A0A096NVZ3_PAPAN Loading...

Alpha-fetoprotein

AlphaFold DB , UniProt , Accession A0A096NVZ3, Species PAPAN (Papio anubis, Olive baboon), Gene AFP, Length 609 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
1M34.3Very low32Very low237 Ų237160.6 Ų160.6100%1.16778%0.777SS**  0135.80-80.6172.2-74.500107.7
2K31.6Very low31.8Very low204 Ų204159 Ų15989%0.88777%0.774SS**  trans-64129.1-154-66.9174173.31790113.5
3W28.6Very low31.6Very low216 Ų216155.6 Ų155.682%0.81876%0.761SS**  trans-77.6128.5157.9-88.952000108.7E5W3-E5 HydrophobicContact CE3-CG 4.01Å; W3-E5 HydrophobicContact CZ3-CG 4.08Å
4V31.1Very low31Very low123 Ų123154 Ų15475%0.74576%0.757SS**  trans-134.293.5159.7-1800000105.3
5E30.5Very low30.7Very low143 Ų143155.1 Ų155.167%0.66876%0.757SS**  trans-79.6111.6160.8-72.6-160.3162.300107.5W3 I7W3-E5 HydrophobicContact CE3-CG 4.01Å; W3-E5 HydrophobicContact CZ3-CG 4.08Å; E5-I7 PolarHBondContact O-N 2.72Å
6S30.7Very low30.6Very low97 Ų97153.1 Ų153.168%0.67876%0.756SS**  trans-77.1100.2167.3-71.60000108.6F8S6-F8 PolarHBondContact O-N 3.27Å
7I35.9Very low30.5Very low136 Ų136153.6 Ų153.670%0.69776%0.757SS**  trans-72.4105.9166.1-65.3169.8000107.3E5 L9E5-I7 PolarHBondContact O-N 2.72Å; I7-L9 HydrophobicContact CG2-CG 4.32Å; I7-L9 PolarHBondContact O-N 2.91Å; I7-L9 VanDerWaalsContact O-N 3.1Å
8F32.3Very low30.5Very low192 Ų192151 Ų15184%0.84276%0.756SS**  trans-71.195.1163.3-93.4-90.2000108.2S6 I10S6-F8 PolarHBondContact O-N 3.27Å; F8-I10 PolarHBondContact O-N 2.92Å; F8-I10 VanDerWaalsContact O-N 3.07Å
9L31Very low30.9Very low128 Ų128151.5 Ų151.567%0.6775%0.748SS**  trans-69.594163.6-97.2149.3000108.1I7 F11I7-L9 HydrophobicContact CG2-CG 4.32Å; I7-L9 PolarHBondContact O-N 2.91Å; I7-L9 VanDerWaalsContact O-N 3.1Å; L9-F11 HydrophobicContact CB-CD2 4.31Å; L9-F11 HydrophobicContact CB-CE2 4.26Å; L9-F11 HydrophobicContact CD2-CE2 4.38Å; L9-F11 PolarHBondContact O-N 3.32Å; L9-F11 VanDerWaalsContact O-N 3.09Å
10I36.7Very low31.3Very low134 Ų134149.5 Ų149.569%0.68774%0.744SS**  trans-69.998.2161.9-58176.3000105.9F8 L12F8-I10 PolarHBondContact O-N 2.92Å; F8-I10 VanDerWaalsContact O-N 3.07Å; I10-L12 HydrophobicContact CG2-CD2 4.43Å; I10-L12 HydrophobicContact CG2-CG 3.89Å; I10-L12 PolarHBondContact O-N 3.37Å
11F28.9Very low31.8Very low157 Ų157148.8 Ų148.869%0.68974%0.742SS**  trans-69.986.2163.7-86-89.8000108.1L9 L13L9-F11 HydrophobicContact CB-CD2 4.31Å; L9-F11 HydrophobicContact CB-CE2 4.26Å; L9-F11 HydrophobicContact CD2-CE2 4.38Å; L9-F11 PolarHBondContact O-N 3.32Å; L9-F11 VanDerWaalsContact O-N 3.09Å; F11-L13 HydrophobicContact CD1-CG 4.36Å; F11-L13 PolarHBondContact O-N 3.27Å
12L30.2Very low32.6Very low141 Ų141139.8 Ų139.874%0.73870%0.698SS**  trans-7378.3155.6-73.7169.7000107I10 N14I10-L12 HydrophobicContact CG2-CD2 4.43Å; I10-L12 HydrophobicContact CG2-CG 3.89Å; I10-L12 PolarHBondContact O-N 3.37Å; L12-N14 PolarHBondContact O-N 3.31Å
13L28.5Very low33.2Very low115 Ų115140.2 Ų140.260%0.60269%0.694SS**  trans-71.587.4159-73.9167.4000106.2F11 F15F11-L13 HydrophobicContact CD1-CG 4.36Å; F11-L13 PolarHBondContact O-N 3.27Å; L13-F15 HydrophobicContact CB-CD2 4Å; L13-F15 HydrophobicContact CB-CE2 3.8Å; L13-F15 HydrophobicContact CD1-CE2 4.05Å; L13-F15 HydrophobicContact CD1-CZ 4.35Å; L13-F15 HydrophobicContact CG-CE2 4.47Å; L13-F15 PolarHBondContact O-N 3.2Å
14N24.4Very low34.6Very low133 Ų133131.1 Ų131.171%0.71166%0.661SS**  trans-61.296153.7-75.7-30.5000105.6L12 T16L12-N14 PolarHBondContact O-N 3.31Å; N14-T16 PolarHBondContact O-N 3.19Å
15F26.1Very low35.9Very low171 Ų171132.6 Ų132.675%0.7566%0.66SS**  trans-71.278.4157.7-76.1-86.6000106.3L13 E17L13-F15 HydrophobicContact CB-CD2 4Å; L13-F15 HydrophobicContact CB-CE2 3.8Å; L13-F15 HydrophobicContact CD1-CE2 4.05Å; L13-F15 HydrophobicContact CD1-CZ 4.35Å; L13-F15 HydrophobicContact CG-CE2 4.47Å; L13-F15 PolarHBondContact O-N 3.2Å; F15-E17 PolarHBondContact O-N 2.9Å; F15-E17 VanDerWaalsContact O-N 3.16Å
16T29.3Very low37.2Very low122 Ų122128.7 Ų128.775%0.74864%0.639SS**  trans-71.494.6148.642.60000104.7N14 S18N14-T16 PolarHBondContact O-N 3.19Å; T16-S18 PolarHBondContact O-N 3.04Å
17E28.3Very low38.7Very low163 Ų163126.7 Ų126.776%0.76263%0.634SS**  trans-62.881.9159.3-85.4-167.3150.100106.9F15 R19F15-E17 PolarHBondContact O-N 2.9Å; F15-E17 VanDerWaalsContact O-N 3.16Å; E17-R19 PolarHBondContact O-N 2.68Å
18S31Very low40.3Very low106 Ų106122 Ų12274%0.74161%0.61SS**  trans-53.6120.7161.1-161.50000105.8T16 T20T16-S18 PolarHBondContact O-N 3.04Å; S18-T20 PolarHBondContact O-N 3.15Å
19R37.6Very low42.2Very low161 Ų161116.4 Ų116.461%0.60860%0.6SS**  trans-17.2103.1178.2-83-178.2170.1-179.2-4.4110.4E17 L21 C86E17-R19 PolarHBondContact O-N 2.68Å; R19-L21 PolarHBondContact O-N 3.38Å; R19-C86 VanDerWaalsContact NH2-CB 3.26Å; R19-C86 PolarHBondContact NH2-SG 3.34Å
20T38.7Very low44.4Very low110 Ų110110.7 Ų110.768%0.67557%0.57SS**  trans-54.1113.6174.933.90000106.5S18 H22S18-T20 PolarHBondContact O-N 3.15Å; T20-H22 PolarHBondContact O-N 2.98Å; T20-H22 VanDerWaalsContact O-N 3.12Å
21L41.5Very low46.4Very low135 Ų135104.3 Ų104.371%0.70754%0.537SS*.  trans-43.1123.6176.5-155.6110.6000107.4R19 R23R19-L21 PolarHBondContact O-N 3.38Å; L21-R23 PolarHBondContact O-N 3.25Å
22H51Low48.5Very low49 Ų4997.2 Ų97.223%0.22751%0.507CS..  trans-69.178-169.1-159.564000110.3T20 N24 S30 D33 H264T20-H22 PolarHBondContact O-N 2.98Å; T20-H22 VanDerWaalsContact O-N 3.12Å; H22-N24 PolarHBondContact O-N 3.48Å; H22-S30 PolarHBondContact CD2-OG 3.33Å; H22-D33 WeakPolarHBondContact CB-OD1 3.38Å; H22-D33 PolarHBondContact N-OD1 2.89Å; H22-D33 PolarHBondContact N-OD2 2.89Å; H22-H264 AromaticContact CE1-CD2 3.27Å; H22-H264 PolarHBondContact CE1-CD2 2.96Å; H22-H264 AromaticContact CE1-CE1 3.37Å; H22-H264 PolarHBondContact CE1-CE1 3.41Å; H22-H264 AromaticContact CE1-CG 3.48Å; H22-H264 VanDerWaalsContact CE1-CG 3.48Å; H22-H264 AromaticContact CE1-ND1 3.54Å; H22-H264 AromaticContact CE1-NE2 3.16Å; H22-H264 PolarHBondContact CE1-NE2 3.13Å; H22-H264 AromaticContact ND1-NE2 3.89Å; H22-H264 AromaticContact NE2-CD2 3.48Å; H22-H264 PolarHBondContact NE2-CD2 3Å; H22-H264 AromaticContact NE2-CG 3.5Å; H22-H264 AromaticContact NE2-ND1 3.93Å; H22-H264 AromaticContact NE2-NE2 3.87Å
23R44.3Very low50.2Low212 Ų21294.2 Ų94.280%0.849%0.491SS*.  trans-94.394.6-172.3-168.7175.2179.2-179.8-0.6108.2L21L21-R23 PolarHBondContact O-N 3.25Å
24N59.7Low51.6Low25 Ų2593 Ų9313%0.13449%0.493CS..  trans-65161.3171.658.463.8000111.7H22 Y26 G27 I28 L260H22-N24 PolarHBondContact O-N 3.48Å; N24-Y26 PolarHBondContact O-N 3.25Å; N24-Y26 PolarHBondContact OD1-N 3.06Å; N24-G27 PolarHBondContact O-N 3.02Å; N24-G27 PolarHBondContact OD1-N 3.48Å; N24-I28 PolarHBondContact ND2-O 3.09Å; N24-I28 PolarHBondContact OD1-N 3.37Å; N24-L260 HydrophobicContact CB-CD1 4.12Å; N24-L260 WeakPolarHBondContact ND2-CD1 3.29Å
25E57.8Low53.1Low154 Ų15490.2 Ų90.272%0.7247%0.473SS*.THydrogen-bonded Turntrans-58.6-17.4-177.274.4179.9174.100114
26Y57.9Low54.9Low61 Ų6190.1 Ų90.124%0.23948%0.475CS..THydrogen-bonded Turntrans-99.5-2.4-179-58.1-69.7000113.7N24 I28 L260 I349N24-Y26 PolarHBondContact O-N 3.25Å; N24-Y26 PolarHBondContact OD1-N 3.06Å; Y26-I28 PolarHBondContact O-N 3.03Å; Y26-L260 HydrophobicContact CD2-CD2 4.42Å; Y26-I349 HydrophobicContact CD1-CD1 3.74Å; Y26-I349 HydrophobicContact CD1-CG1 3.98Å; Y26-I349 HydrophobicContact CE1-CD1 4.11Å; Y26-I349 HydrophobicContact CE1-CG1 3.92Å
27G61.4Low56.3Low56 Ų5685.5 Ų85.558%0.57745%0.447SS*.  trans6620.4-177.500000114.5N24N24-G27 PolarHBondContact O-N 3.02Å; N24-G27 PolarHBondContact OD1-N 3.48Å
28I70Confident57.6Low37 Ų3782.6 Ų82.619%0.1944%0.44CS..PPolyproline II helixtrans-77.5136.5176.8-62.5175.2000108.4N24 Y26 S30 Q256 K257 L260N24-I28 PolarHBondContact ND2-O 3.09Å; N24-I28 PolarHBondContact OD1-N 3.37Å; Y26-I28 PolarHBondContact O-N 3.03Å; I28-S30 PolarHBondContact O-N 2.87Å; I28-Q256 HydrophobicContact CD1-CB 4.48Å; I28-Q256 HydrophobicContact CD1-CG 3.65Å; I28-K257 HydrophobicContact CG2-CB 4.39Å; I28-K257 HydrophobicContact CG2-CG 4.49Å; I28-L260 HydrophobicContact CB-CD1 4.14Å; I28-L260 HydrophobicContact CD1-CD1 3.98Å; I28-L260 HydrophobicContact CG2-CD1 4.44Å
29A72.8Confident58.7Low75 Ų7578.9 Ų78.962%0.6242%0.416SS*.PPolyproline II helixtrans-69.6129.6179.300000111.5K257A29-K257 VanDerWaalsContact O-CE 3.25Å; A29-K257 WeakPolarHBondContact O-CE 3.36Å; A29-K257 WeakPolarHBondContact O-CG 3.29Å
30S77Confident59.9Low7 Ų780.8 Ų80.85%0.04943%0.432CS..PPolyproline II helixtrans-79.3147.4176.9-179.40000112H22 I28 L32 D261H22-S30 PolarHBondContact CD2-OG 3.33Å; I28-S30 PolarHBondContact O-N 2.87Å; S30-L32 VanDerWaalsContact C-N 3.29Å; S30-L32 WeakPolarHBondContact OG-CB 3.33Å; S30-L32 PolarHBondContact OG-N 2.72Å; S30-L32 VanDerWaalsContact OG-N 3.07Å; S30-D261 WeakPolarHBondContact CB-OD1 3.49Å; S30-D261 PolarHBondContact OG-OD1 3.31Å
31I77.3Confident61.6Low0 Ų077.4 Ų77.40%041%0.41CS..SBendtrans-70-33.1169.6-60159.4000110.3D33 S34 Y35 K257 L258 D261 Y287I31-D33 PolarHBondContact O-N 3.21Å; I31-S34 PolarHBondContact O-N 3.1Å; I31-S34 PolarHBondContact O-OG 3.25Å; I31-Y35 HydrophobicContact CG2-CD2 4.4Å; I31-K257 HydrophobicContact CD1-CD 3.99Å; I31-K257 HydrophobicContact CD1-CG 4.18Å; I31-K257 HydrophobicContact CG1-CD 3.69Å; I31-K257 HydrophobicContact CG1-CG 4.05Å; I31-K257 VanDerWaalsContact CG1-NZ 3.31Å; I31-L258 HydrophobicContact CD1-CD2 3.62Å; I31-L258 HydrophobicContact CD1-CG 4.36Å; I31-D261 WeakPolarHBondContact CB-OD2 3.47Å; I31-D261 WeakPolarHBondContact CD1-OD2 3.24Å; I31-D261 VanDerWaalsContact CG1-OD2 3.24Å; I31-D261 WeakPolarHBondContact CG1-OD2 3.43Å; I31-D261 PolarHBondContact N-OD2 3.46Å; I31-Y287 HydrophobicContact CB-CG 4.47Å; I31-Y287 HydrophobicContact CD1-CD1 3.3Å; I31-Y287 HydrophobicContact CD1-CD2 4.27Å; I31-Y287 HydrophobicContact CD1-CE1 3.38Å; I31-Y287 HydrophobicContact CD1-CE2 4.37Å; I31-Y287 HydrophobicContact CD1-CG 3.76Å; I31-Y287 HydrophobicContact CG1-CD1 4.11Å; I31-Y287 HydrophobicContact CG1-CD2 4.2Å; I31-Y287 HydrophobicContact CG1-CE1 4.12Å; I31-Y287 HydrophobicContact CG1-CE2 4.24Å; I31-Y287 HydrophobicContact CG1-CG 4.13Å; I31-Y287 HydrophobicContact CG2-CD1 4.26Å; I31-Y287 HydrophobicContact CG2-CD2 3.57Å; I31-Y287 HydrophobicContact CG2-CE2 4.34Å; I31-Y287 HydrophobicContact CG2-CG 3.52Å
32L73.9Confident63.7Low9 Ų974.1 Ų74.15%0.04739%0.392CS..THydrogen-bonded Turntrans-63.1-26.8-171.9-57.7176.1000112.9S30 S34 D261 D280 K283 I284S30-L32 VanDerWaalsContact C-N 3.29Å; S30-L32 WeakPolarHBondContact OG-CB 3.33Å; S30-L32 PolarHBondContact OG-N 2.72Å; S30-L32 VanDerWaalsContact OG-N 3.07Å; L32-S34 VanDerWaalsContact C-N 3.28Å; L32-S34 PolarHBondContact O-N 3.09Å; L32-D261 HydrophobicContact CD1-CB 4.33Å; L32-D261 HydrophobicContact CG-CB 4.28Å; L32-D280 HydrophobicContact CD1-CB 4.3Å; L32-D280 HydrophobicContact CD2-CB 3.81Å; L32-K283 HydrophobicContact CD2-CB 3.93Å; L32-K283 HydrophobicContact CD2-CD 3.98Å; L32-I284 HydrophobicContact CD2-CG1 4.09Å
33D65.6Low65.5Low77 Ų7772.8 Ų72.841%0.41239%0.387SS..THydrogen-bonded Turntrans-71.4-20.5177.9-67.9-31.6000113.3H22 I31H22-D33 WeakPolarHBondContact CB-OD1 3.38Å; H22-D33 PolarHBondContact N-OD1 2.89Å; H22-D33 PolarHBondContact N-OD2 2.89Å; I31-D33 PolarHBondContact O-N 3.21Å
34S57.8Low67.9Low91 Ų9164.7 Ų64.764%0.63636%0.362SS*.THydrogen-bonded Turntrans-111.7-12.8-16867.20000115.2I31 L32I31-S34 PolarHBondContact O-N 3.1Å; I31-S34 PolarHBondContact O-OG 3.25Å; L32-S34 VanDerWaalsContact C-N 3.28Å; L32-S34 PolarHBondContact O-N 3.09Å
35Y56.9Low69.7Low73 Ų7364.6 Ų64.629%0.28636%0.362SS..  trans-104.6132.1-170.8-124.5-92.8000112.3I31 S286 Y287 S290I31-Y35 HydrophobicContact CG2-CD2 4.4Å; Y35-S286 VanDerWaalsContact CE1-CB 3.47Å; Y35-S286 PolarHBondContact OH-O 3.17Å; Y35-Y287 HydrophobicContact CE2-CD2 4.37Å; Y35-S290 WeakPolarHBondContact OH-CB 3.28Å
36Q62.3Low71.5Confident170 Ų17057.3 Ų57.379%0.79433%0.328SS*.  trans-80137.4174.3-68.7177.6-15.200110.1
37C60.4Low73.3Confident24 Ų2454.4 Ų54.416%0.16232%0.316CS..  trans-70.2142.7172.3-52.30000109.9C86 K283C37-C86 HydrophobicContact CB-CB 3.94Å; C37-C86 WeakPolarHBondContact CB-SG 3.21Å; C37-C86 PolarHBondContact N-SG 2.98Å; C37-C86 VanDerWaalsContact N-SG 3.4Å; C37-C86 WeakPolarHBondContact SG-CB 3.18Å; C37-C86 CovalentContact SG-SG 2.03Å; C37-C86 PolarHBondContact SG-SG 2.87Å; C37-K283 WeakPolarHBondContact SG-CE 3.22Å
38T54.6Low75.1Confident102 Ų10251.8 Ų51.863%0.62629%0.289SS*.  trans-121.7-9.7-179.750.90000113.5E282T38-E282 PolarHBondContact N-OE2 3.49Å; T38-E282 PolarHBondContact OG1-OE1 3.45Å
39A54.3Low76.5Confident28 Ų2850 Ų5023%0.23128%0.28CS..  trans-70133.9-179.300000112.3I41 E282A39-I41 PolarHBondContact O-N 3.33Å; A39-E282 WeakPolarHBondContact CB-OE2 3.45Å; A39-E282 PolarHBondContact N-OE1 2.93Å; A39-E282 PolarHBondContact N-OE2 2.93Å
40E62.8Low77.7Confident201 Ų20146.5 Ų46.594%0.93925%0.25SS*.  trans-67.2108.1158.7-166.4171.3-162.700107.4N42E40-N42 PolarHBondContact O-N 2.84Å
41I73.7Confident78.7Confident40 Ų4046.1 Ų46.121%0.20525%0.248CC..  trans-86.5110.9-174.4-63.6160000108.8A39 L43 L46 L87 L275 Q279A39-I41 PolarHBondContact O-N 3.33Å; I41-L43 VanDerWaalsContact C-N 3.34Å; I41-L43 PolarHBondContact O-N 3.35Å; I41-L43 VanDerWaalsContact O-N 3.08Å; I41-L46 HydrophobicContact CG2-CD1 3.63Å; I41-L87 HydrophobicContact CB-CD1 4.21Å; I41-L87 HydrophobicContact CD1-CB 4.29Å; I41-L87 HydrophobicContact CD1-CD1 3.91Å; I41-L87 HydrophobicContact CD1-CG 4Å; I41-L87 HydrophobicContact CG2-CD1 3.94Å; I41-L275 HydrophobicContact CD1-CD1 4.13Å; I41-L275 HydrophobicContact CG2-CD1 3.86Å; I41-Q279 HydrophobicContact CD1-CG 4.29Å; I41-Q279 VanDerWaalsContact CD1-NE2 3.29Å
42N85.9Confident79.7Confident65 Ų6546.2 Ų46.235%0.34825%0.248SC..  trans-8084.6167.4-167.6-16.9000109.6E40 P44 D45 L46E40-N42 PolarHBondContact O-N 2.84Å; N42-P44 WeakPolarHBondContact OD1-CD 3.47Å; N42-P44 WeakPolarHBondContact OD1-CG 3.1Å; N42-D45 HydrophobicContact CB-CB 4.12Å; N42-D45 PolarHBondContact ND2-OD2 2.91Å; N42-D45 PolarHBondContact O-N 2.72Å; N42-D45 PolarHBondContact OD1-N 3.2Å; N42-L46 PolarHBondContact O-N 2.63Å; N42-L46 VanDerWaalsContact O-N 3.11Å
43L89.8Confident80.8Confident21 Ų2146 Ų4611%0.1125%0.247CC..Hα-helixtrans-58.4-40.3-179.9-170.763.4000113.2I41 D45 L46 A47 L71 I74 Q90 F94I41-L43 VanDerWaalsContact C-N 3.34Å; I41-L43 PolarHBondContact O-N 3.35Å; I41-L43 VanDerWaalsContact O-N 3.08Å; L43-D45 PolarHBondContact O-N 3.4Å; L43-L46 PolarHBondContact O-N 3.21Å; L43-A47 WeakPolarHBondContact O-CB 3.06Å; L43-A47 PolarHBondContact O-N 3.32Å; L43-L71 HydrophobicContact CB-CD2 4.04Å; L43-L71 HydrophobicContact CD2-CD2 3.53Å; L43-L71 HydrophobicContact CG-CD2 3.56Å; L43-I74 HydrophobicContact CD2-CD1 4.07Å; L43-I74 HydrophobicContact CD2-CG2 4.31Å; L43-Q90 HydrophobicContact CD1-CG 4.35Å; L43-F94 HydrophobicContact CD1-CZ 4.01Å
44P94.6Very high82.3Confident42 Ų4242.5 Ų42.527%0.27323%0.228SC..Hα-helixtrans-51.8-47.7169.6-25.326.4000114.5N42 A47 T48 V67 L71N42-P44 WeakPolarHBondContact OD1-CD 3.47Å; N42-P44 WeakPolarHBondContact OD1-CG 3.1Å; P44-A47 PolarHBondContact O-N 3.5Å; P44-T48 PolarHBondContact O-N 2.89Å; P44-T48 PolarHBondContact O-OG1 3.39Å; P44-V67 HydrophobicContact CB-CG1 4.37Å; P44-L71 HydrophobicContact CB-CD1 4.03Å; P44-L71 HydrophobicContact CG-CD1 3.72Å
45D96Very high84.2Confident24 Ų2438.3 Ų38.313%0.12820%0.199CC..Hα-helixtrans-66.2-40.2179.5-76.9-17.6000112N42 L43 T48 I49 N160 I163 L179N42-D45 HydrophobicContact CB-CB 4.12Å; N42-D45 PolarHBondContact ND2-OD2 2.91Å; N42-D45 PolarHBondContact O-N 2.72Å; N42-D45 PolarHBondContact OD1-N 3.2Å; L43-D45 PolarHBondContact O-N 3.4Å; D45-T48 PolarHBondContact O-N 3.12Å; D45-I49 VanDerWaalsContact O-CG1 3.28Å; D45-I49 WeakPolarHBondContact O-CG1 2.82Å; D45-I49 PolarHBondContact O-N 3.48Å; D45-N160 PolarHBondContact OD1-ND2 2.97Å; D45-I163 HydrophobicContact CB-CD1 3.91Å; D45-I163 WeakPolarHBondContact OD2-CD1 3.17Å; D45-L179 HydrophobicContact CB-CD2 3.93Å
46L95.9Very high86Confident1 Ų135.3 Ų35.31%0.00519%0.188CC..Hα-helixtrans-63.6-43.6175.8-70.6179.8000111.8I41 N42 L43 I49 F50 A175 L179 V274 L275 L278I41-L46 HydrophobicContact CG2-CD1 3.63Å; N42-L46 PolarHBondContact O-N 2.63Å; N42-L46 VanDerWaalsContact O-N 3.11Å; L43-L46 PolarHBondContact O-N 3.21Å; L46-I49 HydrophobicContact CD2-CD1 4.46Å; L46-I49 WeakPolarHBondContact O-CB 3.49Å; L46-I49 PolarHBondContact O-N 3.28Å; L46-F50 PolarHBondContact O-N 2.05Å; L46-A175 HydrophobicContact CD2-CB 3.97Å; L46-L179 HydrophobicContact CD2-CD1 4.04Å; L46-V274 HydrophobicContact CB-CG2 4.03Å; L46-V274 HydrophobicContact CD2-CB 4.26Å; L46-V274 HydrophobicContact CD2-CG2 4.44Å; L46-L275 HydrophobicContact CD1-CB 4.46Å; L46-L275 HydrophobicContact CD1-CD1 3.66Å; L46-L278 HydrophobicContact CD1-CD2 4.17Å; L46-L278 HydrophobicContact CD2-CD2 4.17Å
47A97.3Very high87.5Confident0 Ų030.5 Ų30.50%017%0.165CC..Hα-helixtrans-62.1-43174.700000111L43 P44 I49 F50 F51 V67 V70 F94L43-A47 WeakPolarHBondContact O-CB 3.06Å; L43-A47 PolarHBondContact O-N 3.32Å; P44-A47 PolarHBondContact O-N 3.5Å; A47-I49 VanDerWaalsContact C-N 3.33Å; A47-I49 PolarHBondContact O-N 3.14Å; A47-F50 PolarHBondContact O-N 3.4Å; A47-F51 HydrophobicContact CB-CD2 4.35Å; A47-F51 HydrophobicContact CB-CE2 4.13Å; A47-F51 WeakPolarHBondContact O-CD2 3.31Å; A47-F51 PolarHBondContact O-N 3.46Å; A47-V67 HydrophobicContact CB-CB 4.38Å; A47-V67 HydrophobicContact CB-CG1 4.08Å; A47-V67 HydrophobicContact CB-CG2 3.88Å; A47-V70 HydrophobicContact CB-CG1 4.31Å; A47-F94 HydrophobicContact CB-CE1 4.03Å; A47-F94 HydrophobicContact CB-CZ 4.06Å
48T98.6Very high89.2Confident1 Ų129.3 Ų29.31%0.00616%0.157CC..Hα-helixtrans-57.1-45.7173.2-68.70000111.1P44 D45 A52 V63 N160 I163P44-T48 PolarHBondContact O-N 2.89Å; P44-T48 PolarHBondContact O-OG1 3.39Å; D45-T48 PolarHBondContact O-N 3.12Å; T48-A52 WeakPolarHBondContact O-CB 3.48Å; T48-A52 PolarHBondContact O-N 3.37Å; T48-V63 HydrophobicContact CG2-CG1 4.2Å; T48-N160 PolarHBondContact OG1-ND2 3.29Å; T48-N160 PolarHBondContact OG1-OD1 2.91Å; T48-I163 HydrophobicContact CG2-CG2 4.13Å
