-T133 WeakPolarHBondContact CA-O 3.31Å; L34-T133 HydrophobicContact CB-CG2 4.45Å; L34-T133 HydrophobicContact CD1-CG2 3.99Å; L34-T133 HydrophobicContact CG-CG2 4.45Å; L34-T133 PolarHBondContact N-O 3.25Å; I36-T133 WeakPolarHBondContact O-CB 3.43Å; I36-T133 PolarHBondContact O-OG1 3.21Å; A38-T133 HydrophobicContact CB-CG2 3.88Å; A38-T133 VanDerWaalsContact CB-OG1 3.31Å; A38-T133 WeakPolarHBondContact CB-OG1 3.32Å; A38-T133 PolarHBondContact N-OG1 2.88Å; F104-T133 HydrophobicContact CE1-CG2 3.97Å; F104-T133 HydrophobicContact CZ-CG2 3.55Å; L120-T133 HydrophobicContact CB-CG2 4.37Å; L120-T133 HydrophobicContact CD2-CG2 3.94Å
134E89.6Confident81.1Confident6 Ų662.7 Ų62.73%0.02836%0.36CS..EExtended strand (participates in β ladder)trans-105.4125.2169.5-167177.6-131.800109.7F31 R121 K123F31-E134 HydrophobicContact CB-CG 4.11Å; F31-E134 HydrophobicContact CD1-CG 4.06Å; F31-E134 HydrophobicContact CG-CG 4.5Å; R121-E134 HydrophobicContact CG-CB 4.02Å; R121-E134 IonicContact CZ-OE2 3.67Å; R121-E134 PolarHBondContact N-O 2.98Å; R121-E134 IonicContact NE-OE2 3.47Å; R121-E134 PolarHBondContact NE-OE2 3.03Å; R121-E134 IonicContact NH2-OE2 3.28Å; R121-E134 PolarHBondContact NH2-OE2 2.85Å; R121-E134 PolarHBondContact O-N 3.43Å; K123-E134 HydrophobicContact CB-CB 4.35Å; K123-E134 HydrophobicContact CD-CB 4.48Å; K123-E134 IonicContact NZ-OE1 3.22Å
135L91.9Very high82.5Confident1 Ų159.5 Ų59.51%0.00533%0.331CS..EExtended strand (participates in β ladder)trans-95.3125.7176.2175.572.8000109.1F31 K32 L34 V50 A53 A118 L120F31-L135 CarbonylContact C-O 3.44Å; F31-L135 VanDerWaalsContact CA-O 3.29Å; F31-L135 WeakPolarHBondContact CA-O 3.35Å; K32-L135 HydrophobicContact CB-CB 4.46Å; K32-L135 PolarHBondContact N-O 3.22Å; K32-L135 WeakPolarHBondContact O-CB 2.77Å; K32-L135 PolarHBondContact O-N 3.42Å; L34-L135 HydrophobicContact CD1-CB 4.28Å; L34-L135 HydrophobicContact CD2-CB 4.46Å; L34-L135 HydrophobicContact CD2-CD2 4.42Å; L34-L135 HydrophobicContact CG-CB 4.19Å; V50-L135 HydrophobicContact CG2-CD1 4.16Å; A53-L135 HydrophobicContact CB-CD2 3.32Å; A118-L135 HydrophobicContact CB-CD1 3.5Å; A118-L135 VanDerWaalsContact CB-CD1 3.5Å; L120-L135 HydrophobicContact CD2-CD1 4.39Å; L120-L135 HydrophobicContact CG-CD1 4.02Å
136A94Very high84Confident4 Ų455.2 Ų55.23%0.03331%0.312CS..EExtended strand (participates in β ladder)trans-104.9119.9166.700000109.1F28 F31 L98 I119F28-A136 HydrophobicContact CE2-CB 4.32Å; F31-A136 HydrophobicContact CD1-CB 3.79Å; F31-A136 HydrophobicContact CE1-CB 3.65Å; L98-A136 HydrophobicContact CD1-CB 4.4Å; I119-A136 HydrophobicContact CB-CB 4.3Å; I119-A136 PolarHBondContact N-O 3.31Å; I119-A136 PolarHBondContact O-N 3.03Å
137L95.3Very high85.8Confident2 Ų255.9 Ų55.91%0.0130%0.296CS..EExtended strand (participates in β ladder)trans-108.3125.7-175.6-168.763.2000112F29 G30 I54 T57 F116 A118 F256F29-L137 PolarHBondContact N-O 3.32Å; G30-L137 PolarHBondContact O-N 2.93Å; I54-L137 HydrophobicContact CG1-CD1 3.88Å; I54-L137 HydrophobicContact CG1-CD2 3.94Å; T57-L137 HydrophobicContact CG2-CD2 3.29Å; T57-L137 HydrophobicContact CG2-CG 4.42Å; F116-L137 HydrophobicContact CD1-CD1 4.16Å; F116-L137 HydrophobicContact CD1-CD2 4.32Å; F116-L137 HydrophobicContact CD1-CG 4.17Å; A118-L137 HydrophobicContact CB-CD1 4.1Å; L137-F256 HydrophobicContact CD2-CE2 4.05Å
138V96.2Very high87.4Confident1 Ų155.4 Ų55.41%0.00629%0.293CS..EExtended strand (participates in β ladder)trans-126.1154.3175.3-64.30000111V26 W27 F28 L67 F116 V117 L149V26-V138 HydrophobicContact CB-CB 4.15Å; V26-V138 HydrophobicContact CB-CG1 4.4Å; V26-V138 HydrophobicContact CG2-CB 4.19Å; V26-V138 HydrophobicContact CG2-CG1 3.89Å; W27-V138 CarbonylContact O-C 3.6Å; W27-V138 VanDerWaalsContact O-CA 3.32Å; W27-V138 WeakPolarHBondContact O-CA 3.47Å; F28-V138 HydrophobicContact CB-CG1 4.43Å; F28-V138 HydrophobicContact CD2-CG1 3.7Å; L67-V138 HydrophobicContact CD1-CG1 4.27Å; F116-V138 WeakPolarHBondContact CA-O 3.46Å; V117-V138 HydrophobicContact CB-CG2 3.83Å; V117-V138 PolarHBondContact N-O 3.31Å; V117-V138 VanDerWaalsContact O-CG2 3.31Å; V117-V138 WeakPolarHBondContact O-CG2 3.05Å; V117-V138 PolarHBondContact O-N 3.03Å; V138-L149 HydrophobicContact CG2-CD2 3.9Å
139R96.4Very high89.1Confident107 Ų10750.4 Ų50.440%0.40426%0.258SS..EExtended strand (participates in β ladder)trans-122.3133.3168.1179.7-168.4178.9-165.4-1.9109.6W27 F29 D115 F116W27-R139 HydrophobicContact CB-CB 4.25Å; W27-R139 PolarHBondContact N-O 3Å; W27-R139 PolarHBondContact O-N 3.26Å; F29-R139 HydrophobicContact CE2-CB 3.56Å; F29-R139 HydrophobicContact CZ-CB 4.26Å; D115-R139 HydrophobicContact CB-CG 4.41Å; D115-R139 CarbonylContact O-C 3.52Å; D115-R139 WeakPolarHBondContact O-CA 3.45Å; D115-R139 IonicContact OD2-CZ 2.86Å; D115-R139 VanDerWaalsContact OD2-CZ 3.24Å; D115-R139 IonicContact OD2-NE 3.89Å; D115-R139 PolarHBondContact OD2-NE 3.49Å; D115-R139 IonicContact OD2-NH2 3.46Å; D115-R139 PolarHBondContact OD2-NH2 2.81Å; F116-R139 HydrophobicContact CD1-CB 3.95Å; F116-R139 HydrophobicContact CD1-CG 4.5Å; F116-R139 HydrophobicContact CD2-CB 4.45Å; F116-R139 HydrophobicContact CD2-CG 4.15Å; F116-R139 HydrophobicContact CE1-CB 3.83Å; F116-R139 HydrophobicContact CE1-CG 4.29Å; F116-R139 HydrophobicContact CE2-CB 4.33Å; F116-R139 HydrophobicContact CE2-CG 3.91Å; F116-R139 HydrophobicContact CG-CB 4.29Å; F116-R139 HydrophobicContact CG-CG 4.45Å; F116-R139 HydrophobicContact CZ-CB 4.04Å; F116-R139 HydrophobicContact CZ-CG 4.01Å
140C96.1Very high90.6Very high1 Ų144.6 Ų44.61%0.00723%0.226CC..  trans-87.2174.8175.2-65.30000111D115 T145 A146D115-C140 PolarHBondContact O-N 3.14Å; C140-T145 HydrophobicContact CB-CG2 4.08Å; C140-A146 HydrophobicContact CB-CB 3.99Å
141D94.4Very high92.1Very high120 Ų12042.9 Ų42.964%0.64222%0.217SC*.SBendtrans-74.3-3217455.4-16.7000112.9T145D141-T145 WeakPolarHBondContact OD1-CB 3.48Å; D141-T145 VanDerWaalsContact OD1-CG2 3.3Å; D141-T145 WeakPolarHBondContact OD1-CG2 3.39Å; D141-T145 PolarHBondContact OD1-OG1 2.83Å
142S94.3Very high93.4Very high29 Ų2940.2 Ų40.220%0.20321%0.209CC..SBendtrans-143.7160.7179.492.20000112E144 T145 A146S142-E144 VanDerWaalsContact C-N 3.26Å; S142-E144 WeakPolarHBondContact CB-OE2 3.38Å; S142-E144 PolarHBondContact O-N 3.19Å; S142-E144 PolarHBondContact OG-N 2.9Å; S142-E144 PolarHBondContact OG-OE2 2.9Å; S142-T145 PolarHBondContact O-N 2.69Å; S142-T145 PolarHBondContact OG-N 2.88Å; S142-T145 PolarHBondContact OG-OG1 3.12Å; S142-A146 PolarHBondContact O-N 3.01Å
143P95Very high94.2Very high51 Ų5138.1 Ų38.133%0.33120%0.198SC..Hα-helixtrans-63.9-30.3174.226.5-33.7000112.5Q114 A146 F147Q114-P143 HydrophobicContact CB-CB 3.93Å; P143-A146 WeakPolarHBondContact O-CB 3.43Å; P143-A146 PolarHBondContact O-N 2.72Å; P143-F147 WeakPolarHBondContact O-CB 3.03Å; P143-F147 PolarHBondContact O-N 3.05Å
144E95.7Very high94.5Very high124 Ų12440.4 Ų40.458%0.57921%0.21SC*.Hα-helixtrans-64.8-44.9175.1-57.174.9-162.300111S142 A146 F147 L148S142-E144 VanDerWaalsContact C-N 3.26Å; S142-E144 WeakPolarHBondContact CB-OE2 3.38Å; S142-E144 PolarHBondContact O-N 3.19Å; S142-E144 PolarHBondContact OG-N 2.9Å; S142-E144 PolarHBondContact OG-OE2 2.9Å; E144-A146 VanDerWaalsContact C-N 3.32Å; E144-A146 PolarHBondContact O-N 2.97Å; E144-F147 PolarHBondContact O-N 2.64Å; E144-L148 WeakPolarHBondContact O-CG 3.32Å; E144-L148 PolarHBondContact O-N 3.12Å