49I98.6Very high91.2Very high0 Ų027.4 Ų27.40%015%0.146CC..Hα-helixtrans-59.3-51.5176.4-67.6164.2000110.1D45 L46 A47 A52 Q53 I163 A167 A175 I178 L179 V274D45-I49 VanDerWaalsContact O-CG1 3.28Å; D45-I49 WeakPolarHBondContact O-CG1 2.82Å; D45-I49 PolarHBondContact O-N 3.48Å; L46-I49 HydrophobicContact CD2-CD1 4.46Å; L46-I49 WeakPolarHBondContact O-CB 3.49Å; L46-I49 PolarHBondContact O-N 3.28Å; A47-I49 VanDerWaalsContact C-N 3.33Å; A47-I49 PolarHBondContact O-N 3.14Å; I49-A52 PolarHBondContact O-N 3.34Å; I49-Q53 HydrophobicContact CG2-CG 4.24Å; I49-Q53 WeakPolarHBondContact O-CB 3.19Å; I49-Q53 WeakPolarHBondContact O-CG 3.33Å; I49-Q53 PolarHBondContact O-N 2.95Å; I49-I163 HydrophobicContact CD1-CG2 4.03Å; I49-I163 HydrophobicContact CG1-CG2 3.41Å; I49-I163 VanDerWaalsContact CG1-CG2 3.41Å; I49-A167 HydrophobicContact CG2-CB 4.42Å; I49-A175 HydrophobicContact CD1-CB 4.17Å; I49-A175 HydrophobicContact CG2-CB 4.39Å; I49-I178 HydrophobicContact CD1-CB 4.01Å; I49-I178 HydrophobicContact CD1-CD1 4.4Å; I49-I178 HydrophobicContact CD1-CG2 3.93Å; I49-I178 HydrophobicContact CG1-CB 4.47Å; I49-I178 HydrophobicContact CG1-CD1 4.19Å; I49-I178 HydrophobicContact CG1-CG2 4.06Å; I49-I178 HydrophobicContact CG2-CD1 3.74Å; I49-L179 HydrophobicContact CD1-CD2 4.09Å; I49-L179 HydrophobicContact CD1-CG 4.2Å; I49-V274 HydrophobicContact CB-CG1 4.49Å; I49-V274 HydrophobicContact CG2-CG1 3.88Å
50F98.4Very high93.2Very high0 Ų028.2 Ų28.20%014%0.143CC..Hα-helixtrans-54.8-59.5-179178.5-87.8000111.4L46 A47 A52 Q53 F54 L91 F94 L95 L98 G272 V274L46-F50 PolarHBondContact O-N 2.05Å; A47-F50 PolarHBondContact O-N 3.4Å; F50-A52 VanDerWaalsContact C-N 3.35Å; F50-A52 PolarHBondContact O-N 2.86Å; F50-Q53 PolarHBondContact O-N 3.03Å; F50-Q53 VanDerWaalsContact O-N 3.15Å; F50-F54 HydrophobicContact CD1-CD2 4.14Å; F50-F54 AromaticContact CD2-CD2 3.69Å; F50-F54 HydrophobicContact CD2-CD2 3.69Å; F50-F54 AromaticContact CD2-CE2 3.58Å; F50-F54 HydrophobicContact CD2-CE2 3.58Å; F50-F54 AromaticContact CE1-CD2 3.93Å; F50-F54 HydrophobicContact CE1-CD2 3.93Å; F50-F54 HydrophobicContact CE1-CE2 4.44Å; F50-F54 HydrophobicContact CE1-CG 4.43Å; F50-F54 AromaticContact CE2-CD2 3.47Å; F50-F54 HydrophobicContact CE2-CD2 3.47Å; F50-F54 VanDerWaalsContact CE2-CD2 3.47Å; F50-F54 AromaticContact CE2-CE2 3.17Å; F50-F54 HydrophobicContact CE2-CE2 3.17Å; F50-F54 HydrophobicContact CE2-CG 4.49Å; F50-F54 AromaticContact CE2-CZ 3.98Å; F50-F54 HydrophobicContact CE2-CZ 3.98Å; F50-F54 HydrophobicContact CG-CD2 4.03Å; F50-F54 HydrophobicContact CG-CE2 4.37Å; F50-F54 AromaticContact CZ-CD2 3.59Å; F50-F54 HydrophobicContact CZ-CD2 3.59Å; F50-F54 AromaticContact CZ-CE2 3.67Å; F50-F54 HydrophobicContact CZ-CE2 3.67Å; F50-F54 HydrophobicContact CZ-CG 4.24Å; F50-F54 HydrophobicContact CZ-CZ 4.32Å; F50-F54 WeakPolarHBondContact O-CD2 3.42Å; F50-F54 PolarHBondContact O-N 3.14Å; F50-L91 HydrophobicContact CD2-CD1 4.46Å; F50-L91 HydrophobicContact CE2-CD1 3.5Å; F50-L91 HydrophobicContact CZ-CD1 4.13Å; F50-F94 HydrophobicContact CB-CD2 3.96Å; F50-F94 HydrophobicContact CB-CE2 4.3Å; F50-F94 HydrophobicContact CD1-CB 3.58Å; F50-F94 HydrophobicContact CD1-CD2 4.1Å; F50-F94 HydrophobicContact CD1-CG 4.09Å; F50-F94 HydrophobicContact CD2-CB 4.22Å; F50-F94 AromaticContact CD2-CD2 3.78Å; F50-F94 HydrophobicContact CD2-CD2 3.78Å; F50-F94 HydrophobicContact CD2-CG 4.46Å; F50-F94 HydrophobicContact CE1-CB 3.41Å; F50-F94 VanDerWaalsContact CE1-CB 3.41Å; F50-F94 HydrophobicContact CE1-CG 4.38Å; F50-F94 HydrophobicContact CE2-CB 4.05Å; F50-F94 HydrophobicContact CE2-CD2 4.31Å; F50-F94 HydrophobicContact CG-CB 4Å; F50-F94 AromaticContact CG-CD2 3.67Å; F50-F94 HydrophobicContact CG-CD2 3.67Å; F50-F94 HydrophobicContact CG-CE2 4.47Å; F50-F94 HydrophobicContact CG-CG 4.14Å; F50-F94 HydrophobicContact CZ-CB 3.65Å; F50-L95 HydrophobicContact CZ-CD2 4.01Å; F50-L95 HydrophobicContact CZ-CG 4.22Å; F50-L98 HydrophobicContact CE1-CD1 3.82Å; F50-L98 HydrophobicContact CE1-CG 4.22Å; F50-L98 HydrophobicContact CZ-CD1 4.23Å; F50-G272 WeakPolarHBondContact CD2-O 3.47Å; F50-V274 HydrophobicContact CB-CG1 4.26Å; F50-V274 HydrophobicContact CB-CG2 4.13Å
51F98.4Very high94.9Very high0 Ų027 Ų270%014%0.135CC..Hα-helixtrans-64.7-39-174.9-67.3-57.7000112.2A47 Q53 F54 V55 V63 M66 V67 V70 F94 E97 L98A47-F51 HydrophobicContact CB-CD2 4.35Å; A47-F51 HydrophobicContact CB-CE2 4.13Å; A47-F51 WeakPolarHBondContact O-CD2 3.31Å; A47-F51 PolarHBondContact O-N 3.46Å; F51-Q53 VanDerWaalsContact C-N 3.33Å; F51-Q53 PolarHBondContact O-N 3.24Å; F51-F54 PolarHBondContact O-N 3.34Å; F51-V55 PolarHBondContact O-N 3.44Å; F51-V63 HydrophobicContact CB-CG1 4.06Å; F51-V63 HydrophobicContact CB-CG2 4.44Å; F51-M66 HydrophobicContact CB-CE 3.95Å; F51-M66 HydrophobicContact CD1-CB 4.04Å; F51-M66 HydrophobicContact CD1-CE 4.25Å; F51-M66 HydrophobicContact CD1-CG 4.42Å; F51-M66 HydrophobicContact CD1-SD 3.75Å; F51-M66 HydrophobicContact CD2-CB 3.77Å; F51-M66 HydrophobicContact CE1-CB 4.05Å; F51-M66 HydrophobicContact CE1-CG 4.47Å; F51-M66 HydrophobicContact CE1-SD 4.18Å; F51-M66 HydrophobicContact CE2-CB 3.77Å; F51-M66 HydrophobicContact CG-CB 3.92Å; F51-M66 HydrophobicContact CG-CE 4.19Å; F51-M66 HydrophobicContact CG-SD 4.21Å; F51-M66 HydrophobicContact CZ-CB 3.93Å; F51-V67 HydrophobicContact CD2-CG2 3.78Å; F51-V67 HydrophobicContact CE2-CG2 4.22Å; F51-V70 HydrophobicContact CE2-CB 4.5Å; F51-V70 HydrophobicContact CE2-CG1 3.8Å; F51-V70 HydrophobicContact CZ-CB 4.27Å; F51-V70 HydrophobicContact CZ-CG1 4.01Å; F51-F94 HydrophobicContact CZ-CB 4.47Å; F51-F94 HydrophobicContact CZ-CD1 4.46Å; F51-E97 HydrophobicContact CE1-CB 4.1Å; F51-E97 HydrophobicContact CE1-CG 4.18Å; F51-E97 HydrophobicContact CZ-CB 3.83Å; F51-E97 HydrophobicContact CZ-CG 3.78Å; F51-L98 HydrophobicContact CD1-CD2 3.67Å; F51-L98 HydrophobicContact CD1-CG 4.1Å; F51-L98 HydrophobicContact CE1-CD2 4.04Å; F51-L98 HydrophobicContact CE1-CG 4.02Å
52A97.8Very high96Very high1 Ų126.6 Ų26.61%0.00813%0.132CC..Hα-helixtrans-66.6-33.2176.900000112.7T48 I49 F50 Q56 Y164 A167 R168T48-A52 WeakPolarHBondContact O-CB 3.48Å; T48-A52 PolarHBondContact O-N 3.37Å; I49-A52 PolarHBondContact O-N 3.34Å; F50-A52 VanDerWaalsContact C-N 3.35Å; F50-A52 PolarHBondContact O-N 2.86Å; A52-Q56 VanDerWaalsContact O-CA 3.27Å; A52-Q56 WeakPolarHBondContact O-CA 3.3Å; A52-Y164 HydrophobicContact CB-CD2 3.83Å; A52-Y164 HydrophobicContact CB-CE2 4.43Å; A52-A167 HydrophobicContact CB-CB 3.74Å; A52-R168 HydrophobicContact CB-CB 4.29Å; A52-R168 VanDerWaalsContact O-CA 3.32Å; A52-R168 WeakPolarHBondContact O-CA 3.3Å; A52-R168 WeakPolarHBondContact O-CB 3.36Å
53Q97.8Very high96.6Very high4 Ų423.5 Ų23.52%0.01912%0.115CC..Hα-helixtrans-76.9-33.8176.5-70.4-171.8-24.500112.9I49 F50 F51 Q56 K129 A167 H170 P171 L173I49-Q53 HydrophobicContact CG2-CG 4.24Å; I49-Q53 WeakPolarHBondContact O-CB 3.19Å; I49-Q53 WeakPolarHBondContact O-CG 3.33Å; I49-Q53 PolarHBondContact O-N 2.95Å; F50-Q53 PolarHBondContact O-N 3.03Å; F50-Q53 VanDerWaalsContact O-N 3.15Å; F51-Q53 VanDerWaalsContact C-N 3.33Å; F51-Q53 PolarHBondContact O-N 3.24Å; Q53-Q56 VanDerWaalsContact O-CG 3.31Å; Q53-Q56 WeakPolarHBondContact O-CG 3.31Å; Q53-K129 WeakPolarHBondContact O-CE 3.33Å; Q53-A167 HydrophobicContact CG-CB 4.04Å; Q53-A167 WeakPolarHBondContact CG-O 3.49Å; Q53-H170 PolarHBondContact NE2-O 3.09Å; Q53-P171 HydrophobicContact CB-CB 4.39Å; Q53-P171 PolarHBondContact OE1-O 2.92Å; Q53-L173 PolarHBondContact NE2-O 3.31Å
54F97.2Very high97Very high4 Ų424.4 Ų24.42%0.01812%0.123CC..Hα-helixtrans-85.2-34.1-178.3-85.3-80.2000113.5F50 F51 L98 F125 L126 K129F50-F54 HydrophobicContact CD1-CD2 4.14Å; F50-F54 AromaticContact CD2-CD2 3.69Å; F50-F54 HydrophobicContact CD2-CD2 3.69Å; F50-F54 AromaticContact CD2-CE2 3.58Å; F50-F54 HydrophobicContact CD2-CE2 3.58Å; F50-F54 AromaticContact CE1-CD2 3.93Å; F50-F54 HydrophobicContact CE1-CD2 3.93Å; F50-F54 HydrophobicContact CE1-CE2 4.44Å; F50-F54 HydrophobicContact CE1-CG 4.43Å; F50-F54 AromaticContact CE2-CD2 3.47Å; F50-F54 HydrophobicContact CE2-CD2 3.47Å; F50-F54 VanDerWaalsContact CE2-CD2 3.47Å; F50-F54 AromaticContact CE2-CE2 3.17Å; F50-F54 HydrophobicContact CE2-CE2 3.17Å; F50-F54 HydrophobicContact CE2-CG 4.49Å; F50-F54 AromaticContact CE2-CZ 3.98Å; F50-F54 HydrophobicContact CE2-CZ 3.98Å; F50-F54 HydrophobicContact CG-CD2 4.03Å; F50-F54 HydrophobicContact CG-CE2 4.37Å; F50-F54 AromaticContact CZ-CD2 3.59Å; F50-F54 HydrophobicContact CZ-CD2 3.59Å; F50-F54 AromaticContact CZ-CE2 3.67Å; F50-F54 HydrophobicContact CZ-CE2 3.67Å; F50-F54 HydrophobicContact CZ-CG 4.24Å; F50-F54 HydrophobicContact CZ-CZ 4.32Å; F50-F54 WeakPolarHBondContact O-CD2 3.42Å; F50-F54 PolarHBondContact O-N 3.14Å; F51-F54 PolarHBondContact O-N 3.34Å; F54-L98 HydrophobicContact CB-CD1 4.33Å; F54-F125 HydrophobicContact CD1-CB 3.64Å; F54-F125 HydrophobicContact CE1-CB 3.75Å; F54-L126 HydrophobicContact CE1-CD2 3.78Å; F54-L126 HydrophobicContact CE1-CG 3.97Å; F54-L126 HydrophobicContact CZ-CD2 3.71Å; F54-L126 HydrophobicContact CZ-CG 4.18Å; F54-K129 HydrophobicContact CD1-CG 4.39Å; F54-K129 HydrophobicContact CE1-CD 4.5Å
55V96.3Very high97.1Very high3 Ų326.9 Ų26.92%0.01813%0.13CC..SBendtrans-120.365.4177.3-163.10000109F51 E57 A58 L98 L105 Y108 L110F51-V55 PolarHBondContact O-N 3.44Å; V55-E57 PolarHBondContact O-N 2.9Å; V55-A58 HydrophobicContact CB-CB 4.03Å; V55-A58 HydrophobicContact CG1-CB 3.73Å; V55-A58 WeakPolarHBondContact O-CB 3.4Å; V55-A58 PolarHBondContact O-N 3.45Å; V55-L98 HydrophobicContact CG2-CD2 3.48Å; V55-L98 VanDerWaalsContact CG2-CD2 3.48Å; V55-L105 HydrophobicContact CG2-CD2 4.38Å; V55-Y108 HydrophobicContact CG1-CD2 3.53Å; V55-Y108 HydrophobicContact CG1-CE2 4.18Å; V55-Y108 HydrophobicContact CG1-CG 4.05Å; V55-L110 HydrophobicContact CB-CD1 4.39Å; V55-L110 HydrophobicContact CG1-CD1 3.98Å; V55-L110 HydrophobicContact CG2-CD1 3.95Å
56Q95.5Very high97.2Very high11 Ų1125.8 Ų25.85%0.05112%0.124CC..THydrogen-bonded Turntrans-58.1-25-169.5-60.2171.5-106.600114.6A52 Q53 K130 I136 R168 P171A52-Q56 VanDerWaalsContact O-CA 3.27Å; A52-Q56 WeakPolarHBondContact O-CA 3.3Å; Q53-Q56 VanDerWaalsContact O-CG 3.31Å; Q53-Q56 WeakPolarHBondContact O-CG 3.31Å; Q56-K130 PolarHBondContact NE2-O 3.47Å; Q56-I136 HydrophobicContact CB-CD1 3.89Å; Q56-I136 WeakPolarHBondContact O-CD1 3.47Å; Q56-R168 HydrophobicContact CB-CB 4.44Å; Q56-R168 PolarHBondContact NE2-O 3.22Å; Q56-R168 VanDerWaalsContact O-CZ 3.23Å; Q56-R168 PolarHBondContact O-NE 2.04Å; Q56-R168 PolarHBondContact O-NH2 3.06Å; Q56-P171 HydrophobicContact CG-CB 4.27Å
57E94.4Very high97.3Very high68 Ų6826.2 Ų26.232%0.31813%0.127SC..THydrogen-bonded Turntrans-85.8-14.6179.2-66.4179.4-161.800112.9V55 Y108 K130 S135 R168V55-E57 PolarHBondContact O-N 2.9Å; E57-Y108 HydrophobicContact CB-CD1 3.64Å; E57-Y108 HydrophobicContact CB-CE1 3.68Å; E57-Y108 HydrophobicContact CB-CG 4.49Å; E57-Y108 PolarHBondContact O-OH 3.48Å; E57-K130 IonicContact OE1-NZ 2.81Å; E57-K130 PolarHBondContact OE1-NZ 2.88Å; E57-S135 VanDerWaalsContact CD-OG 3.24Å; E57-S135 WeakPolarHBondContact CG-OG 3.31Å; E57-S135 WeakPolarHBondContact OE1-CB 3.4Å; E57-S135 PolarHBondContact OE1-OG 3.2Å; E57-R168 PolarHBondContact O-NH2 2.97Å
58A95.8Very high97.2Very high0 Ų033 Ų330%016%0.156CC..SBendtrans-56.3138.817500000111.7V55 E62 V63 Y108 Y164 R168V55-A58 HydrophobicContact CB-CB 4.03Å; V55-A58 HydrophobicContact CG1-CB 3.73Å; V55-A58 WeakPolarHBondContact O-CB 3.4Å; V55-A58 PolarHBondContact O-N 3.45Å; A58-E62 WeakPolarHBondContact CA-OE2 3.41Å; A58-E62 HydrophobicContact CB-CB 4.25Å; A58-V63 HydrophobicContact CB-CG2 3.91Å; A58-Y108 WeakPolarHBondContact CA-OH 3.03Å; A58-Y108 HydrophobicContact CB-CE2 3.87Å; A58-Y164 PolarHBondContact O-OH 2.9Å; A58-R168 PolarHBondContact O-NH2 3.09Å
59T96.3Very high97.1Very high62 Ų6235.5 Ų35.538%0.3817%0.169SC..  trans-70158.2174.263.50000110.7K61 E62 V63 Y164T59-K61 PolarHBondContact O-N 3.38Å; T59-E62 PolarHBondContact N-OE2 3.31Å; T59-E62 PolarHBondContact O-N 2.67Å; T59-E62 VanDerWaalsContact O-N 3.09Å; T59-E62 VanDerWaalsContact OG1-CD 3.23Å; T59-E62 VanDerWaalsContact OG1-CG 3.28Å; T59-E62 WeakPolarHBondContact OG1-CG 3.49Å; T59-E62 PolarHBondContact OG1-N 2.66Å; T59-E62 PolarHBondContact OG1-OE2 2.85Å; T59-V63 PolarHBondContact O-N 2.76Å; T59-Y164 WeakPolarHBondContact CA-OH 3.22Å
60Y96.3Very high96.9Very high45 Ų4535.6 Ų35.618%0.17617%0.17CC..Hα-helixtrans-54.8-41.6176.2-179.3-112.9000111.5E62 V63 S64 T157 N160 R161 Y164Y60-E62 PolarHBondContact O-N 3.44Å; Y60-V63 PolarHBondContact O-N 3.26Å; Y60-S64 WeakPolarHBondContact O-CB 3.29Å; Y60-S64 PolarHBondContact O-N 3.36Å; Y60-S64 PolarHBondContact O-OG 2.98Å; Y60-T157 HydrophobicContact CE1-CG2 4.31Å; Y60-T157 PolarHBondContact OH-O 3.37Å; Y60-N160 PolarHBondContact OH-OD1 2.66Å; Y60-R161 HydrophobicContact CD2-CB 4.36Å; Y60-R161 HydrophobicContact CD2-CG 4.18Å; Y60-R161 HydrophobicContact CE1-CB 4.44Å; Y60-R161 HydrophobicContact CE2-CB 3.95Å; Y60-R161 HydrophobicContact CE2-CG 4.27Å; Y60-R161 HydrophobicContact CG-CG 4.3Å; Y60-Y164 AromaticContact CD2-CD1 3.73Å; Y60-Y164 HydrophobicContact CD2-CD1 3.73Å; Y60-Y164 HydrophobicContact CD2-CD2 4.17Å; Y60-Y164 HydrophobicContact CD2-CE1 4.33Å; Y60-Y164 AromaticContact CD2-CG 3.63Å; Y60-Y164 HydrophobicContact CD2-CG 3.63Å; Y60-Y164 HydrophobicContact CE2-CG 4.42Å; Y60-Y164 HydrophobicContact CG-CD1 4.3Å; Y60-Y164 VanDerWaalsContact N-CZ 3.34Å; Y60-Y164 PolarHBondContact N-OH 3.11Å
61K97.7Very high96.6Very high175 Ų17536.9 Ų36.976%0.76118%0.176SC*.Hα-helixtrans-61.3-41177.9-174.1-179.6178.8-176.90113T59 K65T59-K61 PolarHBondContact O-N 3.38Å; K61-K65 WeakPolarHBondContact O-CB 3.41Å; K61-K65 PolarHBondContact O-N 3.23Å
62E98.1Very high96.2Very high32 Ų3240.2 Ų40.215%0.1520%0.197CC..Hα-helixtrans-67-42.5176.4-75.8161.9163.300111.1A58 T59 Y60 K65 M66 I104 K107 Y108A58-E62 WeakPolarHBondContact CA-OE2 3.41Å; A58-E62 HydrophobicContact CB-CB 4.25Å; T59-E62 PolarHBondContact N-OE2 3.31Å; T59-E62 PolarHBondContact O-N 2.67Å; T59-E62 VanDerWaalsContact O-N 3.09Å; T59-E62 VanDerWaalsContact OG1-CD 3.23Å; T59-E62 VanDerWaalsContact OG1-CG 3.28Å; T59-E62 WeakPolarHBondContact OG1-CG 3.49Å; T59-E62 PolarHBondContact OG1-N 2.66Å; T59-E62 PolarHBondContact OG1-OE2 2.85Å; Y60-E62 PolarHBondContact O-N 3.44Å; E62-K65 WeakPolarHBondContact O-CB 3.5Å; E62-K65 PolarHBondContact O-N 3.24Å; E62-M66 PolarHBondContact O-N 3.03Å; E62-M66 VanDerWaalsContact O-N 3.14Å; E62-I104 HydrophobicContact CB-CD1 3.88Å; E62-I104 HydrophobicContact CB-CG1 4.48Å; E62-I104 HydrophobicContact CG-CD1 4.07Å; E62-I104 HydrophobicContact CG-CG1 4.24Å; E62-K107 IonicContact OE1-NZ 2.67Å; E62-K107 PolarHBondContact OE1-NZ 2.73Å; E62-K107 IonicContact OE2-NZ 3.66Å; E62-Y108 PolarHBondContact OE1-OH 3.32Å; E62-Y108 PolarHBondContact OE2-OH 3.45Å
63V98.3Very high95.7Very high0 Ų042.6 Ų42.60%022%0.217CC..Hα-helixtrans-63.5-49174.8171.20000111.5T48 F51 A58 T59 Y60 K65 M66 V67 Y164T48-V63 HydrophobicContact CG2-CG1 4.2Å; F51-V63 HydrophobicContact CB-CG1 4.06Å; F51-V63 HydrophobicContact CB-CG2 4.44Å; A58-V63 HydrophobicContact CB-CG2 3.91Å; T59-V63 PolarHBondContact O-N 2.76Å; Y60-V63 PolarHBondContact O-N 3.26Å; V63-K65 PolarHBondContact O-N 2.78Å; V63-M66 HydrophobicContact CG2-CE 4.16Å; V63-M66 PolarHBondContact O-N 2.89Å; V63-M66 VanDerWaalsContact O-N 3.17Å; V63-V67 HydrophobicContact CG1-CG2 4.25Å; V63-V67 VanDerWaalsContact O-CG2 3.31Å; V63-V67 WeakPolarHBondContact O-CG2 3.48Å; V63-V67 PolarHBondContact O-N 3.09Å; V63-Y164 HydrophobicContact CB-CD2 4.16Å; V63-Y164 HydrophobicContact CB-CE2 4.23Å; V63-Y164 HydrophobicContact CG1-CD2 4.25Å; V63-Y164 HydrophobicContact CG2-CD2 3.99Å; V63-Y164 HydrophobicContact CG2-CE2 3.73Å
64S97.8Very high95Very high39 Ų3944.7 Ų44.727%0.27323%0.228SC..Hα-helixtrans-60.3-30.9177.7-57.30000112.6Y60 K68Y60-S64 WeakPolarHBondContact O-CB 3.29Å; Y60-S64 PolarHBondContact O-N 3.36Å; Y60-S64 PolarHBondContact O-OG 2.98Å; S64-K68 WeakPolarHBondContact O-CB 3.04Å; S64-K68 PolarHBondContact O-N 2.98Å
65K97.1Very high93.9Very high95 Ų9551.4 Ų51.441%0.41326%0.259SS..Hα-helixtrans-63.8-56.4172.5-174.9-168.7172.5-154.40110.7K61 E62 V63 V67 K68 D69 E101K61-K65 WeakPolarHBondContact O-CB 3.41Å; K61-K65 PolarHBondContact O-N 3.23Å; E62-K65 WeakPolarHBondContact O-CB 3.5Å; E62-K65 PolarHBondContact O-N 3.24Å; V63-K65 PolarHBondContact O-N 2.78Å; K65-V67 VanDerWaalsContact C-N 3.26Å; K65-V67 PolarHBondContact O-N 2.92Å; K65-K68 PolarHBondContact O-N 3.26Å; K65-K68 VanDerWaalsContact O-N 3.08Å; K65-D69 WeakPolarHBondContact CE-OD2 3.35Å; K65-D69 WeakPolarHBondContact CG-OD2 3.31Å; K65-D69 PolarHBondContact O-N 3.16Å; K65-E101 WeakPolarHBondContact CE-OE1 3.49Å; K65-E101 IonicContact NZ-OE1 2.7Å; K65-E101 PolarHBondContact NZ-OE1 3.49Å; K65-E101 IonicContact NZ-OE2 2.69Å; K65-E101 PolarHBondContact NZ-OE2 3.3Å
66M97.9Very high92.3Very high0 Ų058.3 Ų58.30%029%0.289CS..Hα-helixtrans-53.9-42176.6-77.7-179.6-66.500112.4F51 E62 V63 D69 V70 E97 L98 E101 I104F51-M66 HydrophobicContact CB-CE 3.95Å; F51-M66 HydrophobicContact CD1-CB 4.04Å; F51-M66 HydrophobicContact CD1-CE 4.25Å; F51-M66 HydrophobicContact CD1-CG 4.42Å; F51-M66 HydrophobicContact CD1-SD 3.75Å; F51-M66 HydrophobicContact CD2-CB 3.77Å; F51-M66 HydrophobicContact CE1-CB 4.05Å; F51-M66 HydrophobicContact CE1-CG 4.47Å; F51-M66 HydrophobicContact CE1-SD 4.18Å; F51-M66 HydrophobicContact CE2-CB 3.77Å; F51-M66 HydrophobicContact CG-CB 3.92Å; F51-M66 HydrophobicContact CG-CE 4.19Å; F51-M66 HydrophobicContact CG-SD 4.21Å; F51-M66 HydrophobicContact CZ-CB 3.93Å; E62-M66 PolarHBondContact O-N 3.03Å; E62-M66 VanDerWaalsContact O-N 3.14Å; V63-M66 HydrophobicContact CG2-CE 4.16Å; V63-M66 PolarHBondContact O-N 2.89Å; V63-M66 VanDerWaalsContact O-N 3.17Å; M66-D69 PolarHBondContact O-N 3.26Å; M66-V70 WeakPolarHBondContact O-CG1 3.46Å; M66-V70 PolarHBondContact O-N 3.47Å; M66-E97 HydrophobicContact CB-CG 4.34Å; M66-E97 HydrophobicContact CG-CG 4.49Å; M66-L98 HydrophobicContact SD-CD2 3.9Å; M66-E101 HydrophobicContact CG-CB 4.23Å; M66-E101 HydrophobicContact CG-CG 3.68Å; M66-E101 HydrophobicContact SD-CB 4.47Å; M66-I104 HydrophobicContact CE-CD1 4.48Å; M66-I104 HydrophobicContact CE-CG2 4.45Å; M66-I104 HydrophobicContact CG-CD1 4.27Å; M66-I104 HydrophobicContact SD-CD1 4.43Å
67V97.4Very high90.1Very high11 Ų1163.7 Ų63.77%0.06733%0.325CS..Hα-helixtrans-60.2-50.1176.41720000111.1P44 A47 F51 V63 K65 D69 V70 L71P44-V67 HydrophobicContact CB-CG1 4.37Å; A47-V67 HydrophobicContact CB-CB 4.38Å; A47-V67 HydrophobicContact CB-CG1 4.08Å; A47-V67 HydrophobicContact CB-CG2 3.88Å; F51-V67 HydrophobicContact CD2-CG2 3.78Å; F51-V67 HydrophobicContact CE2-CG2 4.22Å; V63-V67 HydrophobicContact CG1-CG2 4.25Å; V63-V67 VanDerWaalsContact O-CG2 3.31Å; V63-V67 WeakPolarHBondContact O-CG2 3.48Å; V63-V67 PolarHBondContact O-N 3.09Å; K65-V67 VanDerWaalsContact C-N 3.26Å; K65-V67 PolarHBondContact O-N 2.92Å; V67-D69 VanDerWaalsContact C-N 3.31Å; V67-D69 PolarHBondContact O-N 3.17Å; V67-V70 WeakPolarHBondContact O-CG1 2.98Å; V67-L71 HydrophobicContact CG1-CD1 3.75Å; V67-L71 HydrophobicContact CG1-CG 4.37Å; V67-L71 WeakPolarHBondContact O-CB 3.4Å; V67-L71 WeakPolarHBondContact O-CG 3.44Å; V67-L71 PolarHBondContact O-N 3.21Å