145T95.4Very high94.5Very high30 Ų3043.9 Ų43.918%0.18424%0.235CC..Hα-helixtrans-64.8-38.3174.8-55.10000111.4F24 C140 D141 S142 F147 L148 L149F24-T145 HydrophobicContact CD1-CG2 3.95Å; F24-T145 HydrophobicContact CE1-CG2 4.46Å; C140-T145 HydrophobicContact CB-CG2 4.08Å; D141-T145 WeakPolarHBondContact OD1-CB 3.48Å; D141-T145 VanDerWaalsContact OD1-CG2 3.3Å; D141-T145 WeakPolarHBondContact OD1-CG2 3.39Å; D141-T145 PolarHBondContact OD1-OG1 2.83Å; S142-T145 PolarHBondContact O-N 2.69Å; S142-T145 PolarHBondContact OG-N 2.88Å; S142-T145 PolarHBondContact OG-OG1 3.12Å; T145-F147 VanDerWaalsContact C-N 3.35Å; T145-L148 PolarHBondContact O-N 3.02Å; T145-L149 WeakPolarHBondContact O-CB 3.35Å; T145-L149 PolarHBondContact O-N 2.95Å
146A96.2Very high94.3Very high0 Ų044.2 Ų44.20%024%0.237CC..Hα-helixtrans-62.1-42.5175.300000111.7L108 Q114 V117 C140 S142 P143 E144 L149 H150L108-A146 HydrophobicContact CD1-CB 3.72Å; Q114-A146 WeakPolarHBondContact O-CB 3.26Å; V117-A146 HydrophobicContact CG2-CB 3.82Å; V117-A146 WeakPolarHBondContact CG2-O 3.3Å; C140-A146 HydrophobicContact CB-CB 3.99Å; S142-A146 PolarHBondContact O-N 3.01Å; P143-A146 WeakPolarHBondContact O-CB 3.43Å; P143-A146 PolarHBondContact O-N 2.72Å; E144-A146 VanDerWaalsContact C-N 3.32Å; E144-A146 PolarHBondContact O-N 2.97Å; A146-L149 PolarHBondContact O-N 3.32Å; A146-H150 VanDerWaalsContact O-CB 3.26Å; A146-H150 WeakPolarHBondContact O-CB 3.4Å; A146-H150 PolarHBondContact O-N 3.37Å
147F95.7Very high94Very high118 Ų11844.8 Ų44.852%0.51824%0.239SC..Hα-helixtrans-64.1-42.8175.4-179.4-97.4000112.7L108 P143 E144 T145 H150 S151L108-F147 HydrophobicContact CD2-CD2 4.45Å; P143-F147 WeakPolarHBondContact O-CB 3.03Å; P143-F147 PolarHBondContact O-N 3.05Å; E144-F147 PolarHBondContact O-N 2.64Å; T145-F147 VanDerWaalsContact C-N 3.35Å; F147-H150 PolarHBondContact O-N 3.09Å; F147-S151 WeakPolarHBondContact O-CB 3.24Å; F147-S151 PolarHBondContact O-N 2.68Å; F147-S151 PolarHBondContact O-OG 3.19Å
148L95.5Very high93.4Very high101 Ų10149.7 Ų49.753%0.52926%0.264SS..Hα-helixtrans-64.2-40.4175.4-71.2174.4000112.3F24 E144 T145 S152F24-L148 HydrophobicContact CE1-CB 4.2Å; E144-L148 WeakPolarHBondContact O-CG 3.32Å; E144-L148 PolarHBondContact O-N 3.12Å; T145-L148 PolarHBondContact O-N 3.02Å; L148-S152 WeakPolarHBondContact O-CB 3.42Å; L148-S152 PolarHBondContact O-N 2.74Å; L148-S152 PolarHBondContact O-OG 3.38Å
149L95.9Very high92.5Very high0 Ų052.2 Ų52.20%028%0.277CS..Hα-helixtrans-63-50.2175.4174.661000110.7F24 V26 L67 I69 V117 V138 T145 A146 S152 I153F24-L149 HydrophobicContact CB-CD1 4.44Å; F24-L149 HydrophobicContact CD1-CB 4.15Å; F24-L149 HydrophobicContact CD1-CD1 4.42Å; F24-L149 HydrophobicContact CD2-CD1 3.61Å; F24-L149 HydrophobicContact CE1-CB 4.07Å; F24-L149 HydrophobicContact CE2-CD1 3.86Å; F24-L149 HydrophobicContact CG-CB 4.46Å; F24-L149 HydrophobicContact CG-CD1 3.91Å; F24-L149 HydrophobicContact CZ-CB 4.32Å; F24-L149 HydrophobicContact CZ-CD1 4.37Å; V26-L149 HydrophobicContact CG1-CD2 4.23Å; L67-L149 HydrophobicContact CD1-CD1 4.36Å; L67-L149 HydrophobicContact CD1-CD2 4.49Å; L67-L149 HydrophobicContact CD2-CD1 3.73Å; I69-L149 HydrophobicContact CD1-CD1 3.71Å; V117-L149 HydrophobicContact CB-CD2 4.14Å; V117-L149 HydrophobicContact CG1-CD2 4.39Å; V117-L149 HydrophobicContact CG1-CG 4.48Å; V117-L149 HydrophobicContact CG2-CD2 4.05Å; V117-L149 HydrophobicContact CG2-CG 4.4Å; V138-L149 HydrophobicContact CG2-CD2 3.9Å; T145-L149 WeakPolarHBondContact O-CB 3.35Å; T145-L149 PolarHBondContact O-N 2.95Å; A146-L149 PolarHBondContact O-N 3.32Å; L149-S152 WeakPolarHBondContact O-CB 3.5Å; L149-S152 PolarHBondContact O-N 3.34Å; L149-I153 HydrophobicContact CD1-CD1 3.95Å; L149-I153 HydrophobicContact CD1-CG1 4.39Å; L149-I153 HydrophobicContact CG-CD1 4.18Å; L149-I153 WeakPolarHBondContact O-CG1 3.21Å; L149-I153 PolarHBondContact O-N 2.79Å; L149-I153 VanDerWaalsContact O-N 3.08Å
150H95.2Very high90.9Very high28 Ų2851.7 Ų51.713%0.1329%0.287CS..Hα-helixtrans-56-50.9176.5174.3-97000111.3C106 L108 A146 F147 S152 I153 D154C106-H150 PolarHBondContact O-NE2 3.36Å; L108-H150 HydrophobicContact CD1-CB 4.42Å; A146-H150 VanDerWaalsContact O-CB 3.26Å; A146-H150 WeakPolarHBondContact O-CB 3.4Å; A146-H150 PolarHBondContact O-N 3.37Å; F147-H150 PolarHBondContact O-N 3.09Å; H150-S152 VanDerWaalsContact C-N 3.28Å; H150-S152 PolarHBondContact O-N 2.91Å; H150-I153 PolarHBondContact O-N 3.49Å; H150-I153 VanDerWaalsContact O-N 3.07Å; H150-D154 IonicContact CE1-OD1 3.02Å; H150-D154 IonicContact CE1-OD2 3.78Å; H150-D154 PolarHBondContact CE1-OD2 2.88Å; H150-D154 IonicContact ND1-OD2 3.7Å; H150-D154 IonicContact NE2-OD1 3.59Å; H150-D154 PolarHBondContact NE2-OD1 3.06Å; H150-D154 IonicContact NE2-OD2 2.68Å; H150-D154 PolarHBondContact NE2-OD2 3.38Å; H150-D154 PolarHBondContact O-N 3.03Å
151S93.9Very high89.3Confident40 Ų4056.4 Ų56.428%0.2831%0.309SS..Hα-helixtrans-58.3-37.4177.1-61.20000113.3F147 S155F147-S151 WeakPolarHBondContact O-CB 3.24Å; F147-S151 PolarHBondContact O-N 2.68Å; F147-S151 PolarHBondContact O-OG 3.19Å; S151-S155 WeakPolarHBondContact O-CB 3.45Å; S151-S155 PolarHBondContact O-N 2.81Å; S151-S155 PolarHBondContact O-OG 3.38Å
152S93.4Very high87.6Confident36 Ų3650.8 Ų50.825%0.25228%0.279SS..Hα-helixtrans-68.1-38177.8-61.40000112L148 L149 H150 L156L148-S152 WeakPolarHBondContact O-CB 3.42Å; L148-S152 PolarHBondContact O-N 2.74Å; L148-S152 PolarHBondContact O-OG 3.38Å; L149-S152 WeakPolarHBondContact O-CB 3.5Å; L149-S152 PolarHBondContact O-N 3.34Å; H150-S152 VanDerWaalsContact C-N 3.28Å; H150-S152 PolarHBondContact O-N 2.91Å; S152-L156 PolarHBondContact O-N 2.74Å
153I93.1Very high85.8Confident0 Ų056.7 Ų56.70%030%0.297CS..Hα-helixtrans-75.4-40.9178-63.6173.4000110.6I69 V74 I103 C106 I119 L149 H150 S155 L156 I157I69-I153 HydrophobicContact CD1-CD1 4.41Å; I69-I153 HydrophobicContact CD1-CG1 3.67Å; V74-I153 HydrophobicContact CG2-CG1 4.42Å; I103-I153 HydrophobicContact CG2-CG2 4.32Å; C106-I153 HydrophobicContact CB-CB 4.28Å; C106-I153 HydrophobicContact CB-CG2 3.73Å; I119-I153 HydrophobicContact CD1-CD1 3.51Å; I119-I153 HydrophobicContact CG1-CD1 3.72Å; L149-I153 HydrophobicContact CD1-CD1 3.95Å; L149-I153 HydrophobicContact CD1-CG1 4.39Å; L149-I153 HydrophobicContact CG-CD1 4.18Å; L149-I153 WeakPolarHBondContact O-CG1 3.21Å; L149-I153 PolarHBondContact O-N 2.79Å; L149-I153 VanDerWaalsContact O-N 3.08Å; H150-I153 PolarHBondContact O-N 3.49Å; H150-I153 VanDerWaalsContact O-N 3.07Å; I153-S155 VanDerWaalsContact C-N 3.29Å; I153-S155 PolarHBondContact O-N 2.93Å; I153-L156 WeakPolarHBondContact O-CA 3.25Å; I153-L156 VanDerWaalsContact O-CB 3.28Å; I153-L156 WeakPolarHBondContact O-CB 3.41Å; I153-L156 PolarHBondContact O-N 2.77Å; I153-I157 HydrophobicContact CG2-CD1 3.96Å; I153-I157 HydrophobicContact CG2-CG1 4.37Å; I153-I157 WeakPolarHBondContact O-CG1 3.46Å; I153-I157 PolarHBondContact O-N 2.79Å
154D91.3Very high83.8Confident50 Ų5064.3 Ų64.327%0.26732%0.32SS..Hα-helixtrans-59.4-43.1175-82.46.7000111.3H150 L156 I157 L158H150-D154 IonicContact CE1-OD1 3.02Å; H150-D154 IonicContact CE1-OD2 3.78Å; H150-D154 PolarHBondContact CE1-OD2 2.88Å; H150-D154 IonicContact ND1-OD2 3.7Å; H150-D154 IonicContact NE2-OD1 3.59Å; H150-D154 PolarHBondContact NE2-OD1 3.06Å; H150-D154 IonicContact NE2-OD2 2.68Å; H150-D154 PolarHBondContact NE2-OD2 3.38Å; H150-D154 PolarHBondContact O-N 3.03Å; D154-L156 VanDerWaalsContact C-N 3.26Å; D154-L156 PolarHBondContact O-N 3.47Å; D154-I157 PolarHBondContact O-N 2.8Å; D154-L158 WeakPolarHBondContact O-CB 3.49Å; D154-L158 VanDerWaalsContact O-CG 3.28Å; D154-L158 WeakPolarHBondContact O-CG 3.46Å; D154-L158 PolarHBondContact O-N 3.07Å
155S89.5Confident81.6Confident78 Ų7860.6 Ų60.655%0.54531%0.31SS..Hα-helixtrans-58.7-38.4173.6-61.70000112.2S151 I153 M159S151-S155 WeakPolarHBondContact O-CB 3.45Å; S151-S155 PolarHBondContact O-N 2.81Å; S151-S155 PolarHBondContact O-OG 3.38Å; I153-S155 VanDerWaalsContact C-N 3.29Å; I153-S155 PolarHBondContact O-N 2.93Å; S155-M159 WeakPolarHBondContact O-CG 3.36Å; S155-M159 PolarHBondContact O-N 2.86Å
156L88.6Confident79.7Confident9 Ų963 Ų635%0.04732%0.321CS..Hα-helixtrans-67.4-43.5176.8177.868.9000112I69 S70 V74 A100 I103 S152 I153 D154 L158 M159I69-L156 HydrophobicContact CG2-CD2 4.21Å; S70-L156 WeakPolarHBondContact O-CD1 3.36Å; V74-L156 HydrophobicContact CG2-CD2 4.22Å; A100-L156 HydrophobicContact CB-CD1 3.9Å; A100-L156 HydrophobicContact CB-CD2 4.2Å; A100-L156 HydrophobicContact CB-CG 4.06Å; I103-L156 HydrophobicContact CD1-CD2 4.49Å; S152-L156 PolarHBondContact O-N 2.74Å; I153-L156 WeakPolarHBondContact O-CA 3.25Å; I153-L156 VanDerWaalsContact O-CB 3.28Å; I153-L156 WeakPolarHBondContact O-CB 3.41Å; I153-L156 PolarHBondContact O-N 2.77Å; D154-L156 VanDerWaalsContact C-N 3.26Å; D154-L156 PolarHBondContact O-N 3.47Å; L156-L158 VanDerWaalsContact C-N 3.33Å; L156-L158 PolarHBondContact O-N 3.18Å; L156-M159 HydrophobicContact CD1-SD 4.35Å; L156-M159 WeakPolarHBondContact O-CB 3.46Å; L156-M159 PolarHBondContact O-N 3.45Å
157I86.8Confident77.5Confident16 Ų1671.6 Ų71.68%0.08235%0.354CS..Hα-helixtrans-63.5-41.1179-65.3164.1000110.5I103 C106 I153 D154 M159 L166I103-I157 HydrophobicContact CB-CG1 4.48Å; I103-I157 HydrophobicContact CG2-CD1 3.87Å; I103-I157 HydrophobicContact CG2-CG1 3.87Å; C106-I157 HydrophobicContact CB-CD1 4.21Å; I153-I157 HydrophobicContact CG2-CD1 3.96Å; I153-I157 HydrophobicContact CG2-CG1 4.37Å; I153-I157 WeakPolarHBondContact O-CG1 3.46Å; I153-I157 PolarHBondContact O-N 2.79Å; D154-I157 PolarHBondContact O-N 2.8Å; I157-M159 PolarHBondContact O-N 2.84Å; I157-L166 HydrophobicContact CG2-CD1 4.43Å
158L83.5Confident75.1Confident104 Ų10471.5 Ų71.555%0.54536%0.358SS..Hα-helixtrans-71.3-13.6-177.7-68.7173.4000113.9D154 L156 R163D154-L158 WeakPolarHBondContact O-CB 3.49Å; D154-L158 VanDerWaalsContact O-CG 3.28Å; D154-L158 WeakPolarHBondContact O-CG 3.46Å; D154-L158 PolarHBondContact O-N 3.07Å; L156-L158 VanDerWaalsContact C-N 3.33Å; L156-L158 PolarHBondContact O-N 3.18Å; L158-R163 PolarHBondContact O-NE 3Å
159M77.5Confident72.8Confident55 Ų5571.6 Ų71.627%0.27137%0.365SS..SBendtrans-59.7148.9176.9-72.4-171.360.400111.7Q71 S155 L156 I157 Q161 G162 R163Q71-M159 HydrophobicContact CB-CE 4.43Å; Q71-M159 HydrophobicContact CG-CE 4.18Å; Q71-M159 HydrophobicContact CG-SD 4.33Å; S155-M159 WeakPolarHBondContact O-CG 3.36Å; S155-M159 PolarHBondContact O-N 2.86Å; L156-M159 HydrophobicContact CD1-SD 4.35Å; L156-M159 WeakPolarHBondContact O-CB 3.46Å; L156-M159 PolarHBondContact O-N 3.45Å; I157-M159 PolarHBondContact O-N 2.84Å; M159-Q161 PolarHBondContact O-N 3.11Å; M159-G162 PolarHBondContact O-N 2.97Å; M159-R163 PolarHBondContact O-N 3.22Å; M159-R163 VanDerWaalsContact O-N 3.14Å
160P63Low70.4Confident96 Ų9682.5 Ų82.562%0.62341%0.406SS*.Hα-helixtrans-54.8-31.9-179.5-25.833.3000114R163 R164P160-R163 PolarHBondContact O-N 2.82Å; P160-R164 PolarHBondContact O-N 3.05Å
161Q62.3Low68.1Low99 Ų9988.1 Ų88.146%0.46343%0.433SS..Hα-helixtrans-67.2-35.7177-63.5-178.34.800112.5M159M159-Q161 PolarHBondContact O-N 3.11Å
162G58.2Low65.8Low2 Ų293.1 Ų93.12%0.02146%0.456CS..Hα-helixtrans-71.5-42.7174.300000111.9M159 R164 A165 L166M159-G162 PolarHBondContact O-N 2.97Å; G162-R164 VanDerWaalsContact C-N 3.31Å; G162-R164 PolarHBondContact O-N 2.79Å; G162-A165 PolarHBondContact O-N 2.79Å; G162-L166 PolarHBondContact O-N 2.83Å
163R57.2Low63.3Low154 Ų15497.9 Ų97.958%0.58148%0.479SS*.Hα-helixtrans-61.6-33.2-179.6-65.2-173-175.8-160.1-4.7114.1L158 M159 P160 A165 L166 R167L158-R163 PolarHBondContact O-NE 3Å; M159-R163 PolarHBondContact O-N 3.22Å; M159-R163 VanDerWaalsContact O-N 3.14Å; P160-R163 PolarHBondContact O-N 2.82Å; R163-A165 PolarHBondContact O-N 2.76Å; R163-L166 PolarHBondContact O-N 2.88Å; R163-R167 PolarHBondContact O-N 2.87Å
164R51.5Low60.7Low211 Ų211103.1 Ų103.180%0.79652%0.516SS*.Hα-helixtrans-63.6-30.3175.8-74-177.2-176-176.21112.8P160 G162P160-R164 PolarHBondContact O-N 3.05Å; G162-R164 VanDerWaalsContact C-N 3.31Å; G162-R164 PolarHBondContact O-N 2.79Å
165A50.6Low58.4Low45 Ų45108.1 Ų108.137%0.37254%0.541SS..Hα-helixtrans-84-23.7179.600000113.3Q101 G162 R163 R167Q101-A165 HydrophobicContact CB-CB 3.58Å; Q101-A165 HydrophobicContact CG-CB 4.02Å; Q101-A165 WeakPolarHBondContact O-CB 3.47Å; G162-A165 PolarHBondContact O-N 2.79Å; R163-A165 PolarHBondContact O-N 2.76Å; A165-R167 VanDerWaalsContact C-N 3.3Å
166L54.4Low56Low81 Ų81109.4 Ų109.442%0.42455%0.55SS.*Hα-helixtrans-77.3-18171.5-59.3-179.2000113F104 I157 G162 R163 N168F104-L166 HydrophobicContact CB-CD2 3.28Å; I157-L166 HydrophobicContact CG2-CD1 4.43Å; G162-L166 PolarHBondContact O-N 2.83Å; R163-L166 PolarHBondContact O-N 2.88Å; L166-N168 PolarHBondContact O-N 2.79Å
167R50.5Low53.5Low180 Ų180115.7 Ų115.768%0.67959%0.589SS**SBendtrans-71.3112.5174.3-147.2177-174.5-168.90.1107.4R163 A165R163-R167 PolarHBondContact O-N 2.87Å; A165-R167 VanDerWaalsContact C-N 3.3Å
168N45.1Very low51.3Low116 Ų116125.7 Ų125.762%0.6263%0.626SS**  trans-44.2130178.6-75.7-45.2000110.3L166 R170L166-N168 PolarHBondContact O-N 2.79Å; N168-R170 HydrophobicContact CB-CB 4.12Å; N168-R170 PolarHBondContact O-N 2.84Å
169P48.3Very low49Very low104 Ų104132.3 Ų132.368%0.67564%0.644SS**THydrogen-bonded Turntrans-67.616170.128.3-33.5000112.8
170R45.6Very low47.7Very low228 Ų228137.7 Ų137.786%0.8667%0.672SS**THydrogen-bonded Turntrans-97-8.4-171.2-134-179.5-174.3-1741.9113.9N168N168-R170 HydrophobicContact CB-CB 4.12Å; N168-R170 PolarHBondContact O-N 2.84Å
171E46.5Very low46.6Very low147 Ų147138 Ų13869%0.68768%0.676SS**SBendtrans-99.5-14.8-179.9-67.4-169.5165.100114.4
172D44.7Very low45.5Very low144 Ų144143.4 Ų143.477%0.7770%0.698SS**SBendtrans-111.58.3-175.4-68.8-28000115
173N41.4Very low45.1Very low136 Ų136150.3 Ų150.373%0.72773%0.733SS**  trans-122.943.3-176-109.95.7000114.1L175N173-L175 PolarHBondContact O-N 3.08Å
174S39Very low44.1Very low110 Ų110148.5 Ų148.577%0.76974%0.742SS**  trans-72.99.2171.2530000114.5
175L41.8Very low43.8Very low155 Ų155146.5 Ų146.581%0.81275%0.745SS**SBendtrans-146.778.6-175.6-67.8167.7000111.9N173N173-L175 PolarHBondContact O-N 3.08Å