68K96.3Very high88Confident142 Ų14266.9 Ų66.962%0.61735%0.349SS*.Hα-helixtrans-61.2-43.2179.9-177.4-177.1176.5-176.70111.9S64 K65 T72S64-K68 WeakPolarHBondContact O-CB 3.04Å; S64-K68 PolarHBondContact O-N 2.98Å; K65-K68 PolarHBondContact O-N 3.26Å; K65-K68 VanDerWaalsContact O-N 3.08Å; K68-T72 WeakPolarHBondContact O-CB 3.4Å; K68-T72 PolarHBondContact O-N 2.84Å; K68-T72 PolarHBondContact O-OG1 3.44Å
69D95.3Very high85.5Confident54 Ų5470.2 Ų70.229%0.28938%0.383SS..Hα-helixtrans-69.5-42.6-174.9-68-20.4000110.7K65 M66 V67 T72 A73 E97K65-D69 WeakPolarHBondContact CE-OD2 3.35Å; K65-D69 WeakPolarHBondContact CG-OD2 3.31Å; K65-D69 PolarHBondContact O-N 3.16Å; M66-D69 PolarHBondContact O-N 3.26Å; V67-D69 VanDerWaalsContact C-N 3.31Å; V67-D69 PolarHBondContact O-N 3.17Å; D69-T72 PolarHBondContact O-N 3.19Å; D69-A73 PolarHBondContact O-N 3.1Å; D69-E97 WeakPolarHBondContact CB-OE1 3.42Å
70V94.4Very high82.8Confident1 Ų174.6 Ų74.61%0.00640%0.404CS..Hα-helixtrans-68.9-38.7175.979.10000113.2A47 F51 M66 V67 T72 A73 I74 A93 F94 E97A47-V70 HydrophobicContact CB-CG1 4.31Å; F51-V70 HydrophobicContact CE2-CB 4.5Å; F51-V70 HydrophobicContact CE2-CG1 3.8Å; F51-V70 HydrophobicContact CZ-CB 4.27Å; F51-V70 HydrophobicContact CZ-CG1 4.01Å; M66-V70 WeakPolarHBondContact O-CG1 3.46Å; M66-V70 PolarHBondContact O-N 3.47Å; V67-V70 WeakPolarHBondContact O-CG1 2.98Å; V70-T72 VanDerWaalsContact C-N 3.29Å; V70-T72 PolarHBondContact O-N 2.86Å; V70-A73 WeakPolarHBondContact O-CB 3.17Å; V70-A73 PolarHBondContact O-N 3.48Å; V70-A73 VanDerWaalsContact O-N 3.08Å; V70-I74 HydrophobicContact CG2-CD1 4.06Å; V70-I74 HydrophobicContact CG2-CG1 4.44Å; V70-I74 VanDerWaalsContact O-CG1 3.28Å; V70-I74 WeakPolarHBondContact O-CG1 3.49Å; V70-I74 PolarHBondContact O-N 3.41Å; V70-A93 HydrophobicContact CG2-CB 4.3Å; V70-F94 HydrophobicContact CG1-CD1 4.04Å; V70-F94 HydrophobicContact CG1-CE1 4Å; V70-F94 HydrophobicContact CG2-CD1 3.81Å; V70-F94 HydrophobicContact CG2-CE1 4.28Å; V70-E97 HydrophobicContact CB-CB 3.99Å; V70-E97 HydrophobicContact CB-CG 3.9Å; V70-E97 HydrophobicContact CG2-CB 3.97Å; V70-E97 HydrophobicContact CG2-CG 4.44Å
71L92Very high80.2Confident27 Ų2781.6 Ų81.614%0.14144%0.439CS..Hα-helixtrans-62-41.5175.6-70.2173000110.8L43 P44 V67 A73 I74 E75L43-L71 HydrophobicContact CB-CD2 4.04Å; L43-L71 HydrophobicContact CD2-CD2 3.53Å; L43-L71 HydrophobicContact CG-CD2 3.56Å; P44-L71 HydrophobicContact CB-CD1 4.03Å; P44-L71 HydrophobicContact CG-CD1 3.72Å; V67-L71 HydrophobicContact CG1-CD1 3.75Å; V67-L71 HydrophobicContact CG1-CG 4.37Å; V67-L71 WeakPolarHBondContact O-CB 3.4Å; V67-L71 WeakPolarHBondContact O-CG 3.44Å; V67-L71 PolarHBondContact O-N 3.21Å; L71-A73 VanDerWaalsContact C-N 3.26Å; L71-A73 PolarHBondContact O-N 3.03Å; L71-I74 PolarHBondContact O-N 3.33Å; L71-E75 WeakPolarHBondContact O-CB 3.23Å; L71-E75 WeakPolarHBondContact O-CG 3.33Å; L71-E75 PolarHBondContact O-N 3.31Å
72T90.8Very high77.6Confident70 Ų7081.9 Ų81.943%0.42944%0.443SS..Hα-helixtrans-63.4-33.5174.7-54.40000111.8K68 D69 V70K68-T72 WeakPolarHBondContact O-CB 3.4Å; K68-T72 PolarHBondContact O-N 2.84Å; K68-T72 PolarHBondContact O-OG1 3.44Å; D69-T72 PolarHBondContact O-N 3.19Å; V70-T72 VanDerWaalsContact C-N 3.29Å; V70-T72 PolarHBondContact O-N 2.86Å
73A86.8Confident74.9Confident52 Ų5285.1 Ų85.143%0.4347%0.469SS..Hα-helixtrans-70.7-40.4175.800000112.1D69 V70 L71D69-A73 PolarHBondContact O-N 3.1Å; V70-A73 WeakPolarHBondContact O-CB 3.17Å; V70-A73 PolarHBondContact O-N 3.48Å; V70-A73 VanDerWaalsContact O-N 3.08Å; L71-A73 VanDerWaalsContact C-N 3.26Å; L71-A73 PolarHBondContact O-N 3.03Å
74I84Confident72.3Confident47 Ų4790.9 Ų90.924%0.24152%0.517CS..Hα-helixtrans-70.4-37.1178.7-66.1166.4000111.6L43 V70 L71 K76 Q90 A93 F94L43-I74 HydrophobicContact CD2-CD1 4.07Å; L43-I74 HydrophobicContact CD2-CG2 4.31Å; V70-I74 HydrophobicContact CG2-CD1 4.06Å; V70-I74 HydrophobicContact CG2-CG1 4.44Å; V70-I74 VanDerWaalsContact O-CG1 3.28Å; V70-I74 WeakPolarHBondContact O-CG1 3.49Å; V70-I74 PolarHBondContact O-N 3.41Å; L71-I74 PolarHBondContact O-N 3.33Å; I74-K76 VanDerWaalsContact C-N 3.26Å; I74-K76 PolarHBondContact O-N 3.14Å; I74-Q90 HydrophobicContact CD1-CG 4.48Å; I74-Q90 VanDerWaalsContact CD1-OE1 3.27Å; I74-A93 HydrophobicContact CG1-CB 4.42Å; I74-F94 HydrophobicContact CD1-CE1 4.17Å
75E73.1Confident70.2Confident146 Ų14691.3 Ų91.368%0.68253%0.528SS*.THydrogen-bonded Turntrans-73.3-10.4-179.7-75.2178.1177.700114.4L71 P77L71-E75 WeakPolarHBondContact O-CB 3.23Å; L71-E75 WeakPolarHBondContact O-CG 3.33Å; L71-E75 PolarHBondContact O-N 3.31Å; E75-P77 WeakPolarHBondContact O-CD 3.09Å
76K62.5Low68.6Low147 Ų14788.1 Ų88.164%0.63952%0.517SS*.SBendtrans-64.9122.8174.5-78.6175.7-174.6170.90109.1I74 T78I74-K76 VanDerWaalsContact C-N 3.26Å; I74-K76 PolarHBondContact O-N 3.14Å; K76-T78 PolarHBondContact O-N 3.22Å
77P50.9Low67.4Low125 Ų12591.1 Ų91.181%0.81253%0.533SS*.  trans-70.2105.1-17226.3-32000110.4E75 G79E75-P77 WeakPolarHBondContact O-CD 3.09Å; P77-G79 PolarHBondContact O-N 3.35Å
78T48.6Very low66.4Low134 Ų13498.4 Ų98.482%0.82257%0.566SS**  trans-70.6108147.634.10000105.6K76 D80K76-T78 PolarHBondContact O-N 3.22Å; T78-D80 PolarHBondContact O-N 3.42Å
79G44.2Very low65.6Low70 Ų7094.7 Ų94.772%0.72255%0.553SS**SBendtrans-56.4102.2-168.700000113.3P77P77-G79 PolarHBondContact O-N 3.35Å
80D40Very low65.2Low154 Ų15493.4 Ų93.482%0.82455%0.545SS*.SBendtrans-170.9155.3142.8-98.3-22.3000109.4T78 Q82T78-D80 PolarHBondContact O-N 3.42Å; D80-Q82 PolarHBondContact O-N 2.96Å
81E41.6Very low65Low192 Ų19294.2 Ų94.290%0.89755%0.549SS*.  trans-51.3120.8-178-69177.2152.100111.6S83E81-S83 VanDerWaalsContact C-N 3.31Å; E81-S83 PolarHBondContact O-N 3.31Å
82Q42.9Very low65Low181 Ų18195.4 Ų95.485%0.84656%0.559SS**  trans-62.893.9168.5-84.5174.1-8.300108.9D80D80-Q82 PolarHBondContact O-N 2.96Å
83S40.3Very low65.1Low100 Ų10093.6 Ų93.670%0.69955%0.551SS**  trans-62.7147.9172.572.80000110.2E81 G85E81-S83 VanDerWaalsContact C-N 3.31Å; E81-S83 PolarHBondContact O-N 3.31Å; S83-G85 PolarHBondContact O-N 2.87Å
84A44.3Very low65.5Low122 Ų12291.3 Ų91.3100%1.00853%0.531SS*.SBendtrans-68.464.5173.800000111.8
85G55Low66Low48 Ų4889.2 Ų89.250%0.49552%0.521SS..SBendtrans-129.4178-179.600000112.4S83S83-G85 PolarHBondContact O-N 2.87Å
86C63Low67.1Low27 Ų2785.8 Ų85.818%0.18251%0.505CS..PPolyproline II helixtrans-59.1138.7175.9-49.70000110.8R19 C37R19-C86 VanDerWaalsContact NH2-CB 3.26Å; R19-C86 PolarHBondContact NH2-SG 3.34Å; C37-C86 HydrophobicContact CB-CB 3.94Å; C37-C86 WeakPolarHBondContact CB-SG 3.21Å; C37-C86 PolarHBondContact N-SG 2.98Å; C37-C86 VanDerWaalsContact N-SG 3.4Å; C37-C86 WeakPolarHBondContact SG-CB 3.18Å; C37-C86 CovalentContact SG-SG 2.03Å; C37-C86 PolarHBondContact SG-SG 2.87Å
87L71.8Confident68.7Low64 Ų6479.3 Ų79.334%0.33548%0.477SS..PPolyproline II helixtrans-63.6143169.9-67.7175.1000110.5I41 L275 Q279I41-L87 HydrophobicContact CB-CD1 4.21Å; I41-L87 HydrophobicContact CD1-CB 4.29Å; I41-L87 HydrophobicContact CD1-CD1 3.91Å; I41-L87 HydrophobicContact CD1-CG 4Å; I41-L87 HydrophobicContact CG2-CD1 3.94Å; L87-L275 HydrophobicContact CB-CD2 3.96Å; L87-Q279 PolarHBondContact O-NE2 2.95Å; L87-Q279 PolarHBondContact O-OE1 3.5Å
88E76.4Confident70.8Confident163 Ų16373.4 Ų73.476%0.76244%0.438SS*.PPolyproline II helixtrans-65.1159.7171.3-66.2-175.1166.400111.1Q90 L275E88-Q90 WeakPolarHBondContact O-CG 3.2Å; E88-Q90 PolarHBondContact O-N 2.86Å; E88-Q90 PolarHBondContact O-NE2 3.45Å; E88-L275 VanDerWaalsContact O-CD2 3.25Å; E88-L275 WeakPolarHBondContact O-CD2 3.37Å
89N79.6Confident73.1Confident65 Ų6567.7 Ų67.735%0.34840%0.404SS..PPolyproline II helixtrans-57.1126.1179.5-174.4-22.1000110.8L91 D273 D276N89-L91 WeakPolarHBondContact OD1-CB 3.39Å; N89-L91 PolarHBondContact OD1-N 2.78Å; N89-D273 VanDerWaalsContact CG-OD2 3.31Å; N89-D273 PolarHBondContact ND2-OD2 3.03Å; N89-D273 PolarHBondContact OD1-OD2 3.43Å; N89-D276 PolarHBondContact ND2-OD2 3.27Å
90Q87.6Confident75.5Confident26 Ų2669.8 Ų69.812%0.12139%0.394CS..  trans-103.5-0.8-177.4-59.9-55.8-48.500113.8L43 I74 E88 A93 F94 L275L43-Q90 HydrophobicContact CD1-CG 4.35Å; I74-Q90 HydrophobicContact CD1-CG 4.48Å; I74-Q90 VanDerWaalsContact CD1-OE1 3.27Å; E88-Q90 WeakPolarHBondContact O-CG 3.2Å; E88-Q90 PolarHBondContact O-N 2.86Å; E88-Q90 PolarHBondContact O-NE2 3.45Å; Q90-A93 WeakPolarHBondContact O-CB 3.47Å; Q90-A93 PolarHBondContact O-N 3.15Å; Q90-A93 VanDerWaalsContact O-N 3.14Å; Q90-F94 HydrophobicContact CB-CE1 4.13Å; Q90-F94 HydrophobicContact CB-CE2 4.09Å; Q90-F94 HydrophobicContact CB-CZ 3.89Å; Q90-F94 WeakPolarHBondContact O-CG 3.4Å; Q90-F94 PolarHBondContact O-N 3.38Å; Q90-L275 HydrophobicContact CB-CD2 4.22Å; Q90-L275 HydrophobicContact CG-CD2 3.63Å
91L90.3Very high78.1Confident18 Ų1863.3 Ų63.39%0.09436%0.359CS..Hα-helixtrans-54.8-44.5179.217565.3000112.8F50 N89 A93 F94 L95 D273F50-L91 HydrophobicContact CD2-CD1 4.46Å; F50-L91 HydrophobicContact CE2-CD1 3.5Å; F50-L91 HydrophobicContact CZ-CD1 4.13Å; N89-L91 WeakPolarHBondContact OD1-CB 3.39Å; N89-L91 PolarHBondContact OD1-N 2.78Å; L91-A93 VanDerWaalsContact C-N 3.33Å; L91-A93 PolarHBondContact O-N 3.37Å; L91-F94 PolarHBondContact O-N 3.34Å; L91-L95 HydrophobicContact CD1-CD1 3.93Å; L91-L95 HydrophobicContact CD1-CG 3.98Å; L91-L95 HydrophobicContact CG-CD1 3.92Å; L91-L95 HydrophobicContact CG-CG 4.4Å; L91-L95 WeakPolarHBondContact O-CB 3.31Å; L91-L95 WeakPolarHBondContact O-CG 3.27Å; L91-L95 PolarHBondContact O-N 3.08Å; L91-D273 HydrophobicContact CD2-CB 4.24Å
92P91.3Very high80.6Confident53 Ų5361.2 Ų61.234%0.34435%0.347SS..Hα-helixtrans-60.8-41.7176.8-24.535.6000112.6L95 E96P92-L95 PolarHBondContact O-N 2.88Å; P92-E96 WeakPolarHBondContact O-CB 3.39Å; P92-E96 PolarHBondContact O-N 3.24Å
93A92.3Very high83Confident32 Ų3258.8 Ų58.826%0.26434%0.34SS..Hα-helixtrans-64.1-42.7177.900000111.7V70 I74 Q90 L91 E96 E97V70-A93 HydrophobicContact CG2-CB 4.3Å; I74-A93 HydrophobicContact CG1-CB 4.42Å; Q90-A93 WeakPolarHBondContact O-CB 3.47Å; Q90-A93 PolarHBondContact O-N 3.15Å; Q90-A93 VanDerWaalsContact O-N 3.14Å; L91-A93 VanDerWaalsContact C-N 3.33Å; L91-A93 PolarHBondContact O-N 3.37Å; A93-E96 PolarHBondContact O-N 3.46Å; A93-E97 PolarHBondContact O-N 3.38Å
94F95.8Very high85.6Confident3 Ų354.5 Ų54.51%0.01331%0.309CS..Hα-helixtrans-66.3-39.6176.9-62.8-19.6000112.9L43 A47 F50 F51 V70 I74 Q90 L91 E97 L98 V274L43-F94 HydrophobicContact CD1-CZ 4.01Å; A47-F94 HydrophobicContact CB-CE1 4.03Å; A47-F94 HydrophobicContact CB-CZ 4.06Å; F50-F94 HydrophobicContact CB-CD2 3.96Å; F50-F94 HydrophobicContact CB-CE2 4.3Å; F50-F94 HydrophobicContact CD1-CB 3.58Å; F50-F94 HydrophobicContact CD1-CD2 4.1Å; F50-F94 HydrophobicContact CD1-CG 4.09Å; F50-F94 HydrophobicContact CD2-CB 4.22Å; F50-F94 AromaticContact CD2-CD2 3.78Å; F50-F94 HydrophobicContact CD2-CD2 3.78Å; F50-F94 HydrophobicContact CD2-CG 4.46Å; F50-F94 HydrophobicContact CE1-CB 3.41Å; F50-F94 VanDerWaalsContact CE1-CB 3.41Å; F50-F94 HydrophobicContact CE1-CG 4.38Å; F50-F94 HydrophobicContact CE2-CB 4.05Å; F50-F94 HydrophobicContact CE2-CD2 4.31Å; F50-F94 HydrophobicContact CG-CB 4Å; F50-F94 AromaticContact CG-CD2 3.67Å; F50-F94 HydrophobicContact CG-CD2 3.67Å; F50-F94 HydrophobicContact CG-CE2 4.47Å; F50-F94 HydrophobicContact CG-CG 4.14Å; F50-F94 HydrophobicContact CZ-CB 3.65Å; F51-F94 HydrophobicContact CZ-CB 4.47Å; F51-F94 HydrophobicContact CZ-CD1 4.46Å; V70-F94 HydrophobicContact CG1-CD1 4.04Å; V70-F94 HydrophobicContact CG1-CE1 4Å; V70-F94 HydrophobicContact CG2-CD1 3.81Å; V70-F94 HydrophobicContact CG2-CE1 4.28Å; I74-F94 HydrophobicContact CD1-CE1 4.17Å; Q90-F94 HydrophobicContact CB-CE1 4.13Å; Q90-F94 HydrophobicContact CB-CE2 4.09Å; Q90-F94 HydrophobicContact CB-CZ 3.89Å; Q90-F94 WeakPolarHBondContact O-CG 3.4Å; Q90-F94 PolarHBondContact O-N 3.38Å; L91-F94 PolarHBondContact O-N 3.34Å; F94-E97 PolarHBondContact O-N 3.43Å; F94-L98 PolarHBondContact O-N 2.8Å; F94-V274 HydrophobicContact CD2-CG2 4.44Å; F94-V274 HydrophobicContact CE2-CG2 3.82Å
95L95.4Very high88Confident4 Ų448.7 Ų48.72%0.02126%0.261CS..Hα-helixtrans-67-36.6175.3-71.8170.5000112.2F50 L91 P92 L98 C99 H122 F125F50-L95 HydrophobicContact CZ-CD2 4.01Å; F50-L95 HydrophobicContact CZ-CG 4.22Å; L91-L95 HydrophobicContact CD1-CD1 3.93Å; L91-L95 HydrophobicContact CD1-CG 3.98Å; L91-L95 HydrophobicContact CG-CD1 3.92Å; L91-L95 HydrophobicContact CG-CG 4.4Å; L91-L95 WeakPolarHBondContact O-CB 3.31Å; L91-L95 WeakPolarHBondContact O-CG 3.27Å; L91-L95 PolarHBondContact O-N 3.08Å; P92-L95 PolarHBondContact O-N 2.88Å; L95-L98 HydrophobicContact CD2-CD1 4.37Å; L95-C99 PolarHBondContact O-N 3.4Å; L95-H122 HydrophobicContact CD1-CB 3.87Å; L95-F125 HydrophobicContact CD2-CD2 3.84Å; L95-F125 HydrophobicContact CD2-CE2 4.46Å
96E94.7Very high89.9Confident74 Ų7453.2 Ų53.235%0.34627%0.269SS..Hα-helixtrans-66.3-42.6175-166.962.5-149.800110.9P92 A93 L98 C99 H100 R121P92-E96 WeakPolarHBondContact O-CB 3.39Å; P92-E96 PolarHBondContact O-N 3.24Å; A93-E96 PolarHBondContact O-N 3.46Å; E96-L98 VanDerWaalsContact C-N 3.32Å; E96-L98 PolarHBondContact O-N 3.38Å; E96-C99 CarbonylContact O-C 3.57Å; E96-C99 WeakPolarHBondContact O-CA 3.48Å; E96-C99 WeakPolarHBondContact O-CB 3.19Å; E96-C99 PolarHBondContact O-N 3.31Å; E96-H100 VanDerWaalsContact CG-CE1 3.46Å; E96-H100 WeakPolarHBondContact CG-CE1 3.41Å; E96-H100 PolarHBondContact O-N 2.91Å; E96-H100 PolarHBondContact O-ND1 2.95Å; E96-H100 IonicContact OE1-NE2 3.99Å; E96-R121 IonicContact OE2-CZ 3.99Å; E96-R121 IonicContact OE2-NH1 3.81Å; E96-R121 PolarHBondContact OE2-NH1 3.09Å; E96-R121 IonicContact OE2-NH2 3.83Å; E96-R121 PolarHBondContact OE2-NH2 3.25Å
97E96.6Very high91.5Very high11 Ų1157.7 Ų57.75%0.05129%0.285CS..Hα-helixtrans-60.5-40.4177.6-174.260.5-153.800112.7F51 M66 D69 V70 A93 F94 C99 H100 E101F51-E97 HydrophobicContact CE1-CB 4.1Å; F51-E97 HydrophobicContact CE1-CG 4.18Å; F51-E97 HydrophobicContact CZ-CB 3.83Å; F51-E97 HydrophobicContact CZ-CG 3.78Å; M66-E97 HydrophobicContact CB-CG 4.34Å; M66-E97 HydrophobicContact CG-CG 4.49Å; D69-E97 WeakPolarHBondContact CB-OE1 3.42Å; V70-E97 HydrophobicContact CB-CB 3.99Å; V70-E97 HydrophobicContact CB-CG 3.9Å; V70-E97 HydrophobicContact CG2-CB 3.97Å; V70-E97 HydrophobicContact CG2-CG 4.44Å; A93-E97 PolarHBondContact O-N 3.38Å; F94-E97 PolarHBondContact O-N 3.43Å; E97-C99 PolarHBondContact O-N 3.45Å; E97-H100 PolarHBondContact O-N 3.22Å; E97-H100 VanDerWaalsContact O-N 3.15Å; E97-H100 IonicContact OE2-ND1 3.79Å; E97-H100 PolarHBondContact OE2-ND1 3.4Å; E97-E101 PolarHBondContact O-N 2.92Å; E97-E101 VanDerWaalsContact O-N 3.14Å
98L96.2Very high92.5Very high0 Ų056.7 Ų56.70%028%0.278CS..Hα-helixtrans-51.6-45.6171.8-74174.2000110.5F50 F51 F54 V55 M66 F94 L95 E96 E101 L105 F125F50-L98 HydrophobicContact CE1-CD1 3.82Å; F50-L98 HydrophobicContact CE1-CG 4.22Å; F50-L98 HydrophobicContact CZ-CD1 4.23Å; F51-L98 HydrophobicContact CD1-CD2 3.67Å; F51-L98 HydrophobicContact CD1-CG 4.1Å; F51-L98 HydrophobicContact CE1-CD2 4.04Å; F51-L98 HydrophobicContact CE1-CG 4.02Å; F54-L98 HydrophobicContact CB-CD1 4.33Å; V55-L98 HydrophobicContact CG2-CD2 3.48Å; V55-L98 VanDerWaalsContact CG2-CD2 3.48Å; M66-L98 HydrophobicContact SD-CD2 3.9Å; F94-L98 PolarHBondContact O-N 2.8Å; L95-L98 HydrophobicContact CD2-CD1 4.37Å; E96-L98 VanDerWaalsContact C-N 3.32Å; E96-L98 PolarHBondContact O-N 3.38Å; L98-E101 PolarHBondContact O-N 3.5Å; L98-L105 HydrophobicContact CB-CD1 4.48Å; L98-L105 HydrophobicContact CB-CD2 4.42Å; L98-L105 HydrophobicContact CD2-CD2 4.33Å; L98-L105 WeakPolarHBondContact O-CD1 3.47Å; L98-L105 WeakPolarHBondContact O-CG 3.48Å; L98-F125 HydrophobicContact CB-CE1 4.35Å; L98-F125 HydrophobicContact CB-CE2 4.19Å; L98-F125 HydrophobicContact CB-CZ 3.79Å; L98-F125 HydrophobicContact CD1-CD1 4.06Å; L98-F125 HydrophobicContact CD1-CD2 4.08Å; L98-F125 HydrophobicContact CD1-CE1 3.94Å; L98-F125 HydrophobicContact CD1-CE2 3.95Å; L98-F125 HydrophobicContact CD1-CG 4.14Å; L98-F125 HydrophobicContact CD1-CZ 3.89Å; L98-F125 HydrophobicContact CG-CZ 4.44Å
99C95.5Very high93.3Very high15 Ų1551.4 Ų51.410%0.10127%0.266CS..Hα-helixtrans-77.6-21.4-177.6-66.20000114.9L95 E96 E97 C114 R121L95-C99 PolarHBondContact O-N 3.4Å; E96-C99 CarbonylContact O-C 3.57Å; E96-C99 WeakPolarHBondContact O-CA 3.48Å; E96-C99 WeakPolarHBondContact O-CB 3.19Å; E96-C99 PolarHBondContact O-N 3.31Å; E97-C99 PolarHBondContact O-N 3.45Å; C99-C114 WeakPolarHBondContact CA-SG 3.33Å; C99-C114 HydrophobicContact CB-CB 3.74Å; C99-C114 WeakPolarHBondContact CB-SG 3.35Å; C99-C114 WeakPolarHBondContact SG-CA 3.05Å; C99-C114 WeakPolarHBondContact SG-CB 3.41Å; C99-C114 CovalentContact SG-SG 2.04Å; C99-C114 PolarHBondContact SG-SG 2.94Å; C99-R121 VanDerWaalsContact SG-CD 3.57Å
100H95.2Very high94.1Very high113 Ų11348.8 Ų48.852%0.52325%0.252SS..Hα-helixtrans-67.7-37.7168.1-69.9143.4000111.5E96 E97 K102E96-H100 VanDerWaalsContact CG-CE1 3.46Å; E96-H100 WeakPolarHBondContact CG-CE1 3.41Å; E96-H100 PolarHBondContact O-N 2.91Å; E96-H100 PolarHBondContact O-ND1 2.95Å; E96-H100 IonicContact OE1-NE2 3.99Å; E97-H100 PolarHBondContact O-N 3.22Å; E97-H100 VanDerWaalsContact O-N 3.15Å; E97-H100 IonicContact OE2-ND1 3.79Å; E97-H100 PolarHBondContact OE2-ND1 3.4Å; H100-K102 PolarHBondContact O-N 2.91Å
101E94.9Very high94.4Very high18 Ų1849.8 Ų49.88%0.08426%0.262CS..  trans-81.360.9-179.6-74.7-64.1136.700113.5K65 M66 E97 L98 D103 I104 L105K65-E101 WeakPolarHBondContact CE-OE1 3.49Å; K65-E101 IonicContact NZ-OE1 2.7Å; K65-E101 PolarHBondContact NZ-OE1 3.49Å; K65-E101 IonicContact NZ-OE2 2.69Å; K65-E101 PolarHBondContact NZ-OE2 3.3Å; M66-E101 HydrophobicContact CG-CB 4.23Å; M66-E101 HydrophobicContact CG-CG 3.68Å; M66-E101 HydrophobicContact SD-CB 4.47Å; E97-E101 PolarHBondContact O-N 2.92Å; E97-E101 VanDerWaalsContact O-N 3.14Å; L98-E101 PolarHBondContact O-N 3.5Å; E101-D103 PolarHBondContact O-N 3.22Å; E101-I104 HydrophobicContact CB-CB 4.21Å; E101-I104 HydrophobicContact CB-CD1 4.03Å; E101-I104 HydrophobicContact CB-CG1 4.32Å; E101-I104 HydrophobicContact CG-CD1 4.16Å; E101-I104 WeakPolarHBondContact O-CB 3.47Å; E101-I104 PolarHBondContact O-N 2.89Å; E101-I104 VanDerWaalsContact O-N 3.1Å; E101-I104 VanDerWaalsContact OE2-CD1 3.27Å; E101-I104 WeakPolarHBondContact OE2-CD1 3.29Å; E101-L105 PolarHBondContact O-N 3.43Å