176S39.9Very low43.4Very low105 Ų105153.4 Ų153.473%0.73477%0.766SS**  trans177.885.5147.2-176.20000111.6R178S176-R178 PolarHBondContact O-N 3.4Å
177T34.6Very low42.5Very low141 Ų141158.8 Ų158.887%0.86579%0.789SS**  trans-75.496.4164.9-56.20000109
178R42.2Very low42.1Very low227 Ų227157.7 Ų157.786%0.85780%0.796SS**  trans-137.9101.8162.5-96.9-172.3-171.1-170.73.3113.4S176S176-R178 PolarHBondContact O-N 3.4Å
179R35.4Very low41.7Very low243 Ų243157.6 Ų157.692%0.91780%0.801SS**  trans-21.9121.7158.3-59.3174.2-179.6177.8-0.7114.4
180I49.8Very low41.2Very low168 Ų168158.5 Ų158.586%0.86281%0.81SS**  trans-135.5131.9153.4-58.5-179000109.1
181S40.4Very low40.9Very low101 Ų101158.8 Ų158.871%0.70681%0.811SS**  trans-69.5146.1-163.345.40000116.1
182K38.9Very low40.4Very low213 Ų213161.3 Ų161.393%0.92682%0.823SS**  trans-56.2125.8167.7-62.7172178.31790111.2
183I48.4Very low40.1Very low147 Ų147162.1 Ų162.175%0.75483%0.826SS**  trans-113.9128.9163.9-59.8175.3000107.4
184P37.3Very low39.8Very low117 Ų117161 Ų16176%0.7683%0.826SS**  trans-81.4128.6-176.431.8-31.1000111.1K186P184-K186 PolarHBondContact O-N 3.27Å
185I46.1Very low40Very low168 Ų168163.7 Ų163.786%0.86283%0.832SS**  trans-82.8114.8175.5-61173.6000108.9
186K40.9Very low40Very low190 Ų190165.1 Ų165.183%0.82683%0.827SS**PPolyproline II helixtrans-71.8128.5169.4-75.6-179.7175.8179.20110.1P184P184-K186 PolarHBondContact O-N 3.27Å
187Q36.1Very low39.8Very low194 Ų194164.9 Ų164.991%0.90782%0.823SS**PPolyproline II helixtrans-66.1129.2171-67.9178.5-16.400110.3
188I42Very low40.1Very low158 Ų158162.4 Ų162.481%0.8181%0.809SS**PPolyproline II helixtrans-102.5136.1173.2-62172.9000108.4
189P35.7Very low40.5Very low113 Ų113156.6 Ų156.673%0.73480%0.795SS**PPolyproline II helixtrans-75.1139.6-171.8-7.524.5000112.4R191P189-R191 PolarHBondContact O-N 3.33Å
190S38.7Very low41.4Very low123 Ų123148.5 Ų148.586%0.8678%0.775SS**  trans-60.4110.2172.558.90000111.3
191R39.2Very low41.3Very low234 Ų234146 Ų14688%0.88376%0.763SS**  trans-101.9126.1163-80.5-172.4172.1-178.2-1.6110.1P189P189-R191 PolarHBondContact O-N 3.33Å
192Q35.5Very low42Very low200 Ų200148.4 Ų148.494%0.93576%0.756SS**  trans-47.1131.6177.2-66.1161.1-23.300111.7
193L38.2Very low43Very low161 Ų161141.5 Ų141.584%0.84374%0.735SS**  trans-121.5145.7168.4-119.498000110
194P36.3Very low43.7Very low112 Ų112142 Ų14273%0.72773%0.728SS**  trans-80.3156.2-158.833.5-35.1000113.2R196P194-R196 PolarHBondContact O-N 2.85Å
195D41.9Very low45.1Very low168 Ų168140.2 Ų140.290%0.89871%0.714SS**  trans-39.7113.1178.7-77.8-43.1000113.7
196R42.3Very low46.2Very low184 Ų184134.9 Ų134.969%0.69469%0.687SS**PPolyproline II helixtrans-79.5121176.6-161.7177.2-168.6-178.32.9108.7P194P194-R196 PolarHBondContact O-N 2.85Å
197P36.2Very low47.7Very low101 Ų101133.4 Ų133.466%0.65668%0.678SS**PPolyproline II helixtrans-67.7147.8-179.926.9-32.3000110.7L199P197-L199 PolarHBondContact O-N 3.39Å
198P40.9Very low49.5Very low88 Ų88132.1 Ų132.157%0.57167%0.665SS**PPolyproline II helixtrans-63132.8-177.824.8-32.6000110.6S200 L201P198-S200 PolarHBondContact O-N 3.3Å; P198-L201 PolarHBondContact O-N 2.86Å
199L51.2Low51Low106 Ų106129.1 Ų129.156%0.55565%0.648SS**THydrogen-bonded Turntrans-54.3-10.4179.3-73.3162.7000114.4P197 S203P197-L199 PolarHBondContact O-N 3.39Å; L199-S203 PolarHBondContact O-N 3.24Å; L199-S203 PolarHBondContact O-OG 3.41Å
200S53.7Low52.9Low73 Ų73126.3 Ų126.351%0.5163%0.627SS.*Hα-helixtrans-72.2-26.8-17967.90000114.4P198 S203 R204P198-S200 PolarHBondContact O-N 3.3Å; S200-S203 PolarHBondContact O-OG 3.28Å; S200-R204 WeakPolarHBondContact O-CB 3.32Å; S200-R204 PolarHBondContact O-N 3.19Å
201L47.9Very low54.8Low115 Ų115122.6 Ų122.660%0.60260%0.599SS**Hα-helixtrans-75.8-38.8179.3-83.5163.2000111.8P198 R204 T205P198-L201 PolarHBondContact O-N 2.86Å; L201-R204 PolarHBondContact O-N 2.88Å; L201-T205 PolarHBondContact O-N 3.28Å; L201-T205 VanDerWaalsContact O-N 3.12Å; L201-T205 PolarHBondContact O-OG1 2.77Å; L201-T205 VanDerWaalsContact O-OG1 3.07Å
202R54.3Low56.7Low151 Ų151113.9 Ų113.957%0.5758%0.577SS**Hα-helixtrans-73.5-38.2-176.4-150.3172.8-173.1174.90.6112R204 T205 L206R202-R204 VanDerWaalsContact C-N 3.35Å; R202-T205 PolarHBondContact O-N 2.9Å; R202-L206 WeakPolarHBondContact O-CG 3.22Å; R202-L206 PolarHBondContact O-N 2.9Å; R202-L206 VanDerWaalsContact O-N 3.12Å
203S59.7Low58.8Low68 Ų68107.5 Ų107.548%0.47655%0.547SS..Hα-helixtrans-66-37.5173.757.10000112L199 S200 L206 Y207L199-S203 PolarHBondContact O-N 3.24Å; L199-S203 PolarHBondContact O-OG 3.41Å; S200-S203 PolarHBondContact O-OG 3.28Å; S203-L206 PolarHBondContact O-N 2.76Å; S203-Y207 WeakPolarHBondContact O-CB 3.26Å; S203-Y207 PolarHBondContact O-N 3.36Å
204R62.8Low60.8Low159 Ų159104 Ų10460%0.653%0.529SS*.Hα-helixtrans-67.4-37.8177.8-160.2173.2-175.9175.10.7112.4S200 L201 R202 R208S200-R204 WeakPolarHBondContact O-CB 3.32Å; S200-R204 PolarHBondContact O-N 3.19Å; L201-R204 PolarHBondContact O-N 2.88Å; R202-R204 VanDerWaalsContact C-N 3.35Å; R204-R208 WeakPolarHBondContact O-CB 3.1Å; R204-R208 WeakPolarHBondContact O-CG 3.33Å; R204-R208 PolarHBondContact O-N 2.94Å
205T68.3Low63.1Low79 Ų79105.1 Ų105.149%0.48552%0.522SS..Hα-helixtrans-66.9-44.5174.2-52.30000111.7L201 R202 Y207 R208 M209L201-T205 PolarHBondContact O-N 3.28Å; L201-T205 VanDerWaalsContact O-N 3.12Å; L201-T205 PolarHBondContact O-OG1 2.77Å; L201-T205 VanDerWaalsContact O-OG1 3.07Å; R202-T205 PolarHBondContact O-N 2.9Å; T205-Y207 VanDerWaalsContact C-N 3.34Å; T205-Y207 PolarHBondContact O-N 3.12Å; T205-R208 PolarHBondContact O-N 3.22Å; T205-M209 WeakPolarHBondContact O-CG 3.43Å; T205-M209 PolarHBondContact O-N 3.29Å
206L67.6Low65Low56 Ų56100.9 Ų100.929%0.29350%0.502SS..Hα-helixtrans-62.6-41.3176.2-70.4176000111.9V83 R202 S203 M209 L210V83-L206 HydrophobicContact CG2-CD2 3.5Å; R202-L206 WeakPolarHBondContact O-CG 3.22Å; R202-L206 PolarHBondContact O-N 2.9Å; R202-L206 VanDerWaalsContact O-N 3.12Å; S203-L206 PolarHBondContact O-N 2.76Å; L206-M209 PolarHBondContact O-N 3.42Å; L206-L210 WeakPolarHBondContact O-CB 3.35Å; L206-L210 PolarHBondContact O-N 3.48Å
207Y72.4Confident66.8Low159 Ų15997.3 Ų97.362%0.62449%0.492SS*.Hα-helixtrans-61.9-44.8174.9-173.6-95.7000111.6S203 T205 M209 L210 V211S203-Y207 WeakPolarHBondContact O-CB 3.26Å; S203-Y207 PolarHBondContact O-N 3.36Å; T205-Y207 VanDerWaalsContact C-N 3.34Å; T205-Y207 PolarHBondContact O-N 3.12Å; Y207-M209 PolarHBondContact O-N 3.48Å; Y207-L210 PolarHBondContact O-N 3.07Å; Y207-V211 HydrophobicContact CD1-CG2 3.94Å; Y207-V211 HydrophobicContact CE1-CG2 3.59Å; Y207-V211 HydrophobicContact CE2-CG2 4.43Å; Y207-V211 WeakPolarHBondContact O-CB 3.15Å; Y207-V211 VanDerWaalsContact O-CG2 3.28Å; Y207-V211 WeakPolarHBondContact O-CG2 3.36Å; Y207-V211 PolarHBondContact O-N 3.12Å
208R74.1Confident68.9Low167 Ų16797.3 Ų97.363%0.6349%0.485SS*.Hα-helixtrans-61.6-42175.9-77.3178.5172.7-172.8-2.9112.5R204 T205 V211 A212R204-R208 WeakPolarHBondContact O-CB 3.1Å; R204-R208 WeakPolarHBondContact O-CG 3.33Å; R204-R208 PolarHBondContact O-N 2.94Å; T205-R208 PolarHBondContact O-N 3.22Å; R208-V211 PolarHBondContact O-N 2.97Å; R208-A212 WeakPolarHBondContact O-CB 3.41Å; R208-A212 PolarHBondContact O-N 2.87Å
209M74.2Confident70.7Confident95 Ų9598.5 Ų98.547%0.46848%0.483SS..Hα-helixtrans-63.4-43.7175.6-72.8179.963.300111.7V83 T205 L206 Y207 A212 E213V83-M209 HydrophobicContact CG1-CE 4.32Å; T205-M209 WeakPolarHBondContact O-CG 3.43Å; T205-M209 PolarHBondContact O-N 3.29Å; L206-M209 PolarHBondContact O-N 3.42Å; Y207-M209 PolarHBondContact O-N 3.48Å; M209-A212 PolarHBondContact O-N 3.29Å; M209-E213 WeakPolarHBondContact O-CB 3.34Å; M209-E213 PolarHBondContact O-N 3.23Å
210L75.6Confident71.8Confident53 Ų5396.1 Ų96.128%0.27748%0.476SS..Hα-helixtrans-65.5-41.8178.2-169.3120.3000111.8L81 V89 L206 Y207 A212 E213 L214L81-L210 HydrophobicContact CD1-CD1 3.88Å; V89-L210 HydrophobicContact CG1-CD1 4.47Å; L206-L210 WeakPolarHBondContact O-CB 3.35Å; L206-L210 PolarHBondContact O-N 3.48Å; Y207-L210 PolarHBondContact O-N 3.07Å; L210-A212 VanDerWaalsContact C-N 3.33Å; L210-E213 PolarHBondContact O-N 3.33Å; L210-L214 HydrophobicContact CD2-CD1 3.69Å; L210-L214 HydrophobicContact CG-CD1 4.24Å; L210-L214 WeakPolarHBondContact O-CB 3.34Å; L210-L214 WeakPolarHBondContact O-CG 3.46Å; L210-L214 PolarHBondContact O-N 2.74Å
211V79.1Confident72.7Confident46 Ų4699 Ų9928%0.27948%0.481SS..Hα-helixtrans-63.1-40.2173.9170.60000111.1Y207 R208 K215Y207-V211 HydrophobicContact CD1-CG2 3.94Å; Y207-V211 HydrophobicContact CE1-CG2 3.59Å; Y207-V211 HydrophobicContact CE2-CG2 4.43Å; Y207-V211 WeakPolarHBondContact O-CB 3.15Å; Y207-V211 VanDerWaalsContact O-CG2 3.28Å; Y207-V211 WeakPolarHBondContact O-CG2 3.36Å; Y207-V211 PolarHBondContact O-N 3.12Å; R208-V211 PolarHBondContact O-N 2.97Å; V211-K215 HydrophobicContact CG1-CD 4.33Å; V211-K215 WeakPolarHBondContact O-CB 3.33Å; V211-K215 VanDerWaalsContact O-CG 3.32Å; V211-K215 WeakPolarHBondContact O-CG 3.48Å; V211-K215 PolarHBondContact O-N 3.26Å
212A79.1Confident73.7Confident51 Ų5196.9 Ų96.942%0.42147%0.473SS..Hα-helixtrans-64.8-45.617600000111.7R208 M209 L210 L214 K215 T216R208-A212 WeakPolarHBondContact O-CB 3.41Å; R208-A212 PolarHBondContact O-N 2.87Å; M209-A212 PolarHBondContact O-N 3.29Å; L210-A212 VanDerWaalsContact C-N 3.33Å; A212-L214 PolarHBondContact O-N 3.35Å; A212-K215 PolarHBondContact O-N 3.19Å; A212-T216 WeakPolarHBondContact O-CG2 3.39Å; A212-T216 PolarHBondContact O-N 2.88Å; A212-T216 PolarHBondContact O-OG1 3.47Å
213E78.1Confident74.1Confident65 Ų6595.9 Ų95.930%0.30448%0.475SS..Hα-helixtrans-66.2-36178-159.6-167.2148.600112.4M209 L210 T216 K217M209-E213 WeakPolarHBondContact O-CB 3.34Å; M209-E213 PolarHBondContact O-N 3.23Å; L210-E213 PolarHBondContact O-N 3.33Å; E213-T216 WeakPolarHBondContact CA-OG1 3.41Å; E213-T216 PolarHBondContact O-OG1 3.46Å; E213-K217 WeakPolarHBondContact O-CB 3.28Å; E213-K217 WeakPolarHBondContact O-CG 3.32Å; E213-K217 PolarHBondContact O-N 2.92Å; E213-K217 IonicContact OE1-NZ 2.64Å; E213-K217 PolarHBondContact OE1-NZ 3.48Å
214L81Confident74Confident89 Ų8996.9 Ų96.947%0.46648%0.481SS..Hα-helixtrans-68.1-41.9173-78.5168.4000111.5L210 A212 K217 I218L210-L214 HydrophobicContact CD2-CD1 3.69Å; L210-L214 HydrophobicContact CG-CD1 4.24Å; L210-L214 WeakPolarHBondContact O-CB 3.34Å; L210-L214 WeakPolarHBondContact O-CG 3.46Å; L210-L214 PolarHBondContact O-N 2.74Å; A212-L214 PolarHBondContact O-N 3.35Å; L214-K217 PolarHBondContact O-N 3.38Å; L214-I218 WeakPolarHBondContact O-CB 3.36Å; L214-I218 WeakPolarHBondContact O-CD1 3.47Å; L214-I218 VanDerWaalsContact O-CG1 3.23Å; L214-I218 WeakPolarHBondContact O-CG1 3.41Å; L214-I218 PolarHBondContact O-N 3.09Å
215K85.1Confident73.6Confident134 Ų13495.7 Ų95.758%0.58349%0.486SS*.Hα-helixtrans-61.1-44.1175.5-80.9-176.3175.9-1680111.9V211 A212 I218 Q219V211-K215 HydrophobicContact CG1-CD 4.33Å; V211-K215 WeakPolarHBondContact O-CB 3.33Å; V211-K215 VanDerWaalsContact O-CG 3.32Å; V211-K215 WeakPolarHBondContact O-CG 3.48Å; V211-K215 PolarHBondContact O-N 3.26Å; A212-K215 PolarHBondContact O-N 3.19Å; K215-I218 PolarHBondContact O-N 2.91Å; K215-Q219 WeakPolarHBondContact O-CB 3.36Å; K215-Q219 VanDerWaalsContact O-CG 3.32Å; K215-Q219 WeakPolarHBondContact O-CG 3.48Å; K215-Q219 PolarHBondContact O-N 3.27Å
216T80.7Confident73.1Confident79 Ų7998.5 Ų98.549%0.48550%0.498SS..Hα-helixtrans-67.2-39.2178.355.60000112A212 E213 Q219 S220A212-T216 WeakPolarHBondContact O-CG2 3.39Å; A212-T216 PolarHBondContact O-N 2.88Å; A212-T216 PolarHBondContact O-OG1 3.47Å; E213-T216 WeakPolarHBondContact CA-OG1 3.41Å; E213-T216 PolarHBondContact O-OG1 3.46Å; T216-Q219 PolarHBondContact O-N 2.94Å; T216-S220 WeakPolarHBondContact O-CB 3.37Å; T216-S220 PolarHBondContact O-N 3.4Å; T216-S220 PolarHBondContact O-OG 2.77Å
217K80.4Confident72.3Confident110 Ų11098.8 Ų98.848%0.47851%0.508SS..Hα-helixtrans-62.3-48174.4-82.2173171.1158.80112.2E213 L214 Q219 S220 E221E213-K217 WeakPolarHBondContact O-CB 3.28Å; E213-K217 WeakPolarHBondContact O-CG 3.32Å; E213-K217 PolarHBondContact O-N 2.92Å; E213-K217 IonicContact OE1-NZ 2.64Å; E213-K217 PolarHBondContact OE1-NZ 3.48Å; L214-K217 PolarHBondContact O-N 3.38Å; K217-Q219 VanDerWaalsContact C-N 3.34Å; K217-Q219 PolarHBondContact O-N 3.39Å; K217-S220 WeakPolarHBondContact CA-OG 3.36Å; K217-S220 PolarHBondContact O-N 2.76Å; K217-S220 PolarHBondContact O-OG 3.27Å; K217-E221 PolarHBondContact O-N 2.91Å
218I80.1Confident71.2Confident101 Ų10195.5 Ų95.552%0.51851%0.514SS..Hα-helixtrans-60.9-44.3177-67.3165.4000110.6L214 K215 E221 T222L214-I218 WeakPolarHBondContact O-CB 3.36Å; L214-I218 WeakPolarHBondContact O-CD1 3.47Å; L214-I218 VanDerWaalsContact O-CG1 3.23Å; L214-I218 WeakPolarHBondContact O-CG1 3.41Å; L214-I218 PolarHBondContact O-N 3.09Å; K215-I218 PolarHBondContact O-N 2.91Å; I218-E221 PolarHBondContact O-N 2.88Å; I218-T222 PolarHBondContact O-N 2.92Å; I218-T222 PolarHBondContact O-OG1 2.96Å
219Q78.6Confident70.2Confident112 Ų11293.7 Ų93.752%0.52352%0.521SS..Hα-helixtrans-60.8-45.4176.4-78.9175.5-20.600112.1K215 T216 K217 E221 T222 E223K215-Q219 WeakPolarHBondContact O-CB 3.36Å; K215-Q219 VanDerWaalsContact O-CG 3.32Å; K215-Q219 WeakPolarHBondContact O-CG 3.48Å; K215-Q219 PolarHBondContact O-N 3.27Å; T216-Q219 PolarHBondContact O-N 2.94Å; K217-Q219 VanDerWaalsContact C-N 3.34Å; K217-Q219 PolarHBondContact O-N 3.39Å; Q219-E221 VanDerWaalsContact C-N 3.33Å; Q219-E221 PolarHBondContact O-N 3.49Å; Q219-T222 VanDerWaalsContact CA-OG1 3.26Å; Q219-T222 WeakPolarHBondContact CA-OG1 3.49Å; Q219-T222 PolarHBondContact O-N 2.95Å; Q219-T222 PolarHBondContact O-OG1 3.37Å; Q219-E223 WeakPolarHBondContact O-CB 3.23Å; Q219-E223 WeakPolarHBondContact O-CG 3.44Å; Q219-E223 PolarHBondContact O-N 3.19Å
220S75Confident69.1Low57 Ų57100 Ų10040%0.39954%0.54SS..Hα-helixtrans-65.2-33.3177.568.70000113.2T216 K217 C224T216-S220 WeakPolarHBondContact O-CB 3.37Å; T216-S220 PolarHBondContact O-N 3.4Å; T216-S220 PolarHBondContact O-OG 2.77Å; K217-S220 WeakPolarHBondContact CA-OG 3.36Å; K217-S220 PolarHBondContact O-N 2.76Å; K217-S220 PolarHBondContact O-OG 3.27Å; S220-C224 VanDerWaalsContact O-CB 3.28Å; S220-C224 WeakPolarHBondContact O-CB 3.47Å; S220-C224 PolarHBondContact O-N 3.05Å; S220-C224 PolarHBondContact O-SG 2.96Å