102K93.1Very high94.6Very high148 Ų14855.1 Ų55.164%0.64329%0.291SS*.Hα-helixtrans-54.3-44.9-175-64.7-177.4-178.2-1800113.8H100 I104 L105 E106H100-K102 PolarHBondContact O-N 2.91Å; K102-I104 VanDerWaalsContact C-N 3.28Å; K102-I104 PolarHBondContact O-N 3.06Å; K102-L105 PolarHBondContact O-N 2.96Å; K102-E106 WeakPolarHBondContact O-CB 3.44Å; K102-E106 PolarHBondContact O-N 2.98Å
103D94.7Very high94.8Very high130 Ų13052.6 Ų52.670%0.69527%0.274SS*.Hα-helixtrans-62.9-37-178.6-63.3-15.2000111.5E101 K107E101-D103 PolarHBondContact O-N 3.22Å; D103-K107 WeakPolarHBondContact O-CB 3.44Å; D103-K107 PolarHBondContact O-N 3.23Å; D103-K107 VanDerWaalsContact O-N 3.16Å
104I94.2Very high95Very high10 Ų1053.1 Ų53.15%0.05128%0.276CS..Hα-helixtrans-69.5-47.6177.3-62.9179.4000109.5E62 M66 E101 K102 E106 K107 Y108E62-I104 HydrophobicContact CB-CD1 3.88Å; E62-I104 HydrophobicContact CB-CG1 4.48Å; E62-I104 HydrophobicContact CG-CD1 4.07Å; E62-I104 HydrophobicContact CG-CG1 4.24Å; M66-I104 HydrophobicContact CE-CD1 4.48Å; M66-I104 HydrophobicContact CE-CG2 4.45Å; M66-I104 HydrophobicContact CG-CD1 4.27Å; M66-I104 HydrophobicContact SD-CD1 4.43Å; E101-I104 HydrophobicContact CB-CB 4.21Å; E101-I104 HydrophobicContact CB-CD1 4.03Å; E101-I104 HydrophobicContact CB-CG1 4.32Å; E101-I104 HydrophobicContact CG-CD1 4.16Å; E101-I104 WeakPolarHBondContact O-CB 3.47Å; E101-I104 PolarHBondContact O-N 2.89Å; E101-I104 VanDerWaalsContact O-N 3.1Å; E101-I104 VanDerWaalsContact OE2-CD1 3.27Å; E101-I104 WeakPolarHBondContact OE2-CD1 3.29Å; K102-I104 VanDerWaalsContact C-N 3.28Å; K102-I104 PolarHBondContact O-N 3.06Å; I104-E106 PolarHBondContact O-N 3.36Å; I104-K107 WeakPolarHBondContact O-CB 3.43Å; I104-K107 PolarHBondContact O-N 3.03Å; I104-Y108 HydrophobicContact CG2-CD2 3.92Å; I104-Y108 HydrophobicContact CG2-CE2 3.9Å; I104-Y108 WeakPolarHBondContact O-CD2 3.27Å; I104-Y108 PolarHBondContact O-N 3.45Å
105L94.5Very high94.8Very high1 Ų157.9 Ų57.91%0.00531%0.31CS..Hα-helixtrans-66.5-36.9-179.6-65.2-166.4000113V55 L98 E101 K102 Y108 G109 L110 C114 F125V55-L105 HydrophobicContact CG2-CD2 4.38Å; L98-L105 HydrophobicContact CB-CD1 4.48Å; L98-L105 HydrophobicContact CB-CD2 4.42Å; L98-L105 HydrophobicContact CD2-CD2 4.33Å; L98-L105 WeakPolarHBondContact O-CD1 3.47Å; L98-L105 WeakPolarHBondContact O-CG 3.48Å; E101-L105 PolarHBondContact O-N 3.43Å; K102-L105 PolarHBondContact O-N 2.96Å; L105-Y108 CarbonylContact O-C 3.52Å; L105-Y108 PolarHBondContact O-N 2.68Å; L105-G109 PolarHBondContact O-N 2.93Å; L105-L110 HydrophobicContact CB-CB 4.25Å; L105-L110 HydrophobicContact CD2-CB 3.93Å; L105-L110 HydrophobicContact CD2-CD1 4.17Å; L105-L110 PolarHBondContact O-N 3.31Å; L105-C114 WeakPolarHBondContact CD1-SG 3.29Å; L105-F125 HydrophobicContact CD1-CE1 4.26Å; L105-F125 HydrophobicContact CD1-CZ 3.89Å; L105-F125 HydrophobicContact CD2-CE1 4.11Å; L105-F125 HydrophobicContact CD2-CZ 4.45Å
106E95.1Very high94.6Very high143 Ų14362.1 Ų62.167%0.66833%0.329SS*.Hα-helixtrans-63.9-44.8176.3-175175.7-178.700110.5K102 I104 Y108 G109 S111K102-E106 WeakPolarHBondContact O-CB 3.44Å; K102-E106 PolarHBondContact O-N 2.98Å; I104-E106 PolarHBondContact O-N 3.36Å; E106-Y108 PolarHBondContact O-N 2.89Å; E106-G109 PolarHBondContact O-N 3.17Å; E106-S111 VanDerWaalsContact CA-OG 3.26Å; E106-S111 WeakPolarHBondContact CA-OG 3.41Å; E106-S111 PolarHBondContact N-OG 3.48Å; E106-S111 VanDerWaalsContact N-OG 3.14Å
107K95.7Very high94.4Very high120 Ų12062.7 Ų62.752%0.52234%0.341SS..Hα-helixtrans-55.5-36.5176.6176.7-180173.5-174.60113.1E62 D103 I104E62-K107 IonicContact OE1-NZ 2.67Å; E62-K107 PolarHBondContact OE1-NZ 2.73Å; E62-K107 IonicContact OE2-NZ 3.66Å; D103-K107 WeakPolarHBondContact O-CB 3.44Å; D103-K107 PolarHBondContact O-N 3.23Å; D103-K107 VanDerWaalsContact O-N 3.16Å; I104-K107 WeakPolarHBondContact O-CB 3.43Å; I104-K107 PolarHBondContact O-N 3.03Å
108Y94Very high93.9Very high44 Ų4467.6 Ų67.617%0.17336%0.364CS..THydrogen-bonded Turntrans-103.37.2-177.4-59.4-61.4000114V55 E57 A58 E62 I104 L105 E106V55-Y108 HydrophobicContact CG1-CD2 3.53Å; V55-Y108 HydrophobicContact CG1-CE2 4.18Å; V55-Y108 HydrophobicContact CG1-CG 4.05Å; E57-Y108 HydrophobicContact CB-CD1 3.64Å; E57-Y108 HydrophobicContact CB-CE1 3.68Å; E57-Y108 HydrophobicContact CB-CG 4.49Å; E57-Y108 PolarHBondContact O-OH 3.48Å; A58-Y108 WeakPolarHBondContact CA-OH 3.03Å; A58-Y108 HydrophobicContact CB-CE2 3.87Å; E62-Y108 PolarHBondContact OE1-OH 3.32Å; E62-Y108 PolarHBondContact OE2-OH 3.45Å; I104-Y108 HydrophobicContact CG2-CD2 3.92Å; I104-Y108 HydrophobicContact CG2-CE2 3.9Å; I104-Y108 WeakPolarHBondContact O-CD2 3.27Å; I104-Y108 PolarHBondContact O-N 3.45Å; L105-Y108 CarbonylContact O-C 3.52Å; L105-Y108 PolarHBondContact O-N 2.68Å; E106-Y108 PolarHBondContact O-N 2.89Å
109G93.8Very high93.6Very high51 Ų5173.6 Ų73.653%0.52639%0.392SS..THydrogen-bonded Turntrans67.137.4176.200000114.2L105 E106L105-G109 PolarHBondContact O-N 2.93Å; E106-G109 PolarHBondContact O-N 3.17Å
110L94.9Very high93.4Very high10 Ų1073.5 Ų73.55%0.05239%0.394CS..  trans-112.8-2.9-177.7-63.5178.1000113.9V55 L105 D112 C113 F125 H128V55-L110 HydrophobicContact CB-CD1 4.39Å; V55-L110 HydrophobicContact CG1-CD1 3.98Å; V55-L110 HydrophobicContact CG2-CD1 3.95Å; L105-L110 HydrophobicContact CB-CB 4.25Å; L105-L110 HydrophobicContact CD2-CB 3.93Å; L105-L110 HydrophobicContact CD2-CD1 4.17Å; L105-L110 PolarHBondContact O-N 3.31Å; L110-D112 PolarHBondContact O-N 3.26Å; L110-D112 VanDerWaalsContact O-N 3.17Å; L110-C113 WeakPolarHBondContact O-CB 3.32Å; L110-C113 PolarHBondContact O-N 2.97Å; L110-C113 VanDerWaalsContact O-N 3.13Å; L110-F125 HydrophobicContact CB-CE1 4.09Å; L110-F125 HydrophobicContact CD1-CE1 4.41Å; L110-H128 HydrophobicContact CD2-CB 3.62Å; L110-H128 WeakPolarHBondContact CD2-ND1 3.39Å
111S94Very high93.4Very high47 Ų4769.4 Ų69.433%0.32937%0.374SS..G310 helixtrans-58.5-31.2-174.3-56.10000113.9E106 C113 C114E106-S111 VanDerWaalsContact CA-OG 3.26Å; E106-S111 WeakPolarHBondContact CA-OG 3.41Å; E106-S111 PolarHBondContact N-OG 3.48Å; E106-S111 VanDerWaalsContact N-OG 3.14Å; S111-C113 PolarHBondContact O-N 2.7Å; S111-C114 WeakPolarHBondContact O-CB 3.4Å; S111-C114 PolarHBondContact O-N 2.55Å; S111-C114 VanDerWaalsContact O-N 3.1Å
112D94.6Very high93.4Very high130 Ų13068.9 Ų68.970%0.69537%0.372SS*.G310 helixtrans-61.7-28.6-179.4-69.4-14.6000112.4L110 C114 S115L110-D112 PolarHBondContact O-N 3.26Å; L110-D112 VanDerWaalsContact O-N 3.17Å; D112-C114 PolarHBondContact O-N 3.4Å; D112-S115 PolarHBondContact O-N 2.99Å; D112-S115 PolarHBondContact O-OG 3.2Å
113C96.3Very high93.5Very high0 Ų065.4 Ų65.40%036%0.36CS..G310 helixtrans-62.5-30.8177.2-650000112.7L110 S111 S115 Q116 R121 C124 F125L110-C113 WeakPolarHBondContact O-CB 3.32Å; L110-C113 PolarHBondContact O-N 2.97Å; L110-C113 VanDerWaalsContact O-N 3.13Å; S111-C113 PolarHBondContact O-N 2.7Å; C113-S115 PolarHBondContact O-N 3.11Å; C113-Q116 PolarHBondContact O-N 3.39Å; C113-R121 WeakPolarHBondContact O-CB 3.25Å; C113-R121 WeakPolarHBondContact O-CG 3.4Å; C113-C124 WeakPolarHBondContact CA-SG 3.44Å; C113-C124 HydrophobicContact CB-CB 3.62Å; C113-C124 WeakPolarHBondContact CB-SG 3.3Å; C113-C124 VanDerWaalsContact SG-C 3.52Å; C113-C124 WeakPolarHBondContact SG-CB 3.42Å; C113-C124 CovalentContact SG-SG 2.05Å; C113-C124 PolarHBondContact SG-SG 2.58Å; C113-F125 HydrophobicContact CB-CD1 4.18Å; C113-F125 HydrophobicContact CB-CD2 4.08Å; C113-F125 HydrophobicContact CB-CE1 4.02Å; C113-F125 HydrophobicContact CB-CE2 3.93Å; C113-F125 HydrophobicContact CB-CG 4.19Å; C113-F125 HydrophobicContact CB-CZ 3.89Å
114C95.6Very high93.6Very high43 Ų4360 Ų6029%0.29133%0.332SS..G310 helixtrans-75.9-9.3-176.9-65.40000114.4C99 L105 S111 D112 Q116C99-C114 WeakPolarHBondContact CA-SG 3.33Å; C99-C114 HydrophobicContact CB-CB 3.74Å; C99-C114 WeakPolarHBondContact CB-SG 3.35Å; C99-C114 WeakPolarHBondContact SG-CA 3.05Å; C99-C114 WeakPolarHBondContact SG-CB 3.41Å; C99-C114 CovalentContact SG-SG 2.04Å; C99-C114 PolarHBondContact SG-SG 2.94Å; L105-C114 WeakPolarHBondContact CD1-SG 3.29Å; S111-C114 WeakPolarHBondContact O-CB 3.4Å; S111-C114 PolarHBondContact O-N 2.55Å; S111-C114 VanDerWaalsContact O-N 3.1Å; D112-C114 PolarHBondContact O-N 3.4Å; C114-Q116 VanDerWaalsContact C-N 3.35Å
115S91.6Very high93.7Very high104 Ų10459.5 Ų59.573%0.72733%0.33SS*.G310 helixtrans-85.8-7.7175.969.60000113.7D112 C113D112-S115 PolarHBondContact O-N 2.99Å; D112-S115 PolarHBondContact O-OG 3.2Å; C113-S115 PolarHBondContact O-N 3.11Å
116Q91.9Very high93.8Very high92 Ų9260.9 Ų60.943%0.4334%0.337SS..SBendtrans-89.9168.4-174.4-56.3-166.527.200112.4C113 C114 G120 R121C113-Q116 PolarHBondContact O-N 3.39Å; C114-Q116 VanDerWaalsContact C-N 3.35Å; Q116-G120 PolarHBondContact OE1-O 2.98Å; Q116-G120 VanDerWaalsContact OE1-O 3.07Å; Q116-R121 HydrophobicContact CB-CB 4.38Å
117S90.2Very high93.7Very high86 Ų8658.1 Ų58.160%0.60134%0.338SS*.  trans-59.8166167.862.20000111E119 G120 R121S117-E119 PolarHBondContact O-N 2.96Å; S117-G120 CarbonylContact O-C 3.05Å; S117-G120 PolarHBondContact O-N 2.91Å; S117-G120 VanDerWaalsContact O-N 3.1Å; S117-G120 PolarHBondContact OG-N 3.33Å; S117-R121 WeakPolarHBondContact O-CB 3.42Å; S117-R121 PolarHBondContact O-N 3.25Å
118E86.1Confident93.5Very high114 Ų11456.4 Ų56.453%0.53333%0.332SS..Hα-helixtrans-54-50.3-178.2-173.5176.2-177.700113.4R121 H122E118-R121 PolarHBondContact O-N 3.15Å; E118-H122 PolarHBondContact O-N 3.09Å
119E89.6Confident93.5Very high126 Ų12654.8 Ų54.859%0.58933%0.326SS*.Hα-helixtrans-66.5-39.4176.2-174.4177.7-168.900112.2S117 H122 N123S117-E119 PolarHBondContact O-N 2.96Å; E119-H122 PolarHBondContact O-N 2.85Å; E119-N123 WeakPolarHBondContact O-CB 3.26Å; E119-N123 VanDerWaalsContact O-CG 3.28Å; E119-N123 PolarHBondContact O-N 3.28Å; E119-N123 PolarHBondContact O-ND2 3.09Å
120G92.2Very high93.4Very high14 Ų1457 Ų5714%0.14432%0.321CS..Hα-helixtrans-63.4-43176.300000112.3Q116 S117 N123 C124Q116-G120 PolarHBondContact OE1-O 2.98Å; Q116-G120 VanDerWaalsContact OE1-O 3.07Å; S117-G120 CarbonylContact O-C 3.05Å; S117-G120 PolarHBondContact O-N 2.91Å; S117-G120 VanDerWaalsContact O-N 3.1Å; S117-G120 PolarHBondContact OG-N 3.33Å; G120-N123 PolarHBondContact O-N 2.99Å; G120-C124 VanDerWaalsContact O-CB 3.29Å; G120-C124 WeakPolarHBondContact O-CB 3.25Å; G120-C124 PolarHBondContact O-N 3.21Å
121R94.4Very high92.8Very high27 Ų2758 Ų5810%0.10233%0.328CS..Hα-helixtrans-59.8-48.7176173.617365.3176.34.2110.6E96 C99 C113 Q116 S117 E118 C124 F125E96-R121 IonicContact OE2-CZ 3.99Å; E96-R121 IonicContact OE2-NH1 3.81Å; E96-R121 PolarHBondContact OE2-NH1 3.09Å; E96-R121 IonicContact OE2-NH2 3.83Å; E96-R121 PolarHBondContact OE2-NH2 3.25Å; C99-R121 VanDerWaalsContact SG-CD 3.57Å; C113-R121 WeakPolarHBondContact O-CB 3.25Å; C113-R121 WeakPolarHBondContact O-CG 3.4Å; Q116-R121 HydrophobicContact CB-CB 4.38Å; S117-R121 WeakPolarHBondContact O-CB 3.42Å; S117-R121 PolarHBondContact O-N 3.25Å; E118-R121 PolarHBondContact O-N 3.15Å; R121-C124 WeakPolarHBondContact O-CB 3.36Å; R121-C124 PolarHBondContact O-N 3.2Å; R121-F125 HydrophobicContact CG-CD2 3.84Å; R121-F125 HydrophobicContact CG-CE2 3.64Å; R121-F125 WeakPolarHBondContact O-CD2 3.41Å; R121-F125 PolarHBondContact O-N 3.46Å
122H95.3Very high92Very high7 Ų761.5 Ų61.53%0.03235%0.348CS..Hα-helixtrans-58.7-49.9176-177.3-159.8000111.9L95 E118 E119 C124 F125 L126 R271L95-H122 HydrophobicContact CD1-CB 3.87Å; E118-H122 PolarHBondContact O-N 3.09Å; E119-H122 PolarHBondContact O-N 2.85Å; H122-C124 VanDerWaalsContact C-N 3.31Å; H122-C124 PolarHBondContact O-N 3.27Å; H122-F125 PolarHBondContact O-N 2.96Å; H122-L126 WeakPolarHBondContact O-CB 3.14Å; H122-L126 WeakPolarHBondContact O-CG 3.47Å; H122-L126 PolarHBondContact O-N 3.43Å; H122-R271 PolarHBondContact CE1-NE 3.37Å; H122-R271 PolarHBondContact CE1-O 2.94Å; H122-R271 PolarHBondContact ND1-NH2 3.09Å; H122-R271 VanDerWaalsContact ND1-NH2 3.2Å; H122-R271 PolarHBondContact NE2-O 3.43Å
123N95.3Very high90.9Very high74 Ų7456 Ų5640%0.39632%0.319SS..Hα-helixtrans-63.2-36.8179.2-73.5-29.5000112.5E119 G120 L126 A127E119-N123 WeakPolarHBondContact O-CB 3.26Å; E119-N123 VanDerWaalsContact O-CG 3.28Å; E119-N123 PolarHBondContact O-N 3.28Å; E119-N123 PolarHBondContact O-ND2 3.09Å; G120-N123 PolarHBondContact O-N 2.99Å; N123-L126 PolarHBondContact O-N 3.35Å; N123-A127 WeakPolarHBondContact O-CB 3.37Å; N123-A127 PolarHBondContact O-N 3.07Å
124C96.7Very high89.6Confident17 Ų1761 Ų6112%0.11536%0.361CS..Hα-helixtrans-60.8-54.5174.1-175.70000110.7C113 G120 R121 H122 L126 A127 H128C113-C124 WeakPolarHBondContact CA-SG 3.44Å; C113-C124 HydrophobicContact CB-CB 3.62Å; C113-C124 WeakPolarHBondContact CB-SG 3.3Å; C113-C124 VanDerWaalsContact SG-C 3.52Å; C113-C124 WeakPolarHBondContact SG-CB 3.42Å; C113-C124 CovalentContact SG-SG 2.05Å; C113-C124 PolarHBondContact SG-SG 2.58Å; G120-C124 VanDerWaalsContact O-CB 3.29Å; G120-C124 WeakPolarHBondContact O-CB 3.25Å; G120-C124 PolarHBondContact O-N 3.21Å; R121-C124 WeakPolarHBondContact O-CB 3.36Å; R121-C124 PolarHBondContact O-N 3.2Å; H122-C124 VanDerWaalsContact C-N 3.31Å; H122-C124 PolarHBondContact O-N 3.27Å; C124-L126 VanDerWaalsContact C-N 3.28Å; C124-L126 PolarHBondContact O-N 2.84Å; C124-A127 WeakPolarHBondContact O-CB 3.35Å; C124-A127 PolarHBondContact O-N 2.7Å; C124-A127 VanDerWaalsContact O-N 3.07Å; C124-H128 PolarHBondContact O-CD2 3.12Å; C124-H128 VanDerWaalsContact O-CD2 3.3Å; C124-H128 PolarHBondContact O-N 3.15Å
125F96.8Very high88.7Confident0 Ų061.9 Ų61.90%037%0.367CS..Hα-helixtrans-58.8-39.2177.7-80.5-58.9000112.7F54 L95 L98 L105 L110 C113 R121 H122 A127 H128F54-F125 HydrophobicContact CD1-CB 3.64Å; F54-F125 HydrophobicContact CE1-CB 3.75Å; L95-F125 HydrophobicContact CD2-CD2 3.84Å; L95-F125 HydrophobicContact CD2-CE2 4.46Å; L98-F125 HydrophobicContact CB-CE1 4.35Å; L98-F125 HydrophobicContact CB-CE2 4.19Å; L98-F125 HydrophobicContact CB-CZ 3.79Å; L98-F125 HydrophobicContact CD1-CD1 4.06Å; L98-F125 HydrophobicContact CD1-CD2 4.08Å; L98-F125 HydrophobicContact CD1-CE1 3.94Å; L98-F125 HydrophobicContact CD1-CE2 3.95Å; L98-F125 HydrophobicContact CD1-CG 4.14Å; L98-F125 HydrophobicContact CD1-CZ 3.89Å; L98-F125 HydrophobicContact CG-CZ 4.44Å; L105-F125 HydrophobicContact CD1-CE1 4.26Å; L105-F125 HydrophobicContact CD1-CZ 3.89Å; L105-F125 HydrophobicContact CD2-CE1 4.11Å; L105-F125 HydrophobicContact CD2-CZ 4.45Å; L110-F125 HydrophobicContact CB-CE1 4.09Å; L110-F125 HydrophobicContact CD1-CE1 4.41Å; C113-F125 HydrophobicContact CB-CD1 4.18Å; C113-F125 HydrophobicContact CB-CD2 4.08Å; C113-F125 HydrophobicContact CB-CE1 4.02Å; C113-F125 HydrophobicContact CB-CE2 3.93Å; C113-F125 HydrophobicContact CB-CG 4.19Å; C113-F125 HydrophobicContact CB-CZ 3.89Å; R121-F125 HydrophobicContact CG-CD2 3.84Å; R121-F125 HydrophobicContact CG-CE2 3.64Å; R121-F125 WeakPolarHBondContact O-CD2 3.41Å; R121-F125 PolarHBondContact O-N 3.46Å; H122-F125 PolarHBondContact O-N 2.96Å; F125-A127 PolarHBondContact O-N 3.02Å; F125-H128 PolarHBondContact O-N 3.36Å
126L95.1Very high88.1Confident30 Ų3057.6 Ų57.616%0.15734%0.336CS..Hα-helixtrans-62.3-41.1174.7-78.6173.3000112.8F54 H122 N123 C124 H128 K129 R271F54-L126 HydrophobicContact CE1-CD2 3.78Å; F54-L126 HydrophobicContact CE1-CG 3.97Å; F54-L126 HydrophobicContact CZ-CD2 3.71Å; F54-L126 HydrophobicContact CZ-CG 4.18Å; H122-L126 WeakPolarHBondContact O-CB 3.14Å; H122-L126 WeakPolarHBondContact O-CG 3.47Å; H122-L126 PolarHBondContact O-N 3.43Å; N123-L126 PolarHBondContact O-N 3.35Å; C124-L126 VanDerWaalsContact C-N 3.28Å; C124-L126 PolarHBondContact O-N 2.84Å; L126-H128 PolarHBondContact O-N 2.91Å; L126-K129 HydrophobicContact CD2-CD 4.24Å; L126-K129 WeakPolarHBondContact O-CB 3.26Å; L126-K129 PolarHBondContact O-N 2.91Å; L126-R271 HydrophobicContact CD1-CB 4.31Å; L126-R271 HydrophobicContact CD1-CG 4.4Å; L126-R271 WeakPolarHBondContact CD2-O 3.32Å
127A93.3Very high87.4Confident84 Ų8457.4 Ų57.469%0.69434%0.343SS*.Hα-helixtrans-65.1-24.9178.400000112.9N123 C124 F125N123-A127 WeakPolarHBondContact O-CB 3.37Å; N123-A127 PolarHBondContact O-N 3.07Å; C124-A127 WeakPolarHBondContact O-CB 3.35Å; C124-A127 PolarHBondContact O-N 2.7Å; C124-A127 VanDerWaalsContact O-N 3.07Å; F125-A127 PolarHBondContact O-N 3.02Å
128H93Very high86.7Confident84 Ų8459.7 Ų59.739%0.38935%0.353SS..Hα-helixtrans-82-12.5176.6-82.8-91.4000114.3L110 C124 F125 L126 K130L110-H128 HydrophobicContact CD2-CB 3.62Å; L110-H128 WeakPolarHBondContact CD2-ND1 3.39Å; C124-H128 PolarHBondContact O-CD2 3.12Å; C124-H128 VanDerWaalsContact O-CD2 3.3Å; C124-H128 PolarHBondContact O-N 3.15Å; F125-H128 PolarHBondContact O-N 3.36Å; L126-H128 PolarHBondContact O-N 2.91Å; H128-K130 PolarHBondContact O-N 3.28Å
129K93.8Very high86.2Confident10 Ų1057.5 Ų57.54%0.04334%0.342CS..  trans-62.3121.9172.4-70.9-170166.3-168.60109.7Q53 F54 L126 P131 P171 F172Q53-K129 WeakPolarHBondContact O-CE 3.33Å; F54-K129 HydrophobicContact CD1-CG 4.39Å; F54-K129 HydrophobicContact CE1-CD 4.5Å; L126-K129 HydrophobicContact CD2-CD 4.24Å; L126-K129 WeakPolarHBondContact O-CB 3.26Å; L126-K129 PolarHBondContact O-N 2.91Å; K129-P131 VanDerWaalsContact O-CD 3.26Å; K129-P131 WeakPolarHBondContact O-CD 3.12Å; K129-P171 HydrophobicContact CB-CB 4.29Å; K129-P171 HydrophobicContact CD-CB 4.24Å; K129-P171 HydrophobicContact CG-CB 4.42Å; K129-P171 PolarHBondContact NZ-O 3.29Å; K129-F172 HydrophobicContact CB-CE2 4.19Å; K129-F172 HydrophobicContact CB-CZ 3.82Å; K129-F172 HydrophobicContact CD-CE1 4.3Å; K129-F172 HydrophobicContact CD-CZ 4.39Å
130K90.1Very high85.1Confident98 Ų9859.3 Ų59.343%0.42635%0.35SS..  trans-94.2110.2-179.4-64.7178.7-171.5169.20110.3Q56 E57 H128 T132 P133 P171Q56-K130 PolarHBondContact NE2-O 3.47Å; E57-K130 IonicContact OE1-NZ 2.81Å; E57-K130 PolarHBondContact OE1-NZ 2.88Å; H128-K130 PolarHBondContact O-N 3.28Å; K130-T132 PolarHBondContact O-N 3.27Å; K130-P133 HydrophobicContact CB-CB 4.34Å; K130-P171 WeakPolarHBondContact O-CG 3.35Å
131P83.8Confident83.9Confident31 Ų3164.1 Ų64.120%0.20138%0.376CS..SBendtrans-41.4-37.1172.6-40.943.2000116.5K129 F172 Q221 I486K129-P131 VanDerWaalsContact O-CD 3.26Å; K129-P131 WeakPolarHBondContact O-CD 3.12Å; P131-F172 HydrophobicContact CG-CE2 4.17Å; P131-Q221 PolarHBondContact O-NE2 3.48Å; P131-I486 HydrophobicContact CB-CG2 3.74Å; P131-I486 HydrophobicContact CG-CG2 3.77Å