221E71.5Confident67.7Low132 Ų132107.2 Ų107.262%0.61757%0.569SS**Hα-helixtrans-70-40.2172.8-78-178.7170.800111.4K217 I218 Q219 N225K217-E221 PolarHBondContact O-N 2.91Å; I218-E221 PolarHBondContact O-N 2.88Å; Q219-E221 VanDerWaalsContact C-N 3.33Å; Q219-E221 PolarHBondContact O-N 3.49Å; E221-N225 WeakPolarHBondContact O-CB 3.48Å; E221-N225 PolarHBondContact O-N 2.8Å; E221-N225 PolarHBondContact O-ND2 3.23Å; E221-N225 VanDerWaalsContact O-ND2 3.1Å
222T69.2Low65.8Low72 Ų72116.2 Ų116.244%0.44260%0.598SS.*Hα-helixtrans-66.4-36.9173.941.50000113I218 Q219 N225 L226I218-T222 PolarHBondContact O-N 2.92Å; I218-T222 PolarHBondContact O-OG1 2.96Å; Q219-T222 VanDerWaalsContact CA-OG1 3.26Å; Q219-T222 WeakPolarHBondContact CA-OG1 3.49Å; Q219-T222 PolarHBondContact O-N 2.95Å; Q219-T222 PolarHBondContact O-OG1 3.37Å; T222-N225 PolarHBondContact O-N 3.33Å; T222-L226 PolarHBondContact O-N 3.39Å
223E63.3Low64.4Low130 Ų130120.7 Ų120.761%0.60762%0.62SS**Hα-helixtrans-72.1-38.8176.1-73.4175.5-175.500111.8Q219 N225 L226 A227Q219-E223 WeakPolarHBondContact O-CB 3.23Å; Q219-E223 WeakPolarHBondContact O-CG 3.44Å; Q219-E223 PolarHBondContact O-N 3.19Å; E223-N225 VanDerWaalsContact C-N 3.31Å; E223-N225 PolarHBondContact O-N 3.01Å; E223-L226 PolarHBondContact O-N 3.02Å; E223-A227 WeakPolarHBondContact O-CB 3.44Å; E223-A227 PolarHBondContact O-N 2.92Å
224C56.9Low62.8Low88 Ų88123.5 Ų123.560%0.59564%0.644SS**Hα-helixtrans-63.6-35.1172.2-84.80000112.6S220 L226 A228S220-C224 VanDerWaalsContact O-CB 3.28Å; S220-C224 WeakPolarHBondContact O-CB 3.47Å; S220-C224 PolarHBondContact O-N 3.05Å; S220-C224 PolarHBondContact O-SG 2.96Å; C224-L226 VanDerWaalsContact C-N 3.32Å; C224-A228 PolarHBondContact O-N 2.86Å
225N55.9Low60.7Low134 Ų134130.4 Ų130.472%0.71767%0.666SS**Hα-helixtrans-72.5-23.4175.7-70.5-27.8000113E221 T222 E223E221-N225 WeakPolarHBondContact O-CB 3.48Å; E221-N225 PolarHBondContact O-N 2.8Å; E221-N225 PolarHBondContact O-ND2 3.23Å; E221-N225 VanDerWaalsContact O-ND2 3.1Å; T222-N225 PolarHBondContact O-N 3.33Å; E223-N225 VanDerWaalsContact C-N 3.31Å; E223-N225 PolarHBondContact O-N 3.01Å
226L56Low58.7Low138 Ų138129.6 Ų129.672%0.72368%0.677SS**Hα-helixtrans-91.2-26.9174.6-80.6157.8000113.2T222 E223 C224 T229T222-L226 PolarHBondContact O-N 3.39Å; E223-L226 PolarHBondContact O-N 3.02Å; C224-L226 VanDerWaalsContact C-N 3.32Å; L226-T229 PolarHBondContact O-OG1 3.3Å
227A51.8Low56.6Low62 Ų62129.3 Ų129.351%0.51269%0.69SS.*Hα-helixtrans-89.7-7.2-177.600000114.3E223 T229 R230E223-A227 WeakPolarHBondContact O-CB 3.44Å; E223-A227 PolarHBondContact O-N 2.92Å; A227-T229 PolarHBondContact O-N 3.01Å; A227-R230 PolarHBondContact O-N 2.96Å; A227-R230 VanDerWaalsContact O-N 3.13Å
228A50.2Low54.6Low91 Ų91130 Ų13075%0.75271%0.708SS**THydrogen-bonded Turntrans-61.7-4.4175.500000114.4C224C224-A228 PolarHBondContact O-N 2.86Å
229T53Low52.8Low128 Ų128130.1 Ų130.179%0.78572%0.718SS**THydrogen-bonded Turntrans-102.5-4.1174.529.10000115.8L226 A227L226-T229 PolarHBondContact O-OG1 3.3Å; A227-T229 PolarHBondContact O-N 3.01Å
230R49.4Very low51.1Low227 Ų227134.4 Ų134.486%0.85774%0.738SS**SBendtrans-143.5105177.9-82.6-174170.4175.5-3.7114.2A227A227-R230 PolarHBondContact O-N 2.96Å; A227-R230 VanDerWaalsContact O-N 3.13Å
231K47.2Very low49.2Very low206 Ų206140.5 Ų140.590%0.89676%0.76SS**  trans21.8115.8148.1-68-178.8177.1179.40119.2
232R39.1Very low47.2Very low235 Ų235139.6 Ų139.689%0.88777%0.769SS**  trans26.9118.6135.5-72.3-178.2173.2166.9-1.8119
233T50.3Low45.3Very low144 Ų144142 Ų14288%0.88379%0.789SS**  177.1159.7118.322.60000112.4
234P43.7Very low43.9Very low124 Ų124141.5 Ų141.581%0.80579%0.794SS**  trans-98.1162.2-150.538.1-35.6000116.9
235Y37.6Very low42.7Very low234 Ų234148 Ų14892%0.91881%0.806SS**  trans-53.4133.7178.8-115-105.4000115.6
236S42.5Very low41.8Very low118 Ų118145.8 Ų145.883%0.82580%0.799SS**  trans-105.8121.9160.1170.10000108.9
237G35.9Very low41Very low72 Ų72142.2 Ų142.274%0.74279%0.786SS**  trans-98.4130.5-178.300000112.2
238S39.6Very low40.4Very low125 Ų125148.9 Ų148.987%0.87481%0.806SS**  trans-134.1120.3157.968.90000108.9
239S42.8Very low39.9Very low104 Ų104150 Ų15073%0.72780%0.797SS**  trans-128.198179.7164.90000108.1Q241S239-Q241 PolarHBondContact O-N 2.92Å
240Q40.9Very low39.7Very low201 Ų201152.5 Ų152.594%0.93980%0.797SS**  trans-69.3116.1165.3-74.7-169.9-8.600109.5
241Q35.3Very low39.8Very low185 Ų185145.2 Ų145.286%0.86478%0.775SS**  trans-88113.4175.8-77.6178.5-2.300110.1S239S239-Q241 PolarHBondContact O-N 2.92Å
242S31.4Very low40.3Very low113 Ų113137.7 Ų137.779%0.7975%0.747SS**  trans-96.5130158.695.50000109
243S29.1Very low41.2Very low123 Ų123126.7 Ų126.786%0.8671%0.705SS**  trans-95.3122.1-172.664.50000110.7
244V32.5Very low41.6Very low119 Ų119123.6 Ų123.672%0.72168%0.683SS**  trans-123.3120.4170.4-177.20000108.6
245R32.8Very low42.2Very low225 Ų225122 Ų12285%0.84966%0.661SS**PPolyproline II helixtrans-68.8136.5-179.4-80.1-178.5173.2175.3-2.1111.3S247R245-S247 PolarHBondContact O-N 3.46Å
246P36.6Very low43.2Very low87 Ų87112.4 Ų112.457%0.56562%0.624SS**PPolyproline II helixtrans-72120.3167.8-9.124.7000109.9R85R85-P246 HydrophobicContact CG-CG 4.47Å
247S39.9Very low43.6Very low64 Ų64110.1 Ų110.145%0.44862%0.619SS.*PPolyproline II helixtrans-66.9128.3170.952.40000110.4R245 M249R245-S247 PolarHBondContact O-N 3.46Å; S247-M249 PolarHBondContact O-N 3.42Å
248Q37.9Very low44.8Very low201 Ų201109.3 Ų109.394%0.93960%0.598SS**  trans-60.894164.5-67.3-179.7-7.500108.7
249M41.1Very low45Very low116 Ų116109.6 Ų109.657%0.57160%0.6SS**  trans-107114.7178.4-80.8-169109.500111.5S247S247-M249 PolarHBondContact O-N 3.42Å
250K48.2Very low45.2Very low179 Ų179107.7 Ų107.778%0.77859%0.591SS**  trans-56.9126.7166.8-92.4170.5167.8175.10111.4
251I50.9Low45.1Very low75 Ų75102 Ų10239%0.38559%0.585SS.*  trans36104.3156.7-44.3159.3000116.8F253 Y269I251-F253 PolarHBondContact O-N 3.48Å; I251-Y269 HydrophobicContact CD1-CE2 4.44Å; I251-Y269 WeakPolarHBondContact CD1-OH 3.28Å; I251-Y269 HydrophobicContact CG2-CE1 4.15Å; I251-Y269 WeakPolarHBondContact CG2-OH 3.48Å
252P58Low45.5Very low48 Ų4898 Ų9831%0.31257%0.57SS.*SBendtrans-86.299153.930.6-20.6000109.7Y80 V94Y80-P252 HydrophobicContact CD2-CG 3.98Å; Y80-P252 HydrophobicContact CE1-CB 4.09Å; Y80-P252 HydrophobicContact CE1-CG 4.16Å; Y80-P252 HydrophobicContact CE2-CB 3.67Å; Y80-P252 HydrophobicContact CE2-CG 3.4Å; Y80-P252 VanDerWaalsContact CE2-CG 3.4Å; Y80-P252 WeakPolarHBondContact OH-CB 3.25Å; V94-P252 HydrophobicContact CB-CG 4.3Å; V94-P252 HydrophobicContact CG1-CG 4.08Å; V94-P252 WeakPolarHBondContact CG1-O 3.43Å; V94-P252 HydrophobicContact CG2-CG 3.83Å
253F58.2Low46Very low4 Ų498.5 Ų98.52%0.01857%0.568CS.*  trans176.179.8143.8-84.8-56.2000107.6F28 I63 L65 Q78 V94 R96 I251F28-F253 HydrophobicContact CD1-CD1 4.18Å; F28-F253 HydrophobicContact CD1-CE1 4.23Å; F28-F253 AromaticContact CE1-CD1 3.97Å; F28-F253 HydrophobicContact CE1-CD1 3.97Å; F28-F253 HydrophobicContact CE1-CE1 4.41Å; I63-F253 HydrophobicContact CG2-CE1 4.29Å; L65-F253 HydrophobicContact CB-CZ 4.4Å; L65-F253 HydrophobicContact CD2-CD1 4.47Å; L65-F253 HydrophobicContact CD2-CE1 3.44Å; L65-F253 VanDerWaalsContact CD2-CE1 3.44Å; L65-F253 HydrophobicContact CD2-CZ 3.7Å; Q78-F253 HydrophobicContact CB-CE1 4.1Å; Q78-F253 HydrophobicContact CB-CE2 3.9Å; Q78-F253 HydrophobicContact CB-CZ 3.29Å; Q78-F253 HydrophobicContact CG-CZ 4.36Å; V94-F253 HydrophobicContact CB-CE2 4.41Å; V94-F253 HydrophobicContact CG1-CD2 3.87Å; V94-F253 HydrophobicContact CG1-CE2 4.06Å; R96-F253 HydrophobicContact CB-CD2 4.16Å; R96-F253 PolarHBondContact NH1-O 2.95Å; I251-F253 PolarHBondContact O-N 3.48Å
254L58.7Low46.3Very low78 Ų7896.5 Ų96.541%0.40855%0.554SS.*  trans-138.7140.5147-117.1111000105D258 A260L254-D258 WeakPolarHBondContact CB-OD1 3.26Å; L254-D258 WeakPolarHBondContact CB-OD2 3.41Å; L254-D258 WeakPolarHBondContact CD2-OD1 3.49Å; L254-A260 HydrophobicContact CD2-CB 4.04Å
255R56.9Low46.4Very low92 Ų92100.3 Ų100.335%0.34756%0.561SS.*  trans-176.2108.4159.5-100.6161.6-164.3-135.6-5.1106.1F29 G30 F31 D258F29-R255 CarbonylContact C-O 3.56Å; F29-R255 VanDerWaalsContact C-O 3.3Å; F29-R255 CarbonylContact O-C 3.57Å; G30-R255 CarbonylContact C-O 3.56Å; G30-R255 WeakPolarHBondContact CA-O 3.41Å; G30-R255 PolarHBondContact N-O 3.18Å; F31-R255 PolarHBondContact N-O 3.27Å; R255-D258 VanDerWaalsContact CA-CG 3.42Å; R255-D258 WeakPolarHBondContact CA-OD1 3.36Å; R255-D258 WeakPolarHBondContact CA-OD2 3.49Å; R255-D258 HydrophobicContact CG-CB 4.49Å; R255-D258 WeakPolarHBondContact CG-OD2 3.47Å; R255-D258 PolarHBondContact N-OD1 2.77Å; R255-D258 VanDerWaalsContact N-OD1 3.09Å; R255-D258 PolarHBondContact N-OD2 3.27Å
256F57.4Low46.4Very low31 Ų3194.5 Ų94.514%0.13656%0.561CS.*SBend-144.6101121.7-144.5-68.8000106.3F29 F31 K32 A53 A56 T57 V60 L137 D258F29-F256 HydrophobicContact CB-CD2 3.75Å; F29-F256 HydrophobicContact CB-CE2 3.33Å; F29-F256 HydrophobicContact CB-CZ 4.36Å; F29-F256 HydrophobicContact CG-CE2 4.29Å; F29-F256 WeakPolarHBondContact O-CD2 3.36Å; F31-F256 WeakPolarHBondContact O-CB 3.32Å; F31-F256 PolarHBondContact O-N 3.09Å; K32-F256 HydrophobicContact CB-CB 4.13Å; A53-F256 WeakPolarHBondContact O-CZ 3.5Å; A56-F256 HydrophobicContact CB-CE1 3.81Å; A56-F256 HydrophobicContact CB-CZ 4.31Å; T57-F256 HydrophobicContact CG2-CE2 3.63Å; T57-F256 HydrophobicContact CG2-CZ 3.44Å; T57-F256 VanDerWaalsContact CG2-CZ 3.44Å; V60-F256 HydrophobicContact CG2-CD1 4.05Å; V60-F256 HydrophobicContact CG2-CE1 3.71Å; V60-F256 HydrophobicContact CG2-CZ 4.1Å; L137-F256 HydrophobicContact CD2-CE2 4.05Å; F256-D258 PolarHBondContact N-OD1 2.88Å; F256-D258 PolarHBondContact O-N 3.1Å
257G52.1Low46.7Very low71 Ų7194.5 Ų94.573%0.73255%0.554SS**SBendtrans76.1-14.6-17400000116.3S259G257-S259 PolarHBondContact O-N 3.19Å
258D60Low46.6Very low55 Ų55100.9 Ų100.929%0.29458%0.576SS.*  trans1893.1176.6-78.16.2000117.6L254 R255 F256L254-D258 WeakPolarHBondContact CB-OD1 3.26Å; L254-D258 WeakPolarHBondContact CB-OD2 3.41Å; L254-D258 WeakPolarHBondContact CD2-OD1 3.49Å; R255-D258 VanDerWaalsContact CA-CG 3.42Å; R255-D258 WeakPolarHBondContact CA-OD1 3.36Å; R255-D258 WeakPolarHBondContact CA-OD2 3.49Å; R255-D258 HydrophobicContact CG-CB 4.49Å; R255-D258 WeakPolarHBondContact CG-OD2 3.47Å; R255-D258 PolarHBondContact N-OD1 2.77Å; R255-D258 VanDerWaalsContact N-OD1 3.09Å; R255-D258 PolarHBondContact N-OD2 3.27Å; F256-D258 PolarHBondContact N-OD1 2.88Å; F256-D258 PolarHBondContact O-N 3.1Å
259S45.4Very low46.8Very low130 Ų13096.8 Ų96.891%0.90955%0.553SS**  -142.8111.5114-72.60000107.8G257G257-S259 PolarHBondContact O-N 3.19Å
260A46.1Very low46.7Very low65 Ų6595.3 Ų95.354%0.53755%0.554SS.*  trans-109.4106.1173.400000106.7L254 D262L254-A260 HydrophobicContact CD2-CB 4.04Å; A260-D262 PolarHBondContact O-N 3.46Å
261G39.4Very low46.3Very low80 Ų8093 Ų9383%0.82555%0.55SS*.SBendtrans-61.811.8-173.100000116.8
262D42.3Very low45.9Very low103 Ų10396 Ų9655%0.55156%0.562SS**  trans-134.286.3-169.8-78.6-47.3000111.1A260 S264A260-D262 PolarHBondContact O-N 3.46Å; D262-S264 PolarHBondContact O-N 3.21Å
263V42.4Very low45Very low123 Ų123101.5 Ų101.575%0.74558%0.581SS**  trans-74.763.9151.5-1760000106.8K265V263-K265 PolarHBondContact O-N 3.02Å
264S35.9Very low44Very low81 Ų81107.4 Ų107.457%0.56662%0.617SS**  trans-87.7100173.436.90000108.9D262D262-S264 PolarHBondContact O-N 3.21Å
265K34.9Very low42.8Very low198 Ų198107.6 Ų107.686%0.86162%0.622SS**SBendtrans51.7105.8152.7-62.1-178.51791780118V263V263-K265 PolarHBondContact O-N 3.02Å
266A33.1Very low41.8Very low104 Ų104107.1 Ų107.186%0.8664%0.637SS**  trans53.979.6141.200000118.2
267E42.3Very low40.7Very low86 Ų86111.8 Ų111.840%0.40267%0.671SS.*  trans-92.2130.3144.2-84.8-177.5166.400107.7R96 R121 Y269R96-E267 IonicContact NE-OE2 2.69Å; R121-E267 IonicContact CZ-OE1 3.57Å; R121-E267 IonicContact NH1-OE1 2.9Å; R121-E267 PolarHBondContact NH1-OE1 3.3Å; R121-E267 IonicContact NH2-OE1 3.24Å; E267-Y269 WeakPolarHBondContact O-CD2 3.44Å; E267-Y269 WeakPolarHBondContact O-CE2 3.4Å; E267-Y269 PolarHBondContact O-N 2.85Å
268E38.5Very low40Very low199 Ų199115 Ų11593%0.9368%0.676SS**  trans-63.7111.8-170.5-164.5176.8-168.600112.3
269Y42Very low39Very low114 Ų114116.9 Ų116.945%0.44770%0.699SS.*  trans-90.7111.6174.6-64-84.9000109.9I251 E267 L271I251-Y269 HydrophobicContact CD1-CE2 4.44Å; I251-Y269 WeakPolarHBondContact CD1-OH 3.28Å; I251-Y269 HydrophobicContact CG2-CE1 4.15Å; I251-Y269 WeakPolarHBondContact CG2-OH 3.48Å; E267-Y269 WeakPolarHBondContact O-CD2 3.44Å; E267-Y269 WeakPolarHBondContact O-CE2 3.4Å; E267-Y269 PolarHBondContact O-N 2.85Å; Y269-L271 PolarHBondContact O-N 3.42Å
270S39.2Very low38.3Very low85 Ų85116.4 Ų116.459%0.59469%0.691SS**  trans-85101.5168.3-167.60000110.2Q272S270-Q272 PolarHBondContact O-N 2.75Å
271L38.8Very low37.9Very low132 Ų132119.5 Ų119.569%0.69171%0.707SS**  trans-81.385170.4-101.2150.6000109.3L92 Y269 K273L92-L271 HydrophobicContact CD1-CD2 3.59Å; Y269-L271 PolarHBondContact O-N 3.42Å; L271-K273 PolarHBondContact O-N 2.91Å
272Q42.5Very low37.5Very low138 Ų138121.1 Ų121.165%0.64570%0.701SS**  trans-77.7104.8171.4-81.5-177.4-2300110.6S270 V274S270-Q272 PolarHBondContact O-N 2.75Å; Q272-V274 PolarHBondContact O-N 3.44Å
273K39.1Very low37.4Very low163 Ų163122.2 Ų122.271%0.70972%0.717SS**  trans-79.591.6172.8-173.1-169.4177.2-1760109.3L271 T275L271-K273 PolarHBondContact O-N 2.91Å; K273-T275 WeakPolarHBondContact CG-OG1 3.2Å; K273-T275 PolarHBondContact O-N 3.35Å; K273-T275 VanDerWaalsContact O-N 3.09Å
274V37Very low36.9Very low128 Ų128122.2 Ų122.278%0.77672%0.717SS**  trans-71.1107.3170.1-174.70000108.4Q272Q272-V274 PolarHBondContact O-N 3.44Å
275T33.9Very low37.2Very low82 Ų82124.3 Ų124.350%0.50373%0.732SS.*  trans-119.5109.6173-390000106.6K273K273-T275 WeakPolarHBondContact CG-OG1 3.2Å; K273-T275 PolarHBondContact O-N 3.35Å; K273-T275 VanDerWaalsContact O-N 3.09Å
276A36.6Very low37.3Very low81 Ų81118.2 Ų118.267%0.66973%0.725SS**  trans-66.5142.2172.100000109.8
277P33.4Very low37.5Very low130 Ų130125.3 Ų125.384%0.84473%0.73SS**  trans-77.5126.5178.631.6-30.3000109.3
278V37.8Very low37.2Very low138 Ų138126.6 Ų126.684%0.83674%0.744SS**  trans-112.9122.3160.9175.50000106.1
279A38Very low37.3Very low95 Ų95124.4 Ų124.479%0.78574%0.737SS**  trans-59.3140.7-173.800000112.8
280T30.6Very low37.2Very low120 Ų120123.7 Ų123.774%0.73675%0.745SS**  trans-85.2135.6174.6-36.50000109.6V282T280-V282 HydrophobicContact CG2-CG2 4.3Å