132T75.8Confident82.8Confident121 Ų12165.6 Ų65.674%0.74239%0.39SS*.SBendtrans-142.891.7179.2-550000107.2K130 A134K130-T132 PolarHBondContact O-N 3.27Å; T132-A134 PolarHBondContact O-N 3.43Å
133P72.1Confident82.1Confident14 Ų1469.6 Ų69.69%0.09141%0.408CS..  trans-73.399.7-174.329.5-34.3000110.2K130 S135 I136K130-P133 HydrophobicContact CB-CB 4.34Å; P133-S135 PolarHBondContact O-N 2.81Å; P133-I136 HydrophobicContact CB-CB 4.34Å; P133-I136 HydrophobicContact CB-CD1 3.62Å; P133-I136 HydrophobicContact CB-CG1 3.89Å; P133-I136 HydrophobicContact CG-CB 4.17Å; P133-I136 HydrophobicContact CG-CD1 3.45Å; P133-I136 VanDerWaalsContact CG-CD1 3.45Å; P133-I136 HydrophobicContact CG-CG1 4.03Å; P133-I136 PolarHBondContact O-N 3.01Å; P133-I136 VanDerWaalsContact O-N 3.14Å
134A69.8Low81.5Confident105 Ų10566.8 Ų66.887%0.86839%0.394SS*.THydrogen-bonded Turntrans-62-22.2179.300000113.6T132 I136T132-A134 PolarHBondContact O-N 3.43Å; A134-I136 VanDerWaalsContact C-N 3.34Å
135S75.1Confident80.7Confident61 Ų6169.9 Ų69.943%0.42741%0.412SS..THydrogen-bonded Turntrans-77-1517845.40000113.9E57 P133E57-S135 VanDerWaalsContact CD-OG 3.24Å; E57-S135 WeakPolarHBondContact CG-OG 3.31Å; E57-S135 WeakPolarHBondContact OE1-CB 3.4Å; E57-S135 PolarHBondContact OE1-OG 3.2Å; P133-S135 PolarHBondContact O-N 2.81Å
136I80.6Confident80.1Confident15 Ų1574 Ų748%0.07744%0.437CS..SBendtrans-95.8120-179.4-59.6174.4000109.1Q56 P133 A134 R168 R169Q56-I136 HydrophobicContact CB-CD1 3.89Å; Q56-I136 WeakPolarHBondContact O-CD1 3.47Å; P133-I136 HydrophobicContact CB-CB 4.34Å; P133-I136 HydrophobicContact CB-CD1 3.62Å; P133-I136 HydrophobicContact CB-CG1 3.89Å; P133-I136 HydrophobicContact CG-CB 4.17Å; P133-I136 HydrophobicContact CG-CD1 3.45Å; P133-I136 VanDerWaalsContact CG-CD1 3.45Å; P133-I136 HydrophobicContact CG-CG1 4.03Å; P133-I136 PolarHBondContact O-N 3.01Å; P133-I136 VanDerWaalsContact O-N 3.14Å; A134-I136 VanDerWaalsContact C-N 3.34Å; I136-R168 HydrophobicContact CD1-CB 4.14Å; I136-R168 HydrophobicContact CD1-CG 4.07Å; I136-R168 VanDerWaalsContact CD1-O 3.26Å; I136-R168 WeakPolarHBondContact CD1-O 3.48Å; I136-R169 HydrophobicContact CG2-CG 3.77Å
137P77.5Confident79.7Confident88 Ų8872.8 Ų72.857%0.57143%0.431SS*.PPolyproline II helixtrans-57.1149.2176.1-24.233.6000112.1F139 R169P137-F139 PolarHBondContact O-N 3.39Å; P137-R169 PolarHBondContact O-NE 2.95Å; P137-R169 VanDerWaalsContact O-NE 3.12Å; P137-R169 PolarHBondContact O-NH2 3.25Å; P137-R169 VanDerWaalsContact O-NH2 3.14Å
138V74.3Confident79.7Confident133 Ų13369.4 Ų69.481%0.80640%0.402SS*.PPolyproline II helixtrans-48.3132.4169.2179.90000108.2Q140V138-Q140 PolarHBondContact O-N 2.91Å
139F75.3Confident79.6Confident69 Ų6971.1 Ų71.130%0.30341%0.411SS..  trans-55.3114178.8-178.8-99.7000108.9P137 V141 E165P137-F139 PolarHBondContact O-N 3.39Å; F139-V141 HydrophobicContact CD1-CG2 4.38Å; F139-V141 HydrophobicContact CE1-CG2 4.39Å; F139-V141 PolarHBondContact O-N 3.14Å; F139-E165 HydrophobicContact CD2-CB 4.02Å; F139-E165 HydrophobicContact CE2-CB 3.78Å; F139-E165 HydrophobicContact CE2-CG 4.12Å
140Q66.6Low79.5Confident163 Ų16372.5 Ų72.576%0.76242%0.424SS*.  trans-82.1115174-66.9-175.5-8.500106.4V138 P142V138-Q140 PolarHBondContact O-N 2.91Å; Q140-P142 WeakPolarHBondContact O-CD 3.44Å; Q140-P142 VanDerWaalsContact O-N 3.11Å
141V68.1Low79.7Confident116 Ų11669.1 Ų69.170%0.70341%0.409SS*.  trans-59.7115.5172.2-178.80000106.5F139F139-V141 HydrophobicContact CD1-CG2 4.38Å; F139-V141 HydrophobicContact CE1-CG2 4.39Å; F139-V141 PolarHBondContact O-N 3.14Å
142P69.8Low80.3Confident58 Ų5874.8 Ų74.838%0.37743%0.432SS..  trans-64.3151.7-178-14.928.5000109.9Q140 S147Q140-P142 WeakPolarHBondContact O-CD 3.44Å; Q140-P142 VanDerWaalsContact O-N 3.11Å; P142-S147 WeakPolarHBondContact CB-OG 3.45Å
143E80.9Confident81.2Confident90 Ų9077.3 Ų77.342%0.42144%0.436SS..  trans-61.4133-179.7-171.3-73.313300109.2V145 T146 S147E143-V145 VanDerWaalsContact CD-N 3.27Å; E143-V145 PolarHBondContact O-N 3.37Å; E143-V145 WeakPolarHBondContact OE1-CG2 3.21Å; E143-V145 PolarHBondContact OE1-N 3.27Å; E143-V145 WeakPolarHBondContact OE2-CA 3.36Å; E143-V145 VanDerWaalsContact OE2-CB 3.28Å; E143-V145 WeakPolarHBondContact OE2-CB 3.4Å; E143-V145 PolarHBondContact OE2-N 2.65Å; E143-T146 PolarHBondContact O-N 3.44Å; E143-T146 PolarHBondContact OE2-N 3.06Å; E143-T146 PolarHBondContact OE2-OG1 3.39Å; E143-S147 WeakPolarHBondContact O-CB 3.35Å; E143-S147 PolarHBondContact O-N 2.76Å; E143-S147 PolarHBondContact O-OG 2.94Å
144P82.9Confident82.3Confident16 Ų1680 Ų8010%0.10445%0.449CS..Hα-helixtrans-55.6-42.4-172.2-33.139.3000115.5S147 C148 A198 V199 F202P144-S147 WeakPolarHBondContact O-CB 3.48Å; P144-S147 PolarHBondContact O-N 2.85Å; P144-C148 WeakPolarHBondContact O-CB 3.09Å; P144-C148 PolarHBondContact O-N 3.25Å; P144-C148 PolarHBondContact O-SG 3.34Å; P144-A198 HydrophobicContact CB-CB 3.8Å; P144-V199 HydrophobicContact CG-CB 4.27Å; P144-V199 HydrophobicContact CG-CG2 3.71Å; P144-F202 HydrophobicContact CB-CD2 3.89Å; P144-F202 HydrophobicContact CB-CE2 4.12Å; P144-F202 HydrophobicContact CG-CD2 4.23Å
145V79.3Confident83.5Confident82 Ų8281.3 Ų81.350%0.49743%0.432SS..Hα-helixtrans-63.7-49.1-179.8179.40000110.2E143 S147 C148 E149E143-V145 VanDerWaalsContact CD-N 3.27Å; E143-V145 PolarHBondContact O-N 3.37Å; E143-V145 WeakPolarHBondContact OE1-CG2 3.21Å; E143-V145 PolarHBondContact OE1-N 3.27Å; E143-V145 WeakPolarHBondContact OE2-CA 3.36Å; E143-V145 VanDerWaalsContact OE2-CB 3.28Å; E143-V145 WeakPolarHBondContact OE2-CB 3.4Å; E143-V145 PolarHBondContact OE2-N 2.65Å; V145-S147 PolarHBondContact O-N 3.39Å; V145-C148 WeakPolarHBondContact O-CB 3.29Å; V145-C148 PolarHBondContact O-N 3.15Å; V145-C148 VanDerWaalsContact O-N 3.13Å; V145-E149 PolarHBondContact O-N 2.77Å
146T85.3Confident84.4Confident85 Ų8585 Ų8552%0.52144%0.442SS..Hα-helixtrans-60.3-36.7177-47.10000111.7E143 A150E143-T146 PolarHBondContact O-N 3.44Å; E143-T146 PolarHBondContact OE2-N 3.06Å; E143-T146 PolarHBondContact OE2-OG1 3.39Å; T146-A150 WeakPolarHBondContact O-CB 3.39Å; T146-A150 PolarHBondContact O-N 3.24Å; T146-A150 VanDerWaalsContact O-N 3.12Å
147S86.8Confident85.1Confident5 Ų587.3 Ų87.34%0.03546%0.457CS..Hα-helixtrans-67.1-40.4177.2-55.70000112.2P142 E143 P144 V145 Y151 F158P142-S147 WeakPolarHBondContact CB-OG 3.45Å; E143-S147 WeakPolarHBondContact O-CB 3.35Å; E143-S147 PolarHBondContact O-N 2.76Å; E143-S147 PolarHBondContact O-OG 2.94Å; P144-S147 WeakPolarHBondContact O-CB 3.48Å; P144-S147 PolarHBondContact O-N 2.85Å; V145-S147 PolarHBondContact O-N 3.39Å; S147-Y151 VanDerWaalsContact O-CB 3.29Å; S147-Y151 WeakPolarHBondContact O-CB 3.44Å; S147-Y151 PolarHBondContact O-N 3.05Å; S147-F158 WeakPolarHBondContact O-CE2 3.45Å
148C92.3Very high85.9Confident13 Ų1384.8 Ų84.89%0.08844%0.437CS..Hα-helixtrans-67.8-44.4179.2-69.30000111.8P144 V145 Y151 E152 C193P144-C148 WeakPolarHBondContact O-CB 3.09Å; P144-C148 PolarHBondContact O-N 3.25Å; P144-C148 PolarHBondContact O-SG 3.34Å; V145-C148 WeakPolarHBondContact O-CB 3.29Å; V145-C148 PolarHBondContact O-N 3.15Å; V145-C148 VanDerWaalsContact O-N 3.13Å; C148-Y151 PolarHBondContact O-N 3.34Å; C148-E152 WeakPolarHBondContact O-CG 3.36Å; C148-E152 PolarHBondContact O-N 3.2Å; C148-C193 WeakPolarHBondContact CA-SG 3.42Å; C148-C193 HydrophobicContact CB-CB 3.68Å; C148-C193 WeakPolarHBondContact CB-SG 3.48Å; C148-C193 WeakPolarHBondContact SG-CA 3.27Å; C148-C193 WeakPolarHBondContact SG-CB 3.44Å; C148-C193 CovalentContact SG-SG 2.02Å; C148-C193 PolarHBondContact SG-SG 3.27Å
149E91.8Very high86.9Confident121 Ų12179.2 Ų79.257%0.56540%0.403SS*.Hα-helixtrans-60-49.1175.7-69.8175.517500111.4V145 Y151 E152 E153V145-E149 PolarHBondContact O-N 2.77Å; E149-Y151 VanDerWaalsContact C-N 3.29Å; E149-Y151 PolarHBondContact O-N 2.64Å; E149-E152 PolarHBondContact O-N 2.88Å; E149-E153 WeakPolarHBondContact O-CB 3.14Å; E149-E153 PolarHBondContact O-N 3.21Å
150A91.9Very high87.9Confident38 Ų3876.7 Ų76.731%0.31439%0.392SS..Hα-helixtrans-63.3-35.2179.100000112.8T146 D154 F158T146-A150 WeakPolarHBondContact O-CB 3.39Å; T146-A150 PolarHBondContact O-N 3.24Å; T146-A150 VanDerWaalsContact O-N 3.12Å; A150-D154 PolarHBondContact O-N 2.95Å; A150-D154 VanDerWaalsContact O-N 3.13Å; A150-F158 HydrophobicContact CB-CD2 3.82Å; A150-F158 HydrophobicContact CB-CE2 4.23Å
151Y94.5Very high89.3Confident28 Ų2875.6 Ų75.611%0.1138%0.381CS..Hα-helixtrans-70.1-38.4175.5177.9-88.2000112.5S147 C148 E149 R155 F158 M159 D186 I189 P190S147-Y151 VanDerWaalsContact O-CB 3.29Å; S147-Y151 WeakPolarHBondContact O-CB 3.44Å; S147-Y151 PolarHBondContact O-N 3.05Å; C148-Y151 PolarHBondContact O-N 3.34Å; E149-Y151 VanDerWaalsContact C-N 3.29Å; E149-Y151 PolarHBondContact O-N 2.64Å; Y151-R155 HydrophobicContact CD2-CB 4.49Å; Y151-R155 HydrophobicContact CD2-CG 4.26Å; Y151-R155 HydrophobicContact CE2-CB 4.28Å; Y151-R155 HydrophobicContact CE2-CG 3.64Å; Y151-R155 WeakPolarHBondContact O-CA 3.44Å; Y151-R155 PolarHBondContact O-N 3.43Å; Y151-R155 VanDerWaalsContact O-N 3.16Å; Y151-R155 VanDerWaalsContact OH-CD 3.31Å; Y151-R155 WeakPolarHBondContact OH-CD 3.48Å; Y151-R155 PolarHBondContact OH-NE 3.46Å; Y151-F158 AromaticContact CD2-CD1 3.71Å; Y151-F158 HydrophobicContact CD2-CD1 3.71Å; Y151-F158 HydrophobicContact CD2-CE1 4.12Å; Y151-F158 HydrophobicContact CD2-CG 4.27Å; Y151-F158 HydrophobicContact CG-CD1 4.48Å; Y151-M159 HydrophobicContact CE2-CG 4.37Å; Y151-M159 HydrophobicContact CE2-SD 4.27Å; Y151-D186 WeakPolarHBondContact CE2-OD1 3.32Å; Y151-D186 PolarHBondContact OH-OD1 3.07Å; Y151-I189 HydrophobicContact CD1-CG2 3.63Å; Y151-I189 HydrophobicContact CD2-CB 4.3Å; Y151-I189 HydrophobicContact CD2-CD1 3.52Å; Y151-I189 HydrophobicContact CD2-CG1 4.5Å; Y151-I189 HydrophobicContact CD2-CG2 3.81Å; Y151-I189 HydrophobicContact CE1-CG2 4Å; Y151-I189 HydrophobicContact CE2-CB 4.23Å; Y151-I189 HydrophobicContact CE2-CD1 3.67Å; Y151-I189 HydrophobicContact CE2-CG2 4.14Å; Y151-I189 HydrophobicContact CG-CB 4.47Å; Y151-I189 HydrophobicContact CG-CD1 4.31Å; Y151-I189 HydrophobicContact CG-CG2 3.53Å; Y151-P190 HydrophobicContact CE1-CG 4.12Å
152E94.8Very high90.5Very high150 Ų15071.2 Ų71.270%0.70135%0.353SS*.Hα-helixtrans-70.4-34.7176.1-74.1-173.9172.800112.3C148 E149C148-E152 WeakPolarHBondContact O-CG 3.36Å; C148-E152 PolarHBondContact O-N 3.2Å; E149-E152 PolarHBondContact O-N 2.88Å
153E95.9Very high91.8Very high174 Ų17468.6 Ų68.681%0.81334%0.335SS*.Hα-helixtrans-67.7-51.8176.9-175.4178.9-17400112E149E149-E153 WeakPolarHBondContact O-CB 3.14Å; E149-E153 PolarHBondContact O-N 3.21Å
154D95.7Very high92.5Very high69 Ų6964.4 Ų64.437%0.36932%0.316SS..  trans-150.889.8179.5-173.8-13.3000111.2A150 E156 T157 F158A150-D154 PolarHBondContact O-N 2.95Å; A150-D154 VanDerWaalsContact O-N 3.13Å; D154-E156 VanDerWaalsContact C-N 3.28Å; D154-E156 PolarHBondContact O-N 3.18Å; D154-E156 PolarHBondContact OD1-N 3Å; D154-E156 VanDerWaalsContact OD1-N 3.09Å; D154-T157 VanDerWaalsContact CG-CB 3.41Å; D154-T157 VanDerWaalsContact CG-OG1 3.28Å; D154-T157 PolarHBondContact OD1-N 3.19Å; D154-T157 WeakPolarHBondContact OD2-CB 3.34Å; D154-T157 PolarHBondContact OD2-OG1 3.05Å; D154-F158 WeakPolarHBondContact O-CB 3.24Å; D154-F158 PolarHBondContact O-N 3.33Å
155R94.8Very high93.1Very high134 Ų13465.1 Ų65.151%0.50632%0.318SS..Hα-helixtrans-55.5-41.1176.9172.2175.4173.9-97.40.6112.6Y151 M159 D186Y151-R155 HydrophobicContact CD2-CB 4.49Å; Y151-R155 HydrophobicContact CD2-CG 4.26Å; Y151-R155 HydrophobicContact CE2-CB 4.28Å; Y151-R155 HydrophobicContact CE2-CG 3.64Å; Y151-R155 WeakPolarHBondContact O-CA 3.44Å; Y151-R155 PolarHBondContact O-N 3.43Å; Y151-R155 VanDerWaalsContact O-N 3.16Å; Y151-R155 VanDerWaalsContact OH-CD 3.31Å; Y151-R155 WeakPolarHBondContact OH-CD 3.48Å; Y151-R155 PolarHBondContact OH-NE 3.46Å; R155-M159 HydrophobicContact CG-CG 4.38Å; R155-M159 WeakPolarHBondContact O-CB 3.23Å; R155-M159 VanDerWaalsContact O-CG 3.29Å; R155-M159 WeakPolarHBondContact O-CG 3.44Å; R155-M159 PolarHBondContact O-N 2.89Å; R155-D186 IonicContact CZ-OD1 3.06Å; R155-D186 IonicContact CZ-OD2 3.77Å; R155-D186 IonicContact NE-OD1 2.61Å; R155-D186 PolarHBondContact NE-OD1 3.39Å; R155-D186 IonicContact NE-OD2 3.28Å; R155-D186 VanDerWaalsContact NH2-CG 3.3Å; R155-D186 IonicContact NH2-OD1 2.74Å; R155-D186 PolarHBondContact NH2-OD1 3.25Å; R155-D186 IonicContact NH2-OD2 3.47Å; R155-D186 PolarHBondContact NH2-OD2 3.26Å
156E93.8Very high93.8Very high138 Ų13861.8 Ų61.865%0.64530%0.297SS*.Hα-helixtrans-68.9-51.3-173.9-173.1179.2168.200110.4D154 F158 M159 N160D154-E156 VanDerWaalsContact C-N 3.28Å; D154-E156 PolarHBondContact O-N 3.18Å; D154-E156 PolarHBondContact OD1-N 3Å; D154-E156 VanDerWaalsContact OD1-N 3.09Å; E156-F158 VanDerWaalsContact C-N 3.31Å; E156-F158 PolarHBondContact O-N 3.36Å; E156-M159 PolarHBondContact O-N 2.65Å; E156-N160 WeakPolarHBondContact O-CB 3.17Å; E156-N160 PolarHBondContact O-N 2.85Å
157T94.6Very high94.4Very high64 Ų6457.7 Ų57.739%0.39327%0.272SS..Hα-helixtrans-61.9-39.9175.9-65.60000111.5Y60 D154 R161Y60-T157 HydrophobicContact CE1-CG2 4.31Å; Y60-T157 PolarHBondContact OH-O 3.37Å; D154-T157 VanDerWaalsContact CG-CB 3.41Å; D154-T157 VanDerWaalsContact CG-OG1 3.28Å; D154-T157 PolarHBondContact OD1-N 3.19Å; D154-T157 WeakPolarHBondContact OD2-CB 3.34Å; D154-T157 PolarHBondContact OD2-OG1 3.05Å; T157-R161 WeakPolarHBondContact O-CB 3.48Å; T157-R161 PolarHBondContact O-N 3.01Å
158F94.5Very high94.8Very high34 Ų3459 Ų5915%0.14928%0.276CS..Hα-helixtrans-60.2-48.3177.1-179-84.7000111.6S147 A150 Y151 D154 E156 R161 F162 Y185 I189S147-F158 WeakPolarHBondContact O-CE2 3.45Å; A150-F158 HydrophobicContact CB-CD2 3.82Å; A150-F158 HydrophobicContact CB-CE2 4.23Å; Y151-F158 AromaticContact CD2-CD1 3.71Å; Y151-F158 HydrophobicContact CD2-CD1 3.71Å; Y151-F158 HydrophobicContact CD2-CE1 4.12Å; Y151-F158 HydrophobicContact CD2-CG 4.27Å; Y151-F158 HydrophobicContact CG-CD1 4.48Å; D154-F158 WeakPolarHBondContact O-CB 3.24Å; D154-F158 PolarHBondContact O-N 3.33Å; E156-F158 VanDerWaalsContact C-N 3.31Å; E156-F158 PolarHBondContact O-N 3.36Å; F158-R161 PolarHBondContact O-N 3.31Å; F158-F162 PolarHBondContact O-N 3.15Å; F158-Y185 HydrophobicContact CE1-CE1 4.03Å; F158-Y185 HydrophobicContact CZ-CE1 4.39Å; F158-I189 HydrophobicContact CD1-CD1 4.23Å; F158-I189 HydrophobicContact CE1-CD1 3.55Å; F158-I189 HydrophobicContact CZ-CD1 4.35Å
159M95.3Very high94.9Very high17 Ų1760.4 Ų60.48%0.08428%0.28CS..Hα-helixtrans-71.2-36.9-178.9-69.4-52.2-5100112.5Y151 R155 E156 R161 F162 I163 A182 Y185 D186 I189Y151-M159 HydrophobicContact CE2-CG 4.37Å; Y151-M159 HydrophobicContact CE2-SD 4.27Å; R155-M159 HydrophobicContact CG-CG 4.38Å; R155-M159 WeakPolarHBondContact O-CB 3.23Å; R155-M159 VanDerWaalsContact O-CG 3.29Å; R155-M159 WeakPolarHBondContact O-CG 3.44Å; R155-M159 PolarHBondContact O-N 2.89Å; E156-M159 PolarHBondContact O-N 2.65Å; M159-R161 VanDerWaalsContact C-N 3.3Å; M159-R161 PolarHBondContact O-N 3.12Å; M159-F162 HydrophobicContact CE-CB 4.44Å; M159-F162 HydrophobicContact CE-CD1 4.19Å; M159-F162 HydrophobicContact CE-CG 4.44Å; M159-F162 WeakPolarHBondContact O-CB 3.38Å; M159-F162 PolarHBondContact O-N 3.13Å; M159-I163 WeakPolarHBondContact O-CG1 3.35Å; M159-I163 PolarHBondContact O-N 3.44Å; M159-A182 HydrophobicContact CE-CB 3.97Å; M159-A182 WeakPolarHBondContact CE-O 3.39Å; M159-Y185 HydrophobicContact CE-CD1 4.31Å; M159-Y185 HydrophobicContact SD-CD1 4.38Å; M159-D186 HydrophobicContact CE-CB 3.83Å; M159-D186 HydrophobicContact CG-CB 4.41Å; M159-D186 HydrophobicContact SD-CB 3.93Å; M159-I189 HydrophobicContact SD-CD1 3.93Å
160N96.6Very high95Very high16 Ų1656.5 Ų56.59%0.08626%0.261CS..Hα-helixtrans-64-37.3173.4-169.4-92.2000111.4D45 T48 Y60 E156 F162 I163 Y164D45-N160 PolarHBondContact OD1-ND2 2.97Å; T48-N160 PolarHBondContact OG1-ND2 3.29Å; T48-N160 PolarHBondContact OG1-OD1 2.91Å; Y60-N160 PolarHBondContact OH-OD1 2.66Å; E156-N160 WeakPolarHBondContact O-CB 3.17Å; E156-N160 PolarHBondContact O-N 2.85Å; N160-F162 PolarHBondContact O-N 3.29Å; N160-I163 WeakPolarHBondContact O-CB 3.24Å; N160-I163 PolarHBondContact O-N 3.37Å; N160-Y164 PolarHBondContact O-N 3.47Å
161R94.9Very high95.2Very high140 Ų14054.8 Ų54.853%0.52825%0.247SC..Hα-helixtrans-65.5-37.4173.3-168.7169.3-179-176.7-1112.5Y60 T157 F158 M159 Y164 E165Y60-R161 HydrophobicContact CD2-CB 4.36Å; Y60-R161 HydrophobicContact CD2-CG 4.18Å; Y60-R161 HydrophobicContact CE1-CB 4.44Å; Y60-R161 HydrophobicContact CE2-CB 3.95Å; Y60-R161 HydrophobicContact CE2-CG 4.27Å; Y60-R161 HydrophobicContact CG-CG 4.3Å; T157-R161 WeakPolarHBondContact O-CB 3.48Å; T157-R161 PolarHBondContact O-N 3.01Å; F158-R161 PolarHBondContact O-N 3.31Å; M159-R161 VanDerWaalsContact C-N 3.3Å; M159-R161 PolarHBondContact O-N 3.12Å; R161-Y164 WeakPolarHBondContact O-CB 3.48Å; R161-Y164 PolarHBondContact O-N 3.41Å; R161-E165 WeakPolarHBondContact O-CG 3.47Å; R161-E165 PolarHBondContact O-N 3.02Å
162F93.6Very high95.3Very high24 Ų2455.2 Ų55.211%0.10525%0.249CC..Hα-helixtrans-59.5-47170.8175.6-90.8000111.3F158 M159 N160 Y164 E165 I166 A182 Y185F158-F162 PolarHBondContact O-N 3.15Å; M159-F162 HydrophobicContact CE-CB 4.44Å; M159-F162 HydrophobicContact CE-CD1 4.19Å; M159-F162 HydrophobicContact CE-CG 4.44Å; M159-F162 WeakPolarHBondContact O-CB 3.38Å; M159-F162 PolarHBondContact O-N 3.13Å; N160-F162 PolarHBondContact O-N 3.29Å; F162-Y164 PolarHBondContact O-N 3.47Å; F162-E165 PolarHBondContact O-N 3.42Å; F162-I166 HydrophobicContact CD1-CG1 4.36Å; F162-I166 HydrophobicContact CE1-CG1 3.94Å; F162-I166 HydrophobicContact CE2-CG1 4.36Å; F162-I166 HydrophobicContact CZ-CD1 4.32Å; F162-I166 HydrophobicContact CZ-CG1 3.95Å; F162-I166 WeakPolarHBondContact O-CG1 3.38Å; F162-I166 PolarHBondContact O-N 2.82Å; F162-I166 VanDerWaalsContact O-N 3.09Å; F162-A182 HydrophobicContact CD1-CB 4Å; F162-A182 HydrophobicContact CE1-CB 4.14Å; F162-Y185 AromaticContact CD2-CD1 3.67Å; F162-Y185 HydrophobicContact CD2-CD1 3.67Å; F162-Y185 AromaticContact CD2-CE1 3.86Å; F162-Y185 HydrophobicContact CD2-CE1 3.86Å; F162-Y185 HydrophobicContact CD2-CG 4.24Å; F162-Y185 AromaticContact CE2-CD1 3.7Å; F162-Y185 HydrophobicContact CE2-CD1 3.7Å; F162-Y185 HydrophobicContact CE2-CD2 4.2Å; F162-Y185 HydrophobicContact CE2-CE1 4.05Å; F162-Y185 AromaticContact CE2-CG 3.79Å; F162-Y185 HydrophobicContact CE2-CG 3.79Å; F162-Y185 HydrophobicContact CG-CD1 4.13Å; F162-Y185 HydrophobicContact CZ-CD1 4.21Å; F162-Y185 HydrophobicContact CZ-CD2 4.5Å; F162-Y185 AromaticContact CZ-CG 3.97Å; F162-Y185 HydrophobicContact CZ-CG 3.97Å
163I97Very high95.4Very high2 Ų248.1 Ų48.11%0.0122%0.216CC..Hα-helixtrans-57.6-47.7176.1-71.5169.9000110.9D45 T48 I49 M159 N160 E165 I166 A167 I178 L179 A182D45-I163 HydrophobicContact CB-CD1 3.91Å; D45-I163 WeakPolarHBondContact OD2-CD1 3.17Å; T48-I163 HydrophobicContact CG2-CG2 4.13Å; I49-I163 HydrophobicContact CD1-CG2 4.03Å; I49-I163 HydrophobicContact CG1-CG2 3.41Å; I49-I163 VanDerWaalsContact CG1-CG2 3.41Å; M159-I163 WeakPolarHBondContact O-CG1 3.35Å; M159-I163 PolarHBondContact O-N 3.44Å; N160-I163 WeakPolarHBondContact O-CB 3.24Å; N160-I163 PolarHBondContact O-N 3.37Å; I163-E165 PolarHBondContact O-N 3.32Å; I163-I166 PolarHBondContact O-N 3.38Å; I163-A167 VanDerWaalsContact O-CB 3.23Å; I163-A167 WeakPolarHBondContact O-CB 3.35Å; I163-A167 PolarHBondContact O-N 3.17Å; I163-I178 HydrophobicContact CB-CG2 4.4Å; I163-I178 HydrophobicContact CG1-CG2 4.3Å; I163-I178 HydrophobicContact CG2-CG2 3.93Å; I163-L179 HydrophobicContact CD1-CD2 4.27Å; I163-A182 HydrophobicContact CD1-CB 3.99Å; I163-A182 HydrophobicContact CG1-CB 3.69Å
164Y97.2Very high95.5Very high3 Ų340.6 Ų40.61%0.01218%0.181CC..Hα-helixtrans-55.6-49176160.4-99.9000112.6A52 A58 T59 Y60 V63 N160 R161 F162 I166 A167 R168A52-Y164 HydrophobicContact CB-CD2 3.83Å; A52-Y164 HydrophobicContact CB-CE2 4.43Å; A58-Y164 PolarHBondContact O-OH 2.9Å; T59-Y164 WeakPolarHBondContact CA-OH 3.22Å; Y60-Y164 AromaticContact CD2-CD1 3.73Å; Y60-Y164 HydrophobicContact CD2-CD1 3.73Å; Y60-Y164 HydrophobicContact CD2-CD2 4.17Å; Y60-Y164 HydrophobicContact CD2-CE1 4.33Å; Y60-Y164 AromaticContact CD2-CG 3.63Å; Y60-Y164 HydrophobicContact CD2-CG 3.63Å; Y60-Y164 HydrophobicContact CE2-CG 4.42Å; Y60-Y164 HydrophobicContact CG-CD1 4.3Å; Y60-Y164 VanDerWaalsContact N-CZ 3.34Å; Y60-Y164 PolarHBondContact N-OH 3.11Å; V63-Y164 HydrophobicContact CB-CD2 4.16Å; V63-Y164 HydrophobicContact CB-CE2 4.23Å; V63-Y164 HydrophobicContact CG1-CD2 4.25Å; V63-Y164 HydrophobicContact CG2-CD2 3.99Å; V63-Y164 HydrophobicContact CG2-CE2 3.73Å; N160-Y164 PolarHBondContact O-N 3.47Å; R161-Y164 WeakPolarHBondContact O-CB 3.48Å; R161-Y164 PolarHBondContact O-N 3.41Å; F162-Y164 PolarHBondContact O-N 3.47Å; Y164-I166 VanDerWaalsContact C-N 3.34Å; Y164-I166 PolarHBondContact O-N 2.81Å; Y164-A167 PolarHBondContact O-N 2.81Å; Y164-R168 WeakPolarHBondContact O-CG 3.37Å; Y164-R168 PolarHBondContact O-N 2.94Å; Y164-R168 PolarHBondContact OH-NH1 3.49Å
165E94.6Very high95.5Very high31 Ų3137.4 Ų37.415%0.14516%0.164CC..Hα-helixtrans-66.9-34.2-177.6-68-64.9164.400112.3F139 R161 F162 I163 R169F139-E165 HydrophobicContact CD2-CB 4.02Å; F139-E165 HydrophobicContact CE2-CB 3.78Å; F139-E165 HydrophobicContact CE2-CG 4.12Å; R161-E165 WeakPolarHBondContact O-CG 3.47Å; R161-E165 PolarHBondContact O-N 3.02Å; F162-E165 PolarHBondContact O-N 3.42Å; I163-E165 PolarHBondContact O-N 3.32Å; E165-R169 PolarHBondContact O-NH1 3.13Å; E165-R169 IonicContact OE2-CZ 3.96Å; E165-R169 VanDerWaalsContact OE2-CZ 3.28Å; E165-R169 IonicContact OE2-NH1 3.49Å; E165-R169 PolarHBondContact OE2-NH1 3.24Å; E165-R169 IonicContact OE2-NH2 2.68Å; E165-R169 PolarHBondContact OE2-NH2 2.95Å
166I94.6Very high95.5Very high11 Ų1132.6 Ų32.66%0.05615%0.15CC..Hα-helixtrans-70.2-51173.2-64.9-55.8000110.7F162 I163 Y164 R168 R169 H170 L173 I178 L213F162-I166 HydrophobicContact CD1-CG1 4.36Å; F162-I166 HydrophobicContact CE1-CG1 3.94Å; F162-I166 HydrophobicContact CE2-CG1 4.36Å; F162-I166 HydrophobicContact CZ-CD1 4.32Å; F162-I166 HydrophobicContact CZ-CG1 3.95Å; F162-I166 WeakPolarHBondContact O-CG1 3.38Å; F162-I166 PolarHBondContact O-N 2.82Å; F162-I166 VanDerWaalsContact O-N 3.09Å; I163-I166 PolarHBondContact O-N 3.38Å; Y164-I166 VanDerWaalsContact C-N 3.34Å; Y164-I166 PolarHBondContact O-N 2.81Å; I166-R168 PolarHBondContact O-N 2.89Å; I166-R169 PolarHBondContact O-N 2.54Å; I166-H170 PolarHBondContact O-CD2 3.5Å; I166-H170 VanDerWaalsContact O-CD2 3.29Å; I166-H170 PolarHBondContact O-N 3.33Å; I166-H170 VanDerWaalsContact O-N 3.07Å; I166-L173 HydrophobicContact CG2-CD2 3.88Å; I166-I178 HydrophobicContact CG2-CG1 4.15Å; I166-I178 HydrophobicContact CG2-CG2 4.31Å; I166-L213 HydrophobicContact CD1-CD1 4.42Å; I166-L213 HydrophobicContact CD1-CD2 3.61Å; I166-L213 HydrophobicContact CG2-CD1 3.79Å
167A96.8Very high95.5Very high0 Ų026.6 Ų26.60%012%0.123CC..Hα-helixtrans-57.2-48.3-175.700000112.2I49 A52 Q53 I163 Y164 R169 H170 I178I49-A167 HydrophobicContact CG2-CB 4.42Å; A52-A167 HydrophobicContact CB-CB 3.74Å; Q53-A167 HydrophobicContact CG-CB 4.04Å; Q53-A167 WeakPolarHBondContact CG-O 3.49Å; I163-A167 VanDerWaalsContact O-CB 3.23Å; I163-A167 WeakPolarHBondContact O-CB 3.35Å; I163-A167 PolarHBondContact O-N 3.17Å; Y164-A167 PolarHBondContact O-N 2.81Å; A167-R169 VanDerWaalsContact C-N 3.29Å; A167-R169 PolarHBondContact O-N 3.27Å; A167-H170 CarbonylContact O-C 3.57Å; A167-H170 VanDerWaalsContact O-C 3.24Å; A167-H170 PolarHBondContact O-N 2.88Å; A167-H170 VanDerWaalsContact O-N 3.17Å; A167-I178 HydrophobicContact CB-CD1 4.13Å
168R95.6Very high95.6Very high31 Ų3123.6 Ų23.612%0.11710%0.104CC..Hα-helixtrans-65.7-28.2-178.572.5-174.3-60.3-159.86.3114.4A52 Q56 E57 A58 I136 Y164 I166A52-R168 HydrophobicContact CB-CB 4.29Å; A52-R168 VanDerWaalsContact O-CA 3.32Å; A52-R168 WeakPolarHBondContact O-CA 3.3Å; A52-R168 WeakPolarHBondContact O-CB 3.36Å; Q56-R168 HydrophobicContact CB-CB 4.44Å; Q56-R168 PolarHBondContact NE2-O 3.22Å; Q56-R168 VanDerWaalsContact O-CZ 3.23Å; Q56-R168 PolarHBondContact O-NE 2.04Å; Q56-R168 PolarHBondContact O-NH2 3.06Å; E57-R168 PolarHBondContact O-NH2 2.97Å; A58-R168 PolarHBondContact O-NH2 3.09Å; I136-R168 HydrophobicContact CD1-CB 4.14Å; I136-R168 HydrophobicContact CD1-CG 4.07Å; I136-R168 VanDerWaalsContact CD1-O 3.26Å; I136-R168 WeakPolarHBondContact CD1-O 3.48Å; Y164-R168 WeakPolarHBondContact O-CG 3.37Å; Y164-R168 PolarHBondContact O-N 2.94Å; Y164-R168 PolarHBondContact OH-NH1 3.49Å; I166-R168 PolarHBondContact O-N 2.89Å
169R94.3Very high95.7Very high44 Ų4423.1 Ų23.117%0.16610%0.103CC..Hα-helixtrans-83.9-21.3177.4-75179.9-175.673.1-0.2112.9I136 P137 E165 I166 A167I136-R169 HydrophobicContact CG2-CG 3.77Å; P137-R169 PolarHBondContact O-NE 2.95Å; P137-R169 VanDerWaalsContact O-NE 3.12Å; P137-R169 PolarHBondContact O-NH2 3.25Å; P137-R169 VanDerWaalsContact O-NH2 3.14Å; E165-R169 PolarHBondContact O-NH1 3.13Å; E165-R169 IonicContact OE2-CZ 3.96Å; E165-R169 VanDerWaalsContact OE2-CZ 3.28Å; E165-R169 IonicContact OE2-NH1 3.49Å; E165-R169 PolarHBondContact OE2-NH1 3.24Å; E165-R169 IonicContact OE2-NH2 2.68Å; E165-R169 PolarHBondContact OE2-NH2 2.95Å; I166-R169 PolarHBondContact O-N 2.54Å; A167-R169 VanDerWaalsContact C-N 3.29Å; A167-R169 PolarHBondContact O-N 3.27Å
170H94.9Very high95.7Very high38 Ų3822.4 Ų22.418%0.17610%0.1CC..  trans-130.370.7-175.6-58.1-83.3000110.5Q53 I166 A167 F172 L173 S217Q53-H170 PolarHBondContact NE2-O 3.09Å; I166-H170 PolarHBondContact O-CD2 3.5Å; I166-H170 VanDerWaalsContact O-CD2 3.29Å; I166-H170 PolarHBondContact O-N 3.33Å; I166-H170 VanDerWaalsContact O-N 3.07Å; A167-H170 CarbonylContact O-C 3.57Å; A167-H170 VanDerWaalsContact O-C 3.24Å; A167-H170 PolarHBondContact O-N 2.88Å; A167-H170 VanDerWaalsContact O-N 3.17Å; H170-F172 PolarHBondContact O-N 3.32Å; H170-L173 HydrophobicContact CB-CB 3.66Å; H170-L173 HydrophobicContact CB-CD2 4.07Å; H170-L173 WeakPolarHBondContact O-CB 3.28Å; H170-L173 PolarHBondContact O-N 3.4Å; H170-S217 VanDerWaalsContact ND1-CB 3.35Å; H170-S217 WeakPolarHBondContact ND1-CB 3.08Å; H170-S217 PolarHBondContact ND1-OG 2.65Å
171P95.4Very high95.6Very high2 Ų221.7 Ų21.71%0.01310%0.096CC..THydrogen-bonded Turntrans-68.3-7.9-16928.6-37.8000115.6Q53 Q56 K129 K130Q53-P171 HydrophobicContact CB-CB 4.39Å; Q53-P171 PolarHBondContact OE1-O 2.92Å; Q56-P171 HydrophobicContact CG-CB 4.27Å; K129-P171 HydrophobicContact CB-CB 4.29Å; K129-P171 HydrophobicContact CD-CB 4.24Å; K129-P171 HydrophobicContact CG-CB 4.42Å; K129-P171 PolarHBondContact NZ-O 3.29Å; K130-P171 WeakPolarHBondContact O-CG 3.35Å
172F96.3Very high95.6Very high37 Ų3715.4 Ų15.416%0.1627%0.074CC..THydrogen-bonded Turntrans-117.15.8175.9-61.4-79.2000112.8K129 P131 H170 Y174 N220 Q221 C224K129-F172 HydrophobicContact CB-CE2 4.19Å; K129-F172 HydrophobicContact CB-CZ 3.82Å; K129-F172 HydrophobicContact CD-CE1 4.3Å; K129-F172 HydrophobicContact CD-CZ 4.39Å; P131-F172 HydrophobicContact CG-CE2 4.17Å; H170-F172 PolarHBondContact O-N 3.32Å; F172-Y174 WeakPolarHBondContact O-CD1 3.39Å; F172-N220 WeakPolarHBondContact O-CB 3.49Å; F172-Q221 HydrophobicContact CB-CB 4.24Å; F172-Q221 HydrophobicContact CB-CG 4.38Å; F172-Q221 HydrophobicContact CD2-CG 4.19Å; F172-C224 HydrophobicContact CD1-CB 4.33Å
173L97.1Very high95.6Very high2 Ų216.1 Ų16.11%0.018%0.084CC..SBendtrans-72.2137.4172.4-177.863.9000109Q53 I166 H170 T177 I178 L181 L213Q53-L173 PolarHBondContact NE2-O 3.31Å; I166-L173 HydrophobicContact CG2-CD2 3.88Å; H170-L173 HydrophobicContact CB-CB 3.66Å; H170-L173 HydrophobicContact CB-CD2 4.07Å; H170-L173 WeakPolarHBondContact O-CB 3.28Å; H170-L173 PolarHBondContact O-N 3.4Å; L173-T177 HydrophobicContact CD1-CG2 3.83Å; L173-T177 HydrophobicContact CG-CG2 4.49Å; L173-I178 HydrophobicContact CB-CD1 4.35Å; L173-I178 HydrophobicContact CB-CG1 4.35Å; L173-I178 HydrophobicContact CD2-CD1 4.34Å; L173-I178 HydrophobicContact CD2-CG1 3.6Å; L173-I178 HydrophobicContact CG-CD1 4.33Å; L173-I178 HydrophobicContact CG-CG1 3.79Å; L173-L181 HydrophobicContact CD2-CD1 4.29Å; L173-L213 HydrophobicContact CD2-CD1 3.49Å; L173-L213 VanDerWaalsContact CD2-CD1 3.49Å
174Y97.5Very high95.4Very high16 Ų1619.3 Ų19.36%0.06310%0.096CC..  trans-76.8140.1-171.8-65.2-5.2000110.1F172 T177 I178 N220 H266 C269 C270F172-Y174 WeakPolarHBondContact O-CD1 3.39Å; Y174-T177 WeakPolarHBondContact O-CA 3.33Å; Y174-T177 WeakPolarHBondContact O-CB 3.34Å; Y174-T177 PolarHBondContact O-N 3.12Å; Y174-I178 PolarHBondContact O-N 2.88Å; Y174-I178 VanDerWaalsContact O-N 3.09Å; Y174-N220 VanDerWaalsContact CB-ND2 3.33Å; Y174-N220 WeakPolarHBondContact CB-ND2 3.37Å; Y174-N220 HydrophobicContact CD1-CB 3.83Å; Y174-N220 VanDerWaalsContact CD1-ND2 3.33Å; Y174-N220 WeakPolarHBondContact CD1-ND2 3.46Å; Y174-N220 VanDerWaalsContact CD2-ND2 3.34Å; Y174-N220 WeakPolarHBondContact CD2-ND2 3.45Å; Y174-N220 HydrophobicContact CE1-CB 3.69Å; Y174-N220 HydrophobicContact CE2-CB 4.44Å; Y174-N220 HydrophobicContact CG-CB 4.29Å; Y174-N220 PolarHBondContact N-ND2 3.2Å; Y174-N220 VanDerWaalsContact N-ND2 3.13Å; Y174-H266 AromaticContact CE2-CE1 3.66Å; Y174-H266 AromaticContact CE2-ND1 3.42Å; Y174-H266 WeakPolarHBondContact CE2-ND1 3.31Å; Y174-H266 AromaticContact CZ-ND1 3.53Å; Y174-H266 PolarHBondContact OH-ND1 2.8Å; Y174-C269 HydrophobicContact CD1-CB 3.46Å; Y174-C269 VanDerWaalsContact CD1-CB 3.46Å; Y174-C269 HydrophobicContact CD2-CB 3.81Å; Y174-C269 HydrophobicContact CE1-CB 3.42Å; Y174-C269 VanDerWaalsContact CE1-CB 3.42Å; Y174-C269 HydrophobicContact CE2-CB 3.78Å; Y174-C269 HydrophobicContact CG-CB 3.65Å; Y174-C270 PolarHBondContact OH-SG 2.89Å
175A95.8Very high95.3Very high2 Ų220.3 Ų20.32%0.01710%0.1CC..Hα-helixtrans-47.8-48.8177.700000113.6L46 I49 T177 I178 L179 V274L46-A175 HydrophobicContact CD2-CB 3.97Å; I49-A175 HydrophobicContact CD1-CB 4.17Å; I49-A175 HydrophobicContact CG2-CB 4.39Å; A175-T177 PolarHBondContact O-N 2.88Å; A175-I178 PolarHBondContact O-N 3.33Å; A175-I178 VanDerWaalsContact O-N 3.08Å; A175-L179 WeakPolarHBondContact O-CG 3.09Å; A175-L179 PolarHBondContact O-N 3.09Å; A175-V274 HydrophobicContact CB-CB 3.91Å; A175-V274 HydrophobicContact CB-CG1 4.19Å
176P94.3Very high95.2Very high33 Ų3319.9 Ų19.921%0.21410%0.099CC..Hα-helixtrans-56.1-36.2176.118.5-33.2000113.6L180 L278 L308P176-L180 WeakPolarHBondContact O-CB 3.35Å; P176-L180 PolarHBondContact O-N 2.97Å; P176-L278 HydrophobicContact CB-CD1 3.87Å; P176-L308 HydrophobicContact CB-CD2 4.25Å
177T95.6Very high95.2Very high12 Ų1225.1 Ų25.17%0.07412%0.121CC..Hα-helixtrans-70.8-41177-50.20000111.6L173 Y174 A175 L179 L180 L181L173-T177 HydrophobicContact CD1-CG2 3.83Å; L173-T177 HydrophobicContact CG-CG2 4.49Å; Y174-T177 WeakPolarHBondContact O-CA 3.33Å; Y174-T177 WeakPolarHBondContact O-CB 3.34Å; Y174-T177 PolarHBondContact O-N 3.12Å; A175-T177 PolarHBondContact O-N 2.88Å; T177-L179 VanDerWaalsContact C-N 3.34Å; T177-L179 PolarHBondContact O-N 2.88Å; T177-L180 PolarHBondContact O-N 3.03Å; T177-L181 HydrophobicContact CG2-CD1 4.13Å; T177-L181 HydrophobicContact CG2-CG 4.39Å; T177-L181 WeakPolarHBondContact O-CG 3.38Å; T177-L181 PolarHBondContact O-N 3.48Å
178I96.8Very high95.1Very high1 Ų126.2 Ų26.21%0.00513%0.126CC..Hα-helixtrans-61.1-46.2176.8-63.1171.2000110.2I49 I163 I166 A167 L173 Y174 A175 L180 L181 A182I49-I178 HydrophobicContact CD1-CB 4.01Å; I49-I178 HydrophobicContact CD1-CD1 4.4Å; I49-I178 HydrophobicContact CD1-CG2 3.93Å; I49-I178 HydrophobicContact CG1-CB 4.47Å; I49-I178 HydrophobicContact CG1-CD1 4.19Å; I49-I178 HydrophobicContact CG1-CG2 4.06Å; I49-I178 HydrophobicContact CG2-CD1 3.74Å; I163-I178 HydrophobicContact CB-CG2 4.4Å; I163-I178 HydrophobicContact CG1-CG2 4.3Å; I163-I178 HydrophobicContact CG2-CG2 3.93Å; I166-I178 HydrophobicContact CG2-CG1 4.15Å; I166-I178 HydrophobicContact CG2-CG2 4.31Å; A167-I178 HydrophobicContact CB-CD1 4.13Å; L173-I178 HydrophobicContact CB-CD1 4.35Å; L173-I178 HydrophobicContact CB-CG1 4.35Å; L173-I178 HydrophobicContact CD2-CD1 4.34Å; L173-I178 HydrophobicContact CD2-CG1 3.6Å; L173-I178 HydrophobicContact CG-CD1 4.33Å; L173-I178 HydrophobicContact CG-CG1 3.79Å; Y174-I178 PolarHBondContact O-N 2.88Å; Y174-I178 VanDerWaalsContact O-N 3.09Å; A175-I178 PolarHBondContact O-N 3.33Å; A175-I178 VanDerWaalsContact O-N 3.08Å; I178-L180 VanDerWaalsContact C-N 3.34Å; I178-L180 PolarHBondContact O-N 3.16Å; I178-L181 PolarHBondContact O-N 3.47Å; I178-A182 WeakPolarHBondContact O-CB 3Å; I178-A182 PolarHBondContact O-N 3.45Å
179L95.6Very high95Very high23 Ų2324.8 Ų24.812%0.1212%0.121CC..Hα-helixtrans-62.2-40.7177.4-64.4175.3000111.8D45 L46 I49 I163 A175 T177 A182 A183 L278 L308D45-L179 HydrophobicContact CB-CD2 3.93Å; L46-L179 HydrophobicContact CD2-CD1 4.04Å; I49-L179 HydrophobicContact CD1-CD2 4.09Å; I49-L179 HydrophobicContact CD1-CG 4.2Å; I163-L179 HydrophobicContact CD1-CD2 4.27Å; A175-L179 WeakPolarHBondContact O-CG 3.09Å; A175-L179 PolarHBondContact O-N 3.09Å; T177-L179 VanDerWaalsContact C-N 3.34Å; T177-L179 PolarHBondContact O-N 2.88Å; L179-A182 PolarHBondContact O-N 3.33Å; L179-A183 WeakPolarHBondContact O-CB 3.5Å; L179-A183 PolarHBondContact O-N 3.4Å; L179-L278 HydrophobicContact CD1-CD1 4.34Å; L179-L278 HydrophobicContact CD1-CD2 3.91Å; L179-L308 HydrophobicContact CB-CD1 3.79Å; L179-L308 HydrophobicContact CB-CD2 4.41Å
180L94.4Very high95Very high3 Ų325.2 Ų25.22%0.01613%0.13CC..Hα-helixtrans-61-45.7174.817562.8000111.9P176 T177 I178 A182 A183 R184 L308 E309 Q312P176-L180 WeakPolarHBondContact O-CB 3.35Å; P176-L180 PolarHBondContact O-N 2.97Å; T177-L180 PolarHBondContact O-N 3.03Å; I178-L180 VanDerWaalsContact C-N 3.34Å; I178-L180 PolarHBondContact O-N 3.16Å; L180-A182 VanDerWaalsContact C-N 3.35Å; L180-A183 PolarHBondContact O-N 2.91Å; L180-R184 HydrophobicContact CD1-CG 4.32Å; L180-R184 WeakPolarHBondContact O-CG 3.45Å; L180-R184 PolarHBondContact O-N 2.87Å; L180-L308 HydrophobicContact CB-CB 4.19Å; L180-L308 HydrophobicContact CD1-CB 4.04Å; L180-E309 HydrophobicContact CD1-CG 3.76Å; L180-Q312 HydrophobicContact CD2-CB 3.51Å; L180-Q312 HydrophobicContact CD2-CG 3.63Å
181L94.9Very high94.9Very high1 Ų125.9 Ų25.91%0.00514%0.138CC..Hα-helixtrans-64.4-41.9179.8-67.3169.1000110.9L173 T177 I178 R184 Y185 I209 E212 L213L173-L181 HydrophobicContact CD2-CD1 4.29Å; T177-L181 HydrophobicContact CG2-CD1 4.13Å; T177-L181 HydrophobicContact CG2-CG 4.39Å; T177-L181 WeakPolarHBondContact O-CG 3.38Å; T177-L181 PolarHBondContact O-N 3.48Å; I178-L181 PolarHBondContact O-N 3.47Å; L181-R184 PolarHBondContact O-N 3.48Å; L181-Y185 WeakPolarHBondContact O-CB 2.99Å; L181-Y185 PolarHBondContact O-N 3Å; L181-I209 HydrophobicContact CB-CG2 4.31Å; L181-I209 HydrophobicContact CD2-CG2 3.69Å; L181-E212 HydrophobicContact CD2-CB 3.96Å; L181-E212 HydrophobicContact CD2-CG 3.82Å; L181-L213 HydrophobicContact CD1-CB 3.86Å; L181-L213 HydrophobicContact CD1-CD1 3.75Å; L181-L213 HydrophobicContact CD1-CG 4.39Å; L181-L213 HydrophobicContact CD2-CB 4.44Å
182A94.9Very high94.9Very high7 Ų725.8 Ų25.86%0.05814%0.138CC..Hα-helixtrans-60.9-48.7174.300000111.3M159 F162 I163 I178 L179 L180 R184 Y185 D186M159-A182 HydrophobicContact CE-CB 3.97Å; M159-A182 WeakPolarHBondContact CE-O 3.39Å; F162-A182 HydrophobicContact CD1-CB 4Å; F162-A182 HydrophobicContact CE1-CB 4.14Å; I163-A182 HydrophobicContact CD1-CB 3.99Å; I163-A182 HydrophobicContact CG1-CB 3.69Å; I178-A182 WeakPolarHBondContact O-CB 3Å; I178-A182 PolarHBondContact O-N 3.45Å; L179-A182 PolarHBondContact O-N 3.33Å; L180-A182 VanDerWaalsContact C-N 3.35Å; A182-R184 VanDerWaalsContact C-N 3.31Å; A182-R184 PolarHBondContact O-N 3.2Å; A182-Y185 PolarHBondContact O-N 3.08Å; A182-Y185 VanDerWaalsContact O-N 3.12Å; A182-D186 WeakPolarHBondContact O-CB 3.36Å; A182-D186 PolarHBondContact O-N 3.06Å
183A94.1Very high94.8Very high39 Ų3925.6 Ų25.632%0.32214%0.141SC..Hα-helixtrans-61-37.8177.600000112.8L179 L180 K187L179-A183 WeakPolarHBondContact O-CB 3.5Å; L179-A183 PolarHBondContact O-N 3.4Å; L180-A183 PolarHBondContact O-N 2.91Å; A183-K187 VanDerWaalsContact O-CG 3.28Å; A183-K187 WeakPolarHBondContact O-CG 3.34Å; A183-K187 PolarHBondContact O-N 3.18Å
184R93.7Very high94.6Very high69 Ų6933.7 Ų33.726%0.2618%0.176SC..Hα-helixtrans-68.9-38.6174.6-74.8179175.6177.31.2112.1L180 L181 A182 I188 I209L180-R184 HydrophobicContact CD1-CG 4.32Å; L180-R184 WeakPolarHBondContact O-CG 3.45Å; L180-R184 PolarHBondContact O-N 2.87Å; L181-R184 PolarHBondContact O-N 3.48Å; A182-R184 VanDerWaalsContact C-N 3.31Å; A182-R184 PolarHBondContact O-N 3.2Å; R184-I188 PolarHBondContact O-N 3.26Å; R184-I209 HydrophobicContact CB-CD1 3.93Å; R184-I209 HydrophobicContact CB-CG1 4.1Å