281C37.5Very low37.4Very low129 Ų129128 Ų12887%0.87276%0.756SS**  trans-123.8120.5152-57.30000107.9
282V31.6Very low37.6Very low115 Ų115132.5 Ų132.570%0.69776%0.764SS**  trans-76.5141.8177.21710000108.9T280T280-V282 HydrophobicContact CG2-CG2 4.3Å
283S39.4Very low37.7Very low126 Ų126133.2 Ų133.288%0.88177%0.767SS**  trans-160.4132.6139.1-121.10000111.9
284T33.4Very low37.9Very low122 Ų122133.4 Ų133.475%0.74877%0.77SS**  trans-99.8139.6-170.135.50000112.2
285S42.6Very low38.4Very low126 Ų126133 Ų13388%0.88177%0.768SS**  trans161.9131.7145.746.40000106.2
286G35.1Very low38.8Very low70 Ų70133.9 Ų133.972%0.72278%0.777SS**  cis114.683.320.200000108.7
287R38.7Very low39.3Very low252 Ų252141.6 Ų141.695%0.95179%0.789SS**  trans174.5159.7142.6-100.6171.2164-176.9-5.6113.2
288T36Very low39.8Very low114 Ų114140.3 Ų140.370%0.69978%0.781SS**  trans-127.2167.1-144.838.20000111.9
289L40.7Very low40.1Very low152 Ų152141.1 Ų141.180%0.79678%0.78SS**  trans73.8141.9158.5-63146000114.5
290T39.8Very low40.3Very low100 Ų100141.8 Ų141.861%0.61378%0.778SS**  cis-169.1148.2177.80000110.2
291E42.1Very low40.9Very low175 Ų175140.9 Ų140.982%0.81878%0.777SS**  trans46.5124135.7-65.3173.616200123.7
292R42.7Very low40.9Very low226 Ų226140.5 Ų140.585%0.85378%0.776SS**  177.5112.6109.8-103.8-178.7156.9162.9-4.2110.2
293E45.5Very low41.2Very low153 Ų153139 Ų13972%0.71578%0.784SS**  62104.395.8-98.7-175.9154.800114.2
294E42.4Very low41.3Very low167 Ų167144.6 Ų144.678%0.7879%0.786SS**  78.6130.2101.8-75.7-159.4155.600112
295V48Very low41.5Very low120 Ų120145 Ų14573%0.72779%0.79SS**  178.9135.681.1161.50000109.3
296S43.5Very low41.6Very low100 Ų100144 Ų14470%0.69979%0.789SS**  trans68.5106.2145.1-60.90000126
297R45.4Very low41.8Very low243 Ų243146.2 Ų146.292%0.91779%0.794SS**  71.1155.7105.9-83-162.2177.7171.32.2122.7
298P45.3Very low41.8Very low103 Ų103142 Ų14267%0.66979%0.789SS**  trans-117.7-177.3-136.443.9-32.8000113.8
299L44.6Very low42.1Very low156 Ų156142 Ų14282%0.81779%0.792SS**  trans171.1147.9134-92.7161.2000112.1
300S41.7Very low41.9Very low108 Ų108141 Ų14176%0.75580%0.796SS**  trans63.7142153.341.10000118.4
301S42.1Very low41.9Very low102 Ų102142 Ų14271%0.71380%0.802SS**  cis-176.1147.811.234.30000109.2
302S37.6Very low41.6Very low121 Ų121144.5 Ų144.585%0.84680%0.803SS**  trans40.7126147.770.80000122.1
303G38.7Very low41.5Very low83 Ų83141.7 Ų141.786%0.85680%0.797SS**  trans178106155.800000113.7
304R41.8Very low41Very low244 Ų244145.5 Ų145.592%0.92181%0.805SS**PPolyproline II helixtrans-52.5157.4-174-91.7173.9164.9-175.4-3.8117
305P37.2Very low40.6Very low129 Ų129147 Ų14784%0.83881%0.805SS**PPolyproline II helixtrans-88.4132.917035.1-28.4000111.5
306A43.9Very low40Very low105 Ų105146.2 Ų146.287%0.86881%0.805SS**PPolyproline II helixtrans-88.6134.3170.200000110.9
307S40.2Very low39.7Very low117 Ų117150.9 Ų150.982%0.81881%0.813SS**PPolyproline II helixtrans-70.6146.3-176.641.60000113.6
308L39.4Very low39.2Very low163 Ų163147.5 Ų147.585%0.85381%0.807SS**PPolyproline II helixtrans-85.6142.7171.4-68.7168.2000111
309P40.6Very low38.9Very low116 Ų116146.9 Ų146.975%0.75381%0.805SS**PPolyproline II helixtrans-85.1123.3166.131.8-27.8000110.8V311P309-V311 PolarHBondContact O-N 2.82Å
310C36.7Very low38.5Very low130 Ų130145.4 Ų145.488%0.87880%0.803SS**  trans-73.8104.3169.2-74.30000110.6
311V39.6Very low38.4Very low122 Ų122151.5 Ų151.574%0.73981%0.81SS**  trans-91.2104.1168.4179.70000109.5P309 K313P309-V311 PolarHBondContact O-N 2.82Å; V311-K313 HydrophobicContact CG1-CG 4.47Å; V311-K313 PolarHBondContact O-N 3.19Å
312R37.3Very low38.2Very low227 Ų227158.1 Ų158.186%0.85782%0.819SS**  trans-88.194.8178.5-159.2177.3-1711753.1109.3
313K39Very low38.4Very low167 Ų167158 Ų15873%0.72682%0.818SS**  trans-83113.2169.2-79.4-172.3176.1-177.70110.1V311 Y315V311-K313 HydrophobicContact CG1-CG 4.47Å; V311-K313 PolarHBondContact O-N 3.19Å; K313-Y315 HydrophobicContact CB-CE2 4.49Å
314R35.5Very low38.5Very low232 Ų232166 Ų16688%0.87582%0.822SS**  trans-74.7128.6165.5-68.2-176.1-179.6-154.11.2108.4
315Y35.3Very low38.5Very low199 Ų199158.9 Ų158.978%0.7882%0.815SS**  trans-111.9112.5162.2-85.7-87.2000107.6K313K313-Y315 HydrophobicContact CB-CE2 4.49Å
316S35.3Very low39Very low104 Ų104158.1 Ų158.173%0.72781%0.813SS**  trans-78.7127.2164.237.80000108.5
317F36.7Very low39.1Very low197 Ų197160.9 Ų160.986%0.86481%0.808SS**  trans-101.4104.7168.4-122.3-92.1000107.2
318H35.3Very low39.6Very low173 Ų173160.9 Ų160.980%0.80181%0.805SS**  trans-83.1111.9163.1-94.3-83.9000107.6
319S39.1Very low40.2Very low89 Ų89160.8 Ų160.862%0.62280%0.801SS**  trans-107.3101.116260.10000108.3W321S319-W321 PolarHBondContact O-N 3.44Å
320T35.7Very low40.6Very low126 Ų126162.4 Ų162.477%0.77380%0.803SS**  trans-76.697.8167.845.50000108.9
321W40Very low41.4Very low236 Ų236162.7 Ų162.789%0.89480%0.8SS**  trans-87.6104.7159-84.670.4000107.5S319 S323S319-W321 PolarHBondContact O-N 3.44Å; W321-S323 PolarHBondContact O-N 3.31Å
322R37Very low41.7Very low241 Ų241162.5 Ų162.591%0.90981%0.805SS**  trans-75110.8166.3-91.8-172.7-171.4-134.32.6108.1R324R322-R324 PolarHBondContact O-N 3.34Å
323S41.9Very low42.6Very low117 Ų117156.9 Ų156.982%0.81880%0.8SS**  trans-67.8117.8157.5-64.30000108.8W321 A325W321-S323 PolarHBondContact O-N 3.31Å; S323-A325 PolarHBondContact O-N 2.95Å
324R40Very low43.1Very low253 Ų253153.2 Ų153.296%0.95580%0.795SS**  trans-82.8100.2156.3-108-177.6175.4175.7-1.6106.2R322R322-R324 PolarHBondContact O-N 3.34Å
325A42.8Very low43.8Very low93 Ų93153 Ų15377%0.76980%0.795SS**PPolyproline II helixtrans-75.9129.9164.900000108.3S323S323-A325 PolarHBondContact O-N 2.95Å
326S47.7Very low44.7Very low113 Ų113150.5 Ų150.579%0.7979%0.794SS**PPolyproline II helixtrans-66.7126165.824.30000109.8
327E46.2Very low45.5Very low163 Ų163154.1 Ų154.176%0.76280%0.797SS**PPolyproline II helixtrans-63.4140.2163.9-91.2176.7123.100110.7
328P50.3Low46.8Very low117 Ų117154.1 Ų154.176%0.7682%0.821SS**  trans-108.6110.9149.431.2-19.3000109.3N330P328-N330 PolarHBondContact O-N 3.13Å
329Q53Low47.3Very low162 Ų162153.2 Ų153.276%0.75782%0.822SS**  trans-82101.9163-79.2-171.4-3.900108.9
330N48.1Very low47.8Very low150 Ų150156.5 Ų156.580%0.80283%0.833SS**  trans-102.8113.2155.2-91.6-17.5000107.2P328P328-N330 PolarHBondContact O-N 3.13Å
331T53.6Low48.4Very low135 Ų135158.2 Ų158.283%0.82884%0.836SS**  trans-120.1100.8161.741.90000108.1
332S46.1Very low48.9Very low119 Ų119153.6 Ų153.683%0.83283%0.833SS**  trans-84.9116.5164.1-39.90000107.1
333S54.8Low49.7Very low109 Ų109148.2 Ų148.276%0.76283%0.828SS**  trans-150.7107.7158.4-153.90000110.7
334S49.7Very low50.2Low89 Ų89150.3 Ų150.362%0.62283%0.828SS**  trans0.9131.2148.955.30000118.5
335R51.4Low50.9Low229 Ų229142.9 Ų142.986%0.86482%0.819SS**  174.6110.2121.7-89.8159.8-157.7-1537.7106.7
336L52.9Low51.6Low145 Ų145146.8 Ų146.876%0.75982%0.823SS**  66.5125.681.9-86.1170.7000113.7
337F53.2Low51.9Low181 Ų181149.6 Ų149.679%0.79483%0.826SS**  trans89.9112.8161.5-69.6-76.5000119.5
338S63.1Low52.4Low196 Ų196148.4 Ų148.4100%1.37183%0.832SS**  trans69.70153.5-71.70000120.2

Retrieved 338 of 338 residues in 183 ms (Link to these results)

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