185Y93.4Very high94.4Very high24 Ų2434.6 Ų34.69%0.09419%0.187CC..Hα-helixtrans-68.1-45.7178.8-167.9-110.9000111.3F158 M159 F162 L181 A182 K187 I188 I189 F202 I209F158-Y185 HydrophobicContact CE1-CE1 4.03Å; F158-Y185 HydrophobicContact CZ-CE1 4.39Å; M159-Y185 HydrophobicContact CE-CD1 4.31Å; M159-Y185 HydrophobicContact SD-CD1 4.38Å; F162-Y185 AromaticContact CD2-CD1 3.67Å; F162-Y185 HydrophobicContact CD2-CD1 3.67Å; F162-Y185 AromaticContact CD2-CE1 3.86Å; F162-Y185 HydrophobicContact CD2-CE1 3.86Å; F162-Y185 HydrophobicContact CD2-CG 4.24Å; F162-Y185 AromaticContact CE2-CD1 3.7Å; F162-Y185 HydrophobicContact CE2-CD1 3.7Å; F162-Y185 HydrophobicContact CE2-CD2 4.2Å; F162-Y185 HydrophobicContact CE2-CE1 4.05Å; F162-Y185 AromaticContact CE2-CG 3.79Å; F162-Y185 HydrophobicContact CE2-CG 3.79Å; F162-Y185 HydrophobicContact CG-CD1 4.13Å; F162-Y185 HydrophobicContact CZ-CD1 4.21Å; F162-Y185 HydrophobicContact CZ-CD2 4.5Å; F162-Y185 AromaticContact CZ-CG 3.97Å; F162-Y185 HydrophobicContact CZ-CG 3.97Å; L181-Y185 WeakPolarHBondContact O-CB 2.99Å; L181-Y185 PolarHBondContact O-N 3Å; A182-Y185 PolarHBondContact O-N 3.08Å; A182-Y185 VanDerWaalsContact O-N 3.12Å; Y185-K187 VanDerWaalsContact C-N 3.29Å; Y185-K187 PolarHBondContact O-N 2.8Å; Y185-I188 HydrophobicContact CD2-CD1 3.94Å; Y185-I188 HydrophobicContact CD2-CG1 4.23Å; Y185-I188 HydrophobicContact CE2-CD1 4.16Å; Y185-I188 WeakPolarHBondContact O-CG1 3.28Å; Y185-I188 PolarHBondContact O-N 3.43Å; Y185-I189 HydrophobicContact CD1-CD1 3.74Å; Y185-I189 HydrophobicContact CD1-CG1 4.27Å; Y185-I189 HydrophobicContact CE1-CD1 3.69Å; Y185-I189 HydrophobicContact CE1-CG1 4.07Å; Y185-I189 WeakPolarHBondContact O-CG1 3.31Å; Y185-I189 PolarHBondContact O-N 3.5Å; Y185-F202 HydrophobicContact CE2-CD1 4.45Å; Y185-I209 HydrophobicContact CD2-CD1 4.15Å
186D94.1Very high94.2Very high23 Ų2344.7 Ų44.712%0.12323%0.234CC..Hα-helixtrans-52.1-45.4173.4-177.566.7000112.2Y151 R155 M159 A182 I188 I189 P190Y151-D186 WeakPolarHBondContact CE2-OD1 3.32Å; Y151-D186 PolarHBondContact OH-OD1 3.07Å; R155-D186 IonicContact CZ-OD1 3.06Å; R155-D186 IonicContact CZ-OD2 3.77Å; R155-D186 IonicContact NE-OD1 2.61Å; R155-D186 PolarHBondContact NE-OD1 3.39Å; R155-D186 IonicContact NE-OD2 3.28Å; R155-D186 VanDerWaalsContact NH2-CG 3.3Å; R155-D186 IonicContact NH2-OD1 2.74Å; R155-D186 PolarHBondContact NH2-OD1 3.25Å; R155-D186 IonicContact NH2-OD2 3.47Å; R155-D186 PolarHBondContact NH2-OD2 3.26Å; M159-D186 HydrophobicContact CE-CB 3.83Å; M159-D186 HydrophobicContact CG-CB 4.41Å; M159-D186 HydrophobicContact SD-CB 3.93Å; A182-D186 WeakPolarHBondContact O-CB 3.36Å; A182-D186 PolarHBondContact O-N 3.06Å; D186-I188 VanDerWaalsContact C-N 3.29Å; D186-I188 PolarHBondContact O-N 3.34Å; D186-I189 PolarHBondContact O-N 2.97Å; D186-P190 WeakPolarHBondContact O-CD 3.33Å
187K93.9Very high94.1Very high121 Ų12146.7 Ų46.753%0.52624%0.243SC..Hα-helixtrans-60.9-30.5177.8-74.7174.3-173.3-176.40114A183 Y185 E309A183-K187 VanDerWaalsContact O-CG 3.28Å; A183-K187 WeakPolarHBondContact O-CG 3.34Å; A183-K187 PolarHBondContact O-N 3.18Å; Y185-K187 VanDerWaalsContact C-N 3.29Å; Y185-K187 PolarHBondContact O-N 2.8Å; K187-E309 IonicContact NZ-OE1 2.8Å; K187-E309 PolarHBondContact NZ-OE1 3.08Å; K187-E309 IonicContact NZ-OE2 3.18Å
188I94Very high93.8Very high22 Ų2247.1 Ų47.111%0.11325%0.247CC..Hα-helixtrans-86.6-29.6-175.565.1161.8000112.7R184 Y185 D186 S191 C192 F202 K205 A206 I209R184-I188 PolarHBondContact O-N 3.26Å; Y185-I188 HydrophobicContact CD2-CD1 3.94Å; Y185-I188 HydrophobicContact CD2-CG1 4.23Å; Y185-I188 HydrophobicContact CE2-CD1 4.16Å; Y185-I188 WeakPolarHBondContact O-CG1 3.28Å; Y185-I188 PolarHBondContact O-N 3.43Å; D186-I188 VanDerWaalsContact C-N 3.29Å; D186-I188 PolarHBondContact O-N 3.34Å; I188-S191 PolarHBondContact O-N 3.02Å; I188-S191 PolarHBondContact O-OG 2.82Å; I188-C192 PolarHBondContact O-N 2.91Å; I188-F202 HydrophobicContact CD1-CD1 4.25Å; I188-K205 HydrophobicContact CB-CB 4.17Å; I188-K205 HydrophobicContact CB-CD 4.12Å; I188-K205 HydrophobicContact CD1-CB 3.84Å; I188-K205 HydrophobicContact CG2-CB 4Å; I188-K205 HydrophobicContact CG2-CD 4.07Å; I188-A206 HydrophobicContact CD1-CB 4.12Å; I188-I209 HydrophobicContact CD1-CD1 4.11Å
189I93.4Very high93.5Very high1 Ų150.2 Ų50.21%0.00527%0.266CS..Hα-helixtrans-54.4-55.1-173.1-67.1161.9000112Y151 F158 M159 Y185 D186 S191 C192 C193 F202Y151-I189 HydrophobicContact CD1-CG2 3.63Å; Y151-I189 HydrophobicContact CD2-CB 4.3Å; Y151-I189 HydrophobicContact CD2-CD1 3.52Å; Y151-I189 HydrophobicContact CD2-CG1 4.5Å; Y151-I189 HydrophobicContact CD2-CG2 3.81Å; Y151-I189 HydrophobicContact CE1-CG2 4Å; Y151-I189 HydrophobicContact CE2-CB 4.23Å; Y151-I189 HydrophobicContact CE2-CD1 3.67Å; Y151-I189 HydrophobicContact CE2-CG2 4.14Å; Y151-I189 HydrophobicContact CG-CB 4.47Å; Y151-I189 HydrophobicContact CG-CD1 4.31Å; Y151-I189 HydrophobicContact CG-CG2 3.53Å; F158-I189 HydrophobicContact CD1-CD1 4.23Å; F158-I189 HydrophobicContact CE1-CD1 3.55Å; F158-I189 HydrophobicContact CZ-CD1 4.35Å; M159-I189 HydrophobicContact SD-CD1 3.93Å; Y185-I189 HydrophobicContact CD1-CD1 3.74Å; Y185-I189 HydrophobicContact CD1-CG1 4.27Å; Y185-I189 HydrophobicContact CE1-CD1 3.69Å; Y185-I189 HydrophobicContact CE1-CG1 4.07Å; Y185-I189 WeakPolarHBondContact O-CG1 3.31Å; Y185-I189 PolarHBondContact O-N 3.5Å; D186-I189 PolarHBondContact O-N 2.97Å; I189-S191 PolarHBondContact O-N 3.3Å; I189-S191 VanDerWaalsContact O-N 3.08Å; I189-C192 PolarHBondContact O-N 3.16Å; I189-C193 VanDerWaalsContact CG2-SG 3.53Å; I189-C193 WeakPolarHBondContact O-CB 3.34Å; I189-C193 PolarHBondContact O-N 3.4Å; I189-C193 PolarHBondContact O-SG 3.34Å; I189-F202 HydrophobicContact CB-CE1 4.35Å; I189-F202 HydrophobicContact CB-CZ 4.39Å; I189-F202 HydrophobicContact CG1-CE1 3.84Å; I189-F202 HydrophobicContact CG1-CZ 4.23Å; I189-F202 HydrophobicContact CG2-CZ 4.29Å
190P94.5Very high93.2Very high54 Ų5454.3 Ų54.335%0.35129%0.285SS..Hα-helixtrans-58.9-33-175.5-2534.1000113.7Y151 D186 K194Y151-P190 HydrophobicContact CE1-CG 4.12Å; D186-P190 WeakPolarHBondContact O-CD 3.33Å; P190-K194 WeakPolarHBondContact O-CG 3.42Å
191S94.1Very high93.2Very high51 Ų5155.1 Ų55.136%0.35729%0.29SS..Hα-helixtrans-77.6-34.4179.272.80000112.8I188 I189 A195 K205I188-S191 PolarHBondContact O-N 3.02Å; I188-S191 PolarHBondContact O-OG 2.82Å; I189-S191 PolarHBondContact O-N 3.3Å; I189-S191 VanDerWaalsContact O-N 3.08Å; S191-A195 PolarHBondContact O-N 3.16Å; S191-K205 PolarHBondContact OG-NZ 3.49Å
192C94.1Very high93Very high0 Ų055.7 Ų55.70%029%0.293CS..Hα-helixtrans-81.1-30.9178.8-73.30000113I188 I189 K194 A195 C201 F202I188-C192 PolarHBondContact O-N 2.91Å; I189-C192 PolarHBondContact O-N 3.16Å; C192-K194 PolarHBondContact O-N 3.48Å; C192-A195 WeakPolarHBondContact O-CB 3.41Å; C192-A195 PolarHBondContact O-N 3.37Å; C192-A195 VanDerWaalsContact O-N 3.15Å; C192-C201 WeakPolarHBondContact CA-SG 3.38Å; C192-C201 HydrophobicContact CB-CB 3.68Å; C192-C201 WeakPolarHBondContact CB-SG 3.37Å; C192-C201 WeakPolarHBondContact SG-CB 3.17Å; C192-C201 PolarHBondContact SG-O 3.31Å; C192-C201 CovalentContact SG-SG 2.06Å; C192-C201 PolarHBondContact SG-SG 3.41Å; C192-F202 HydrophobicContact CB-CD1 4.1Å; C192-F202 HydrophobicContact CB-CD2 3.76Å; C192-F202 HydrophobicContact CB-CE1 3.96Å; C192-F202 HydrophobicContact CB-CE2 3.61Å; C192-F202 HydrophobicContact CB-CG 4Å; C192-F202 HydrophobicContact CB-CZ 3.72Å
193C94.2Very high92.7Very high33 Ų3361.8 Ų61.822%0.22332%0.32CS..Hα-helixtrans-64.1-23.6172.5-64.70000113.4C148 I189C148-C193 WeakPolarHBondContact CA-SG 3.42Å; C148-C193 HydrophobicContact CB-CB 3.68Å; C148-C193 WeakPolarHBondContact CB-SG 3.48Å; C148-C193 WeakPolarHBondContact SG-CA 3.27Å; C148-C193 WeakPolarHBondContact SG-CB 3.44Å; C148-C193 CovalentContact SG-SG 2.02Å; C148-C193 PolarHBondContact SG-SG 3.27Å; I189-C193 VanDerWaalsContact CG2-SG 3.53Å; I189-C193 WeakPolarHBondContact O-CB 3.34Å; I189-C193 PolarHBondContact O-N 3.4Å; I189-C193 PolarHBondContact O-SG 3.34Å
194K93.7Very high92.6Very high172 Ų17264.5 Ų64.575%0.74833%0.333SS*.THydrogen-bonded Turntrans-97.8-0.4177.1-64.3175.5-176177.20113.4P190 C192P190-K194 WeakPolarHBondContact O-CG 3.42Å; C192-K194 PolarHBondContact O-N 3.48Å
195A93.1Very high92.5Very high36 Ų3665.4 Ų65.430%0.29834%0.339SS..SBendtrans-77.7147.5-179.600000110.6S191 C192 N197 C201S191-A195 PolarHBondContact O-N 3.16Å; C192-A195 WeakPolarHBondContact O-CB 3.41Å; C192-A195 PolarHBondContact O-N 3.37Å; C192-A195 VanDerWaalsContact O-N 3.15Å; A195-N197 PolarHBondContact O-N 3.27Å; A195-C201 HydrophobicContact CB-CB 3.92Å
196E91.4Very high92.3Very high213 Ų21365.1 Ų65.1100%0.99534%0.341SS*.SBendtrans-59-37.7175.2-173.1176.8-175.200111.7
197N91.3Very high92.2Very high76 Ų7666.7 Ų66.741%0.40636%0.357SS..SBendtrans-117.888.6171.6-170.9-9.9000110.5A195 V199 E200 C201A195-N197 PolarHBondContact O-N 3.27Å; N197-V199 VanDerWaalsContact C-N 3.32Å; N197-V199 PolarHBondContact O-N 3.06Å; N197-V199 PolarHBondContact OD1-N 2.92Å; N197-E200 HydrophobicContact CB-CB 4.15Å; N197-E200 VanDerWaalsContact CG-CB 3.47Å; N197-E200 VanDerWaalsContact ND2-CB 3.31Å; N197-E200 WeakPolarHBondContact ND2-CB 3.47Å; N197-E200 PolarHBondContact ND2-OE2 3.45Å; N197-E200 PolarHBondContact O-N 3.18Å; N197-E200 PolarHBondContact OD1-N 3.07Å; N197-C201 WeakPolarHBondContact O-CB 3.25Å; N197-C201 PolarHBondContact O-N 2.89Å
198A90.4Very high92Very high20 Ų2064.6 Ų64.617%0.16536%0.358CS..Hα-helixtrans-60.3-40.3-179.900000112.3P144 C201 F202P144-A198 HydrophobicContact CB-CB 3.8Å; A198-C201 PolarHBondContact O-N 2.91Å; A198-F202 VanDerWaalsContact O-CD2 3.23Å; A198-F202 WeakPolarHBondContact O-CD2 3.27Å; A198-F202 PolarHBondContact O-N 2.93Å
199V89.3Confident91.9Very high66 Ų6664 Ų6440%0.436%0.355SS..Hα-helixtrans-57.7-53.6179.7177.70000110.8P144 N197 C201 F202 Q203P144-V199 HydrophobicContact CG-CB 4.27Å; P144-V199 HydrophobicContact CG-CG2 3.71Å; N197-V199 VanDerWaalsContact C-N 3.32Å; N197-V199 PolarHBondContact O-N 3.06Å; N197-V199 PolarHBondContact OD1-N 2.92Å; V199-C201 VanDerWaalsContact C-N 3.33Å; V199-C201 PolarHBondContact O-N 2.91Å; V199-F202 PolarHBondContact O-N 2.93Å; V199-Q203 WeakPolarHBondContact O-CB 3.3Å; V199-Q203 VanDerWaalsContact O-CG 3.27Å; V199-Q203 WeakPolarHBondContact O-CG 3.35Å; V199-Q203 PolarHBondContact O-N 3.05Å
200E91.3Very high91.9Very high109 Ų10966.5 Ų66.551%0.50937%0.37SS..Hα-helixtrans-65.2-37.8-179.7-177.2179.9176.900111.9N197 Q203 T204N197-E200 HydrophobicContact CB-CB 4.15Å; N197-E200 VanDerWaalsContact CG-CB 3.47Å; N197-E200 VanDerWaalsContact ND2-CB 3.31Å; N197-E200 WeakPolarHBondContact ND2-CB 3.47Å; N197-E200 PolarHBondContact ND2-OE2 3.45Å; N197-E200 PolarHBondContact O-N 3.18Å; N197-E200 PolarHBondContact OD1-N 3.07Å; E200-Q203 PolarHBondContact O-N 2.95Å; E200-T204 WeakPolarHBondContact O-CB 3.48Å; E200-T204 PolarHBondContact O-N 3.35Å; E200-T204 PolarHBondContact O-OG1 3.31Å
201C92.9Very high91.7Very high20 Ų2069.9 Ų69.914%0.13538%0.379CS..Hα-helixtrans-60.5-50.7175.8-174.60000111.7C192 A195 N197 A198 V199 T204 K205C192-C201 WeakPolarHBondContact CA-SG 3.38Å; C192-C201 HydrophobicContact CB-CB 3.68Å; C192-C201 WeakPolarHBondContact CB-SG 3.37Å; C192-C201 WeakPolarHBondContact SG-CB 3.17Å; C192-C201 PolarHBondContact SG-O 3.31Å; C192-C201 CovalentContact SG-SG 2.06Å; C192-C201 PolarHBondContact SG-SG 3.41Å; A195-C201 HydrophobicContact CB-CB 3.92Å; N197-C201 WeakPolarHBondContact O-CB 3.25Å; N197-C201 PolarHBondContact O-N 2.89Å; A198-C201 PolarHBondContact O-N 2.91Å; V199-C201 VanDerWaalsContact C-N 3.33Å; V199-C201 PolarHBondContact O-N 2.91Å; C201-T204 PolarHBondContact O-N 3.47Å; C201-K205 WeakPolarHBondContact O-CB 3.49Å; C201-K205 WeakPolarHBondContact O-CG 3.47Å; C201-K205 PolarHBondContact O-N 2.94Å
202F90.9Very high91.7Very high14 Ų1468.4 Ų68.46%0.06137%0.367CS..Hα-helixtrans-62.7-45.3178.8-84.1-68.9000111.5P144 Y185 I188 I189 C192 A198 V199 T204 A206P144-F202 HydrophobicContact CB-CD2 3.89Å; P144-F202 HydrophobicContact CB-CE2 4.12Å; P144-F202 HydrophobicContact CG-CD2 4.23Å; Y185-F202 HydrophobicContact CE2-CD1 4.45Å; I188-F202 HydrophobicContact CD1-CD1 4.25Å; I189-F202 HydrophobicContact CB-CE1 4.35Å; I189-F202 HydrophobicContact CB-CZ 4.39Å; I189-F202 HydrophobicContact CG1-CE1 3.84Å; I189-F202 HydrophobicContact CG1-CZ 4.23Å; I189-F202 HydrophobicContact CG2-CZ 4.29Å; C192-F202 HydrophobicContact CB-CD1 4.1Å; C192-F202 HydrophobicContact CB-CD2 3.76Å; C192-F202 HydrophobicContact CB-CE1 3.96Å; C192-F202 HydrophobicContact CB-CE2 3.61Å; C192-F202 HydrophobicContact CB-CG 4Å; C192-F202 HydrophobicContact CB-CZ 3.72Å; A198-F202 VanDerWaalsContact O-CD2 3.23Å; A198-F202 WeakPolarHBondContact O-CD2 3.27Å; A198-F202 PolarHBondContact O-N 2.93Å; V199-F202 PolarHBondContact O-N 2.93Å; F202-T204 VanDerWaalsContact C-N 3.32Å; F202-T204 PolarHBondContact O-N 3.03Å; F202-A206 WeakPolarHBondContact O-CB 3.38Å; F202-A206 PolarHBondContact O-N 3.42Å
203Q88.7Confident91.7Very high135 Ų13569.4 Ų69.463%0.63137%0.372SS*.Hα-helixtrans-56.9-46.4177.2-74.8175.4-3.200111.8V199 E200 A207V199-Q203 WeakPolarHBondContact O-CB 3.3Å; V199-Q203 VanDerWaalsContact O-CG 3.27Å; V199-Q203 WeakPolarHBondContact O-CG 3.35Å; V199-Q203 PolarHBondContact O-N 3.05Å; E200-Q203 PolarHBondContact O-N 2.95Å; Q203-A207 PolarHBondContact O-N 2.04Å
204T91.4Very high91.6Very high96 Ų9675.8 Ų75.859%0.58939%0.391SS*.Hα-helixtrans-69.6-49.4-177.7-57.10000111.6E200 C201 F202 A207E200-T204 WeakPolarHBondContact O-CB 3.48Å; E200-T204 PolarHBondContact O-N 3.35Å; E200-T204 PolarHBondContact O-OG1 3.31Å; C201-T204 PolarHBondContact O-N 3.47Å; F202-T204 VanDerWaalsContact C-N 3.32Å; F202-T204 PolarHBondContact O-N 3.03Å; T204-A207 WeakPolarHBondContact O-CB 3.21Å; T204-A207 PolarHBondContact O-N 3.04Å
205K91.4Very high91.5Very high88 Ų8872 Ų7238%0.38338%0.376SS..Hα-helixtrans-73.8-34.5-175.6-65.8-163.7-173.9-176.50112.9I188 S191 C201 A207 S208I188-K205 HydrophobicContact CB-CB 4.17Å; I188-K205 HydrophobicContact CB-CD 4.12Å; I188-K205 HydrophobicContact CD1-CB 3.84Å; I188-K205 HydrophobicContact CG2-CB 4Å; I188-K205 HydrophobicContact CG2-CD 4.07Å; S191-K205 PolarHBondContact OG-NZ 3.49Å; C201-K205 WeakPolarHBondContact O-CB 3.49Å; C201-K205 WeakPolarHBondContact O-CG 3.47Å; C201-K205 PolarHBondContact O-N 2.94Å; K205-A207 VanDerWaalsContact C-N 3.31Å; K205-A207 PolarHBondContact O-N 3.06Å; K205-S208 PolarHBondContact O-OG 3.04Å
206A90.8Very high91.6Very high18 Ų1870.5 Ų70.515%0.14936%0.364CS..Hα-helixtrans-79.6-9.217800000113.7I188 F202 S208 I209 T210I188-A206 HydrophobicContact CD1-CB 4.12Å; F202-A206 WeakPolarHBondContact O-CB 3.38Å; F202-A206 PolarHBondContact O-N 3.42Å; A206-S208 VanDerWaalsContact C-N 3.31Å; A206-S208 PolarHBondContact O-N 3.34Å; A206-I209 PolarHBondContact O-N 3.39Å; A206-T210 WeakPolarHBondContact O-CB 3.25Å; A206-T210 PolarHBondContact O-N 3.47Å; A206-T210 PolarHBondContact O-OG1 3.16Å
207A91.1Very high91.8Very high56 Ų5660.9 Ų60.946%0.46332%0.32SS..Hα-helixtrans-58-43.3178.500000112.2Q203 T204 K205 T210 K211Q203-A207 PolarHBondContact O-N 2.04Å; T204-A207 WeakPolarHBondContact O-CB 3.21Å; T204-A207 PolarHBondContact O-N 3.04Å; K205-A207 VanDerWaalsContact C-N 3.31Å; K205-A207 PolarHBondContact O-N 3.06Å; A207-T210 PolarHBondContact O-N 2.97Å; A207-K211 WeakPolarHBondContact O-CB 3.32Å; A207-K211 PolarHBondContact O-N 3.2Å
208S90.4Very high91.9Very high76 Ų7659.6 Ų59.653%0.53131%0.313SS..Hα-helixtrans-66.5-39.8177.465.80000112.5K205 A206 K211 E212K205-S208 PolarHBondContact O-OG 3.04Å; A206-S208 VanDerWaalsContact C-N 3.31Å; A206-S208 PolarHBondContact O-N 3.34Å; S208-K211 PolarHBondContact O-N 3.41Å; S208-E212 WeakPolarHBondContact O-CB 3.46Å; S208-E212 PolarHBondContact O-N 2.84Å
209I92.3Very high92.1Very high10 Ų1061.5 Ų61.55%0.05132%0.32CS..Hα-helixtrans-64-44.4176.3-57.3176.1000110L181 R184 Y185 I188 A206 K211 E212 L213L181-I209 HydrophobicContact CB-CG2 4.31Å; L181-I209 HydrophobicContact CD2-CG2 3.69Å; R184-I209 HydrophobicContact CB-CD1 3.93Å; R184-I209 HydrophobicContact CB-CG1 4.1Å; Y185-I209 HydrophobicContact CD2-CD1 4.15Å; I188-I209 HydrophobicContact CD1-CD1 4.11Å; A206-I209 PolarHBondContact O-N 3.39Å; I209-K211 PolarHBondContact O-N 3.08Å; I209-E212 PolarHBondContact O-N 2.92Å; I209-L213 WeakPolarHBondContact O-CB 3.29Å; I209-L213 PolarHBondContact O-N 3.32Å
210T92.1Very high92.5Very high54 Ų5459 Ų5933%0.33130%0.304SS..Hα-helixtrans-65.6-39.4178.8-58.20000111.5A206 A207 R214A206-T210 WeakPolarHBondContact O-CB 3.25Å; A206-T210 PolarHBondContact O-N 3.47Å; A206-T210 PolarHBondContact O-OG1 3.16Å; A207-T210 PolarHBondContact O-N 2.97Å; T210-R214 VanDerWaalsContact O-CG 3.27Å; T210-R214 WeakPolarHBondContact O-CG 3.09Å; T210-R214 PolarHBondContact O-N 3.42Å; T210-R214 VanDerWaalsContact O-N 3.12Å
211K91.6Very high92.8Very high124 Ų12454.5 Ų54.554%0.53928%0.283SS..Hα-helixtrans-61.9-51.5174.8-178.5-177173.2-174.50110.6A207 S208 I209 L213 R214 E215A207-K211 WeakPolarHBondContact O-CB 3.32Å; A207-K211 PolarHBondContact O-N 3.2Å; S208-K211 PolarHBondContact O-N 3.41Å; I209-K211 PolarHBondContact O-N 3.08Å; K211-L213 PolarHBondContact O-N 3.36Å; K211-R214 PolarHBondContact O-N 3.35Å; K211-R214 VanDerWaalsContact O-N 3.17Å; K211-E215 VanDerWaalsContact CE-CD 3.47Å; K211-E215 WeakPolarHBondContact CE-OE1 3.44Å; K211-E215 WeakPolarHBondContact CE-OE2 3.48Å; K211-E215 HydrophobicContact CG-CG 4.47Å; K211-E215 IonicContact NZ-OE1 3.14Å; K211-E215 WeakPolarHBondContact O-CG 3.02Å; K211-E215 PolarHBondContact O-N 3.09Å
212E92.9Very high92.9Very high20 Ų2054 Ų549%0.09328%0.279CS..Hα-helixtrans-58.1-46.9178.7-178.259.7-107.800112L181 S208 I209 R214 E215 S216 Q312L181-E212 HydrophobicContact CD2-CB 3.96Å; L181-E212 HydrophobicContact CD2-CG 3.82Å; S208-E212 WeakPolarHBondContact O-CB 3.46Å; S208-E212 PolarHBondContact O-N 2.84Å; I209-E212 PolarHBondContact O-N 2.92Å; E212-R214 VanDerWaalsContact C-N 3.31Å; E212-R214 PolarHBondContact O-N 3.41Å; E212-E215 PolarHBondContact O-N 2.64Å; E212-S216 VanDerWaalsContact O-CB 3.26Å; E212-S216 WeakPolarHBondContact O-CB 3.34Å; E212-S216 PolarHBondContact O-N 3.21Å; E212-S216 PolarHBondContact OE1-OG 2.92Å; E212-Q312 PolarHBondContact OE1-NE2 3.18Å; E212-Q312 PolarHBondContact OE2-NE2 3.41Å
213L94Very high93.2Very high22 Ų2253.9 Ų53.912%0.11528%0.281CS..Hα-helixtrans-53.7-48.4175170.961.9000111.8I166 L173 L181 I209 K211 S217I166-L213 HydrophobicContact CD1-CD1 4.42Å; I166-L213 HydrophobicContact CD1-CD2 3.61Å; I166-L213 HydrophobicContact CG2-CD1 3.79Å; L173-L213 HydrophobicContact CD2-CD1 3.49Å; L173-L213 VanDerWaalsContact CD2-CD1 3.49Å; L181-L213 HydrophobicContact CD1-CB 3.86Å; L181-L213 HydrophobicContact CD1-CD1 3.75Å; L181-L213 HydrophobicContact CD1-CG 4.39Å; L181-L213 HydrophobicContact CD2-CB 4.44Å; I209-L213 WeakPolarHBondContact O-CB 3.29Å; I209-L213 PolarHBondContact O-N 3.32Å; K211-L213 PolarHBondContact O-N 3.36Å; L213-S217 WeakPolarHBondContact O-CB 3.27Å; L213-S217 PolarHBondContact O-N 2.88Å
214R91.6Very high93.6Very high166 Ų16648 Ų4863%0.62625%0.254SS*.Hα-helixtrans-64.7-48.6-179.4-71.7171.6-175.9176.84111T210 K211 E212 L218T210-R214 VanDerWaalsContact O-CG 3.27Å; T210-R214 WeakPolarHBondContact O-CG 3.09Å; T210-R214 PolarHBondContact O-N 3.42Å; T210-R214 VanDerWaalsContact O-N 3.12Å; K211-R214 PolarHBondContact O-N 3.35Å; K211-R214 VanDerWaalsContact O-N 3.17Å; E212-R214 VanDerWaalsContact C-N 3.31Å; E212-R214 PolarHBondContact O-N 3.41Å; R214-L218 WeakPolarHBondContact O-CG 3.33Å; R214-L218 PolarHBondContact O-N 3.02Å; R214-L218 VanDerWaalsContact O-N 3.07Å
215E92.6Very high93.8Very high92 Ų9244 Ų4443%0.4323%0.231SC..Hα-helixtrans-65.1-50.4-177.3-71.7174.8169.500111.5K211 E212 S217 L218 L219K211-E215 VanDerWaalsContact CE-CD 3.47Å; K211-E215 WeakPolarHBondContact CE-OE1 3.44Å; K211-E215 WeakPolarHBondContact CE-OE2 3.48Å; K211-E215 HydrophobicContact CG-CG 4.47Å; K211-E215 IonicContact NZ-OE1 3.14Å; K211-E215 WeakPolarHBondContact O-CG 3.02Å; K211-E215 PolarHBondContact O-N 3.09Å; E212-E215 PolarHBondContact O-N 2.64Å; E215-S217 PolarHBondContact O-N 3.4Å; E215-L218 PolarHBondContact O-N 3.21Å; E215-L219 WeakPolarHBondContact O-CB 3.42Å; E215-L219 PolarHBondContact O-N 3.19Å
216S95.5Very high94Very high6 Ų639.9 Ų39.94%0.04221%0.214CC..Hα-helixtrans-64.3-39.1177.6-78.10000112.6E212 L218 L219 N220E212-S216 VanDerWaalsContact O-CB 3.26Å; E212-S216 WeakPolarHBondContact O-CB 3.34Å; E212-S216 PolarHBondContact O-N 3.21Å; E212-S216 PolarHBondContact OE1-OG 2.92Å; S216-L218 PolarHBondContact O-N 3.41Å; S216-L219 PolarHBondContact O-N 2.88Å; S216-N220 WeakPolarHBondContact O-CB 3.37Å; S216-N220 PolarHBondContact O-N 2.85Å; S216-N220 PolarHBondContact O-OD1 3.14Å
217S94.6Very high94.2Very high11 Ų1140.3 Ų40.38%0.07721%0.213CC..Hα-helixtrans-62.4-43.8175.7177.90000111.6H170 L213 E215 Q221H170-S217 VanDerWaalsContact ND1-CB 3.35Å; H170-S217 WeakPolarHBondContact ND1-CB 3.08Å; H170-S217 PolarHBondContact ND1-OG 2.65Å; L213-S217 WeakPolarHBondContact O-CB 3.27Å; L213-S217 PolarHBondContact O-N 2.88Å; E215-S217 PolarHBondContact O-N 3.4Å; S217-Q221 WeakPolarHBondContact O-CB 3.45Å; S217-Q221 PolarHBondContact O-N 3.44Å; S217-Q221 VanDerWaalsContact O-N 3.16Å
218L94.2Very high94.3Very high49 Ų4944.8 Ų44.826%0.25722%0.222SC..Hα-helixtrans-65.7-42178.7-68172.7000110.9R214 E215 S216 H222 I479 H483R214-L218 WeakPolarHBondContact O-CG 3.33Å; R214-L218 PolarHBondContact O-N 3.02Å; R214-L218 VanDerWaalsContact O-N 3.07Å; E215-L218 PolarHBondContact O-N 3.21Å; S216-L218 PolarHBondContact O-N 3.41Å; L218-H222 VanDerWaalsContact O-CB 3.22Å; L218-H222 WeakPolarHBondContact O-CB 3.26Å; L218-H222 PolarHBondContact O-N 3.5Å; L218-I479 HydrophobicContact CB-CG2 4.05Å; L218-H483 WeakPolarHBondContact CA-NE2 3.49Å; L218-H483 WeakPolarHBondContact CD2-CE1 3.37Å; L218-H483 WeakPolarHBondContact CD2-ND1 3.47Å; L218-H483 PolarHBondContact O-NE2 3.09Å
219L95.4Very high94.4Very high60 Ų6044.2 Ų44.231%0.31421%0.213SC..Hα-helixtrans-66.5-49.2-178.7-178.862.7000112.1E215 S216 H222 A223 I479E215-L219 WeakPolarHBondContact O-CB 3.42Å; E215-L219 PolarHBondContact O-N 3.19Å; S216-L219 PolarHBondContact O-N 2.88Å; L219-H222 PolarHBondContact O-N 2.65Å; L219-A223 WeakPolarHBondContact O-CB 3.43Å; L219-A223 PolarHBondContact O-N 3.22Å; L219-I479 HydrophobicContact CD1-CD1 4Å
220N97.1Very high94.6Very high12 Ų1245.2 Ų45.26%0.06422%0.217CC..Hα-helixtrans-67-41.8-176.7-66.210.1000110.9F172 Y174 S216 H222 A223 C224F172-N220 WeakPolarHBondContact O-CB 3.49Å; Y174-N220 VanDerWaalsContact CB-ND2 3.33Å; Y174-N220 WeakPolarHBondContact CB-ND2 3.37Å; Y174-N220 HydrophobicContact CD1-CB 3.83Å; Y174-N220 VanDerWaalsContact CD1-ND2 3.33Å; Y174-N220 WeakPolarHBondContact CD1-ND2 3.46Å; Y174-N220 VanDerWaalsContact CD2-ND2 3.34Å; Y174-N220 WeakPolarHBondContact CD2-ND2 3.45Å; Y174-N220 HydrophobicContact CE1-CB 3.69Å; Y174-N220 HydrophobicContact CE2-CB 4.44Å; Y174-N220 HydrophobicContact CG-CB 4.29Å; Y174-N220 PolarHBondContact N-ND2 3.2Å; Y174-N220 VanDerWaalsContact N-ND2 3.13Å; S216-N220 WeakPolarHBondContact O-CB 3.37Å; S216-N220 PolarHBondContact O-N 2.85Å; S216-N220 PolarHBondContact O-OD1 3.14Å; N220-H222 VanDerWaalsContact C-N 3.34Å; N220-H222 PolarHBondContact O-N 3.27Å; N220-A223 WeakPolarHBondContact O-CB 3.26Å; N220-A223 PolarHBondContact O-N 2.95Å; N220-C224 PolarHBondContact O-N 2.96Å; N220-C224 PolarHBondContact O-SG 3.15Å
221Q96.2Very high94.6Very high15 Ų1544 Ų447%0.0722%0.215CC..Hα-helixtrans-62.6-41.6174.6-171.2174.223.300112.1P131 F172 S217 C224 A225 H483 I486P131-Q221 PolarHBondContact O-NE2 3.48Å; F172-Q221 HydrophobicContact CB-CB 4.24Å; F172-Q221 HydrophobicContact CB-CG 4.38Å; F172-Q221 HydrophobicContact CD2-CG 4.19Å; S217-Q221 WeakPolarHBondContact O-CB 3.45Å; S217-Q221 PolarHBondContact O-N 3.44Å; S217-Q221 VanDerWaalsContact O-N 3.16Å; Q221-C224 PolarHBondContact O-N 3.4Å; Q221-A225 WeakPolarHBondContact O-CB 3.38Å; Q221-A225 PolarHBondContact O-N 3.02Å; Q221-H483 PolarHBondContact OE1-CE1 3.49Å; Q221-I486 HydrophobicContact CG-CD1 3.9Å
222H96.4Very high94.5Very high9 Ų941.4 Ų41.44%0.04221%0.21CC..Hα-helixtrans-63.9-43.3174.4174.558.6000111.8L218 L219 N220 C224 A225 V226 D478 I479 R508L218-H222 VanDerWaalsContact O-CB 3.22Å; L218-H222 WeakPolarHBondContact O-CB 3.26Å; L218-H222 PolarHBondContact O-N 3.5Å; L219-H222 PolarHBondContact O-N 2.65Å; N220-H222 VanDerWaalsContact C-N 3.34Å; N220-H222 PolarHBondContact O-N 3.27Å; H222-C224 PolarHBondContact O-N 3Å; H222-A225 PolarHBondContact O-N 3.48Å; H222-V226 WeakPolarHBondContact CE1-CG2 3.19Å; H222-V226 WeakPolarHBondContact O-CB 3.42Å; H222-V226 VanDerWaalsContact O-CG2 3.3Å; H222-V226 WeakPolarHBondContact O-CG2 3.47Å; H222-V226 PolarHBondContact O-N 3.4Å; H222-D478 IonicContact CD2-OD2 2.79Å; H222-D478 IonicContact CE1-OD2 2.69Å; H222-D478 PolarHBondContact CE1-OD2 3.1Å; H222-D478 IonicContact NE2-OD2 3.43Å; H222-D478 PolarHBondContact NE2-OD2 2.9Å; H222-I479 HydrophobicContact CB-CD1 3.93Å; H222-I479 WeakPolarHBondContact CD2-CD1 3.35Å; H222-R508 PolarHBondContact CE1-NH2 3.27Å
223A96.4Very high94.4Very high12 Ų1246.5 Ų46.510%0.09923%0.228CC..Hα-helixtrans-58.1-46.817600000111.7L219 N220 V226 M227 F235L219-A223 WeakPolarHBondContact O-CB 3.43Å; L219-A223 PolarHBondContact O-N 3.22Å; N220-A223 WeakPolarHBondContact O-CB 3.26Å; N220-A223 PolarHBondContact O-N 2.95Å; A223-V226 PolarHBondContact O-N 3.41Å; A223-M227 PolarHBondContact O-N 3.24Å; A223-F235 HydrophobicContact CB-CE2 4.07Å
224C96.7Very high94.4Very high11 Ų1147.3 Ų47.37%0.07423%0.234CC..Hα-helixtrans-64.6-41.3177.3-60.40000112.6F172 N220 Q221 H222 V226 M227 K228 C270F172-C224 HydrophobicContact CD1-CB 4.33Å; N220-C224 PolarHBondContact O-N 2.96Å; N220-C224 PolarHBondContact O-SG 3.15Å; Q221-C224 PolarHBondContact O-N 3.4Å; H222-C224 PolarHBondContact O-N 3Å; C224-V226 VanDerWaalsContact C-N 3.34Å; C224-V226 PolarHBondContact O-N 3.32Å; C224-M227 PolarHBondContact O-N 3.02Å; C224-K228 VanDerWaalsContact O-CB 3.32Å; C224-K228 WeakPolarHBondContact O-CB 3.16Å; C224-K228 PolarHBondContact O-N 3.41Å; C224-C270 WeakPolarHBondContact CA-SG 3.42Å; C224-C270 HydrophobicContact CB-CB 3.73Å; C224-C270 WeakPolarHBondContact CB-SG 3.34Å; C224-C270 WeakPolarHBondContact SG-CA 3.43Å; C224-C270 WeakPolarHBondContact SG-CB 3.36Å; C224-C270 CovalentContact SG-SG 2.04Å; C224-C270 PolarHBondContact SG-SG 3.25Å
225A95.6Very high94.6Very high13 Ų1339.9 Ų39.911%0.10721%0.206CC..Hα-helixtrans-64.2-39.3175.400000112.1Q221 H222 K228 N229 I486Q221-A225 WeakPolarHBondContact O-CB 3.38Å; Q221-A225 PolarHBondContact O-N 3.02Å; H222-A225 PolarHBondContact O-N 3.48Å; A225-K228 PolarHBondContact O-N 3.44Å; A225-N229 VanDerWaalsContact O-CB 3.28Å; A225-N229 WeakPolarHBondContact O-CB 3Å; A225-N229 VanDerWaalsContact O-CG 3.29Å; A225-N229 PolarHBondContact O-N 2.93Å; A225-N229 PolarHBondContact O-ND2 3.27Å; A225-N229 VanDerWaalsContact O-ND2 3.08Å; A225-I486 HydrophobicContact CB-CD1 3.74Å; A225-I486 HydrophobicContact CB-CG1 3.51Å
226V96.1Very high94.7Very high2 Ų237.2 Ų37.21%0.01219%0.194CC..Hα-helixtrans-63.1-46.4176.4166.50000110.9H222 A223 C224 N229 F230 T234 F235 I238 Y505H222-V226 WeakPolarHBondContact CE1-CG2 3.19Å; H222-V226 WeakPolarHBondContact O-CB 3.42Å; H222-V226 VanDerWaalsContact O-CG2 3.3Å; H222-V226 WeakPolarHBondContact O-CG2 3.47Å; H222-V226 PolarHBondContact O-N 3.4Å; A223-V226 PolarHBondContact O-N 3.41Å; C224-V226 VanDerWaalsContact C-N 3.34Å; C224-V226 PolarHBondContact O-N 3.32Å; V226-N229 PolarHBondContact O-N 3.33Å; V226-F230 HydrophobicContact CB-CD2 4.37Å; V226-F230 HydrophobicContact CG1-CD2 4.15Å; V226-F230 HydrophobicContact CG2-CD2 4.41Å; V226-F230 WeakPolarHBondContact O-CB 3.33Å; V226-F230 PolarHBondContact O-N 2.74Å; V226-T234 HydrophobicContact CG1-CG2 4.47Å; V226-F235 HydrophobicContact CG1-CD2 4.46Å; V226-I238 HydrophobicContact CG1-CD1 3.57Å; V226-Y505 HydrophobicContact CG1-CD2 4.24Å; V226-Y505 HydrophobicContact CG1-CE2 4.35Å; V226-Y505 HydrophobicContact CG2-CD2 3.89Å; V226-Y505 HydrophobicContact CG2-CE2 3.67Å
227M94.4Very high94.8Very high26 Ų2638.3 Ų38.313%0.12820%0.203CC..Hα-helixtrans-65-42.3-179.9-165.6166.471.800111.6A223 C224 G231 F235 E267 C270A223-M227 PolarHBondContact O-N 3.24Å; C224-M227 PolarHBondContact O-N 3.02Å; M227-G231 WeakPolarHBondContact O-CA 3.5Å; M227-G231 PolarHBondContact O-N 2.91Å; M227-F235 HydrophobicContact CB-CD2 4.25Å; M227-F235 HydrophobicContact CG-CB 4.45Å; M227-F235 HydrophobicContact SD-CG 4.43Å; M227-E267 VanDerWaalsContact CE-CA 3.48Å; M227-E267 HydrophobicContact CE-CB 4.18Å; M227-E267 HydrophobicContact CE-CG 4.46Å; M227-E267 HydrophobicContact SD-CB 4.48Å; M227-C270 HydrophobicContact CE-CB 3.62Å
228K93.4Very high95Very high151 Ų15138.1 Ų38.166%0.65720%0.201SC*.Hα-helixtrans-60.7-47.9174.8-179-170.2172.1-162.90112.6C224 A225 E489C224-K228 VanDerWaalsContact O-CB 3.32Å; C224-K228 WeakPolarHBondContact O-CB 3.16Å; C224-K228 PolarHBondContact O-N 3.41Å; A225-K228 PolarHBondContact O-N 3.44Å; K228-E489 IonicContact NZ-OE2 2.71Å; K228-E489 PolarHBondContact NZ-OE2 3.41Å
229N94.1Very high95.1Very high63 Ų6336.2 Ų36.234%0.33719%0.192SC..Hα-helixtrans-91.8-27.2-168.2-65.4-33.9000114.5A225 V226 E489A225-N229 VanDerWaalsContact O-CB 3.28Å; A225-N229 WeakPolarHBondContact O-CB 3Å; A225-N229 VanDerWaalsContact O-CG 3.29Å; A225-N229 PolarHBondContact O-N 2.93Å; A225-N229 PolarHBondContact O-ND2 3.27Å; A225-N229 VanDerWaalsContact O-ND2 3.08Å; V226-N229 PolarHBondContact O-N 3.33Å; N229-E489 PolarHBondContact ND2-OE1 3.45Å
230F95.1Very high95.3Very high32 Ų3233.6 Ų33.614%0.1418%0.178CC..Hα-helixtrans-117.2-1.9-177.3-54.6-72.7000113.4V226 T234 C501 Y505V226-F230 HydrophobicContact CB-CD2 4.37Å; V226-F230 HydrophobicContact CG1-CD2 4.15Å; V226-F230 HydrophobicContact CG2-CD2 4.41Å; V226-F230 WeakPolarHBondContact O-CB 3.33Å; V226-F230 PolarHBondContact O-N 2.74Å; F230-T234 HydrophobicContact CB-CG2 3.75Å; F230-T234 HydrophobicContact CG-CG2 4.46Å; F230-T234 WeakPolarHBondContact O-CB 3.46Å; F230-T234 PolarHBondContact O-OG1 3.08Å; F230-C501 WeakPolarHBondContact CZ-O 3.26Å; F230-Y505 HydrophobicContact CD2-CD2 4.09Å; F230-Y505 HydrophobicContact CD2-CG 4.37Å; F230-Y505 AromaticContact CE2-CD2 3.94Å; F230-Y505 HydrophobicContact CE2-CD2 3.94Å; F230-Y505 HydrophobicContact CE2-CG 4.45Å
231G92.5Very high95.3Very high29 Ų2933 Ų3330%0.29918%0.175SC..Hα-helixtrans75.6168.6175.200000115M227 R233 T234 F235M227-G231 WeakPolarHBondContact O-CA 3.5Å; M227-G231 PolarHBondContact O-N 2.91Å; G231-R233 VanDerWaalsContact C-N 3.3Å; G231-R233 PolarHBondContact O-N 2.03Å; G231-T234 PolarHBondContact O-N 3.03Å; G231-T234 VanDerWaalsContact O-N 3.16Å; G231-F235 PolarHBondContact O-N 2.89Å
232T88.8Confident95.4Very high68 Ų6837 Ų3742%0.41719%0.192SC..Hα-helixtrans-57.9-36.6-176.5-51.30000113.1T234 F235 H236T232-T234 PolarHBondContact O-N 3.11Å; T232-F235 CarbonylContact O-C 3.24Å; T232-F235 WeakPolarHBondContact O-CB 3.31Å; T232-F235 PolarHBondContact O-N 3.13Å; T232-H236 WeakPolarHBondContact CG2-NE2 3.4Å; T232-H236 PolarHBondContact O-CD2 3.16Å; T232-H236 VanDerWaalsContact O-CG 3.31Å; T232-H236 PolarHBondContact O-N 3.49Å
233R90.6Very high95.4Very high128 Ų12837.6 Ų37.648%0.48320%0.196SC..Hα-helixtrans-60.5-42.7177.5-178.8178.8173.8-172.2-1.2112.7G231 F235 H236 A237 N348G231-R233 VanDerWaalsContact C-N 3.3Å; G231-R233 PolarHBondContact O-N 2.03Å; R233-F235 VanDerWaalsContact C-N 3.33Å; R233-H236 PolarHBondContact O-N 2.75Å; R233-A237 PolarHBondContact O-N 2.94Å; R233-A237 VanDerWaalsContact O-N 3.08Å; R233-N348 PolarHBondContact NE-OD1 3.5Å; R233-N348 PolarHBondContact NH1-OD1 2.74Å; R233-N348 PolarHBondContact NH2-OD1 3.48Å
234T95Very high95.5Very high39 Ų3937 Ų3724%0.23919%0.191CC..Hα-helixtrans-66.5-41.6177.4-59.10000110.1V226 F230 G231 T232 A237 I238 Y505V226-T234 HydrophobicContact CG1-CG2 4.47Å; F230-T234 HydrophobicContact CB-CG2 3.75Å; F230-T234 HydrophobicContact CG-CG2 4.46Å; F230-T234 WeakPolarHBondContact O-CB 3.46Å; F230-T234 PolarHBondContact O-OG1 3.08Å; G231-T234 PolarHBondContact O-N 3.03Å; G231-T234 VanDerWaalsContact O-N 3.16Å; T232-T234 PolarHBondContact O-N 3.11Å; T234-A237 PolarHBondContact O-N 2.94Å; T234-I238 HydrophobicContact CG2-CD1 4.25Å; T234-I238 WeakPolarHBondContact O-CG1 3.25Å; T234-I238 PolarHBondContact O-N 3.01Å; T234-Y505 HydrophobicContact CG2-CD1 3.93Å; T234-Y505 HydrophobicContact CG2-CG 3.91Å
235F95.4Very high95.6Very high10 Ų1037 Ų374%0.04419%0.189CC..Hα-helixtrans-61.2-44.3175.7-163.6-94.5000112A223 V226 M227 G231 T232 R233 A237 I238 T239 A263 H266A223-F235 HydrophobicContact CB-CE2 4.07Å; V226-F235 HydrophobicContact CG1-CD2 4.46Å; M227-F235 HydrophobicContact CB-CD2 4.25Å; M227-F235 HydrophobicContact CG-CB 4.45Å; M227-F235 HydrophobicContact SD-CG 4.43Å; G231-F235 PolarHBondContact O-N 2.89Å; T232-F235 CarbonylContact O-C 3.24Å; T232-F235 WeakPolarHBondContact O-CB 3.31Å; T232-F235 PolarHBondContact O-N 3.13Å; R233-F235 VanDerWaalsContact C-N 3.33Å; F235-A237 VanDerWaalsContact C-N 3.34Å; F235-A237 PolarHBondContact O-N 3Å; F235-I238 WeakPolarHBondContact O-CB 3.06Å; F235-I238 PolarHBondContact O-N 2.97Å; F235-T239 WeakPolarHBondContact CE1-OG1 3.41Å; F235-T239 PolarHBondContact O-N 3.07Å; F235-T239 PolarHBondContact O-OG1 3.26Å; F235-A263 HydrophobicContact CD1-CB 4.02Å; F235-A263 HydrophobicContact CE1-CB 4.33Å; F235-H266 HydrophobicContact CE1-CB 3.72Å; F235-H266 AromaticContact CE1-CD2 3.63Å; F235-H266 AromaticContact CE1-CG 3.71Å; F235-H266 HydrophobicContact CZ-CB 3.67Å; F235-H266 AromaticContact CZ-CD2 3.42Å; F235-H266 VanDerWaalsContact CZ-CD2 3.42Å; F235-H266 WeakPolarHBondContact CZ-CD2 3.5Å; F235-H266 AromaticContact CZ-CE1 3.97Å; F235-H266 AromaticContact CZ-CG 3.33Å; F235-H266 AromaticContact CZ-ND1 3.68Å; F235-H266 AromaticContact CZ-NE2 3.82Å
236H95.5Very high95.6Very high35 Ų3537.6 Ų37.616%0.16219%0.19CC..Hα-helixtrans-56.4-46.6173.4-71-176.8000111.6T232 R233 I238 T239 V240 V259 A263T232-H236 WeakPolarHBondContact CG2-NE2 3.4Å; T232-H236 PolarHBondContact O-CD2 3.16Å; T232-H236 VanDerWaalsContact O-CG 3.31Å; T232-H236 PolarHBondContact O-N 3.49Å; R233-H236 PolarHBondContact O-N 2.75Å; H236-I238 VanDerWaalsContact C-N 3.33Å; H236-I238 PolarHBondContact O-N 3.09Å; H236-T239 PolarHBondContact O-N 3.1Å; H236-T239 VanDerWaalsContact O-N 3.16Å; H236-V240 VanDerWaalsContact O-CG2 3.24Å; H236-V240 WeakPolarHBondContact O-CG2 3.41Å; H236-V240 PolarHBondContact O-N 3.26Å; H236-V259 HydrophobicContact CB-CG1 4.09Å; H236-A263 WeakPolarHBondContact CD2-CB 3.31Å; H236-A263 VanDerWaalsContact NE2-CB 3.3Å; H236-A263 WeakPolarHBondContact NE2-CB 3.36Å
237A97.3Very high95.7Very high29 Ų2937.5 Ų37.524%0.2419%0.189CC..Hα-helixtrans-62.5-38.5179.100000112.7R233 T234 F235 T241 L371R233-A237 PolarHBondContact O-N 2.94Å; R233-A237 VanDerWaalsContact O-N 3.08Å; T234-A237 PolarHBondContact O-N 2.94Å; F235-A237 VanDerWaalsContact C-N 3.34Å; F235-A237 PolarHBondContact O-N 3Å; A237-T241 WeakPolarHBondContact O-CB 3.19Å; A237-T241 PolarHBondContact O-N 3.13Å; A237-T241 PolarHBondContact O-OG1 2.98Å; A237-L371 HydrophobicContact CB-CD2 3.71Å
238I97.8Very high95.7Very high8 Ų836.3 Ų36.34%0.04118%0.183CC..Hα-helixtrans-61.3-47.9172.2-68.6164.6000110.3V226 T234 F235 H236 T241 K242 V367 L371 Y505V226-I238 HydrophobicContact CG1-CD1 3.57Å; T234-I238 HydrophobicContact CG2-CD1 4.25Å; T234-I238 WeakPolarHBondContact O-CG1 3.25Å; T234-I238 PolarHBondContact O-N 3.01Å; F235-I238 WeakPolarHBondContact O-CB 3.06Å; F235-I238 PolarHBondContact O-N 2.97Å; H236-I238 VanDerWaalsContact C-N 3.33Å; H236-I238 PolarHBondContact O-N 3.09Å; I238-T241 WeakPolarHBondContact O-CB 3.33Å; I238-T241 PolarHBondContact O-N 2.88Å; I238-K242 HydrophobicContact CG2-CD 4.16Å; I238-K242 WeakPolarHBondContact O-CG 3.48Å; I238-K242 PolarHBondContact O-N 3.36Å; I238-V367 HydrophobicContact CB-CG1 4.35Å; I238-V367 HydrophobicContact CG1-CG1 4.2Å; I238-V367 HydrophobicContact CG2-CG1 4.18Å; I238-L371 HydrophobicContact CG1-CD1 3.69Å; I238-Y505 HydrophobicContact CD1-CD1 3.86Å; I238-Y505 HydrophobicContact CD1-CE1 3.34Å; I238-Y505 HydrophobicContact CD1-CE2 4.08Å; I238-Y505 HydrophobicContact CD1-CG 4.43Å; I238-Y505 VanDerWaalsContact CD1-CZ 3.48Å; I238-Y505 HydrophobicContact CG1-CD1 4.17Å; I238-Y505 HydrophobicContact CG1-CE1 3.52Å
239T97.5Very high95.8Very high9 Ų935.2 Ų35.26%0.05518%0.179CC..Hα-helixtrans-67.7-41.5-177.8-56.20000111.8F235 H236 T241 K242 L243 V259 V262F235-T239 WeakPolarHBondContact CE1-OG1 3.41Å; F235-T239 PolarHBondContact O-N 3.07Å; F235-T239 PolarHBondContact O-OG1 3.26Å; H236-T239 PolarHBondContact O-N 3.1Å; H236-T239 VanDerWaalsContact O-N 3.16Å; T239-T241 VanDerWaalsContact C-N 3.28Å; T239-T241 PolarHBondContact O-N 3.27Å; T239-K242 PolarHBondContact O-N 3.38Å; T239-L243 HydrophobicContact CG2-CD1 3.8Å; T239-L243 HydrophobicContact CG2-CG 4.19Å; T239-L243 WeakPolarHBondContact O-CB 3.49Å; T239-L243 WeakPolarHBondContact O-CG 3.31Å; T239-L243 PolarHBondContact O-N 2.91Å; T239-V259 HydrophobicContact CG2-CB 4.26Å; T239-V259 HydrophobicContact CG2-CG1 4.28Å; T239-V259 HydrophobicContact CG2-CG2 4.01Å; T239-V262 HydrophobicContact CG2-CB 3.96Å; T239-V262 HydrophobicContact CG2-CG1 3.64Å
240V98.5Very high95.8Very high5 Ų532.8 Ų32.83%0.0317%0.166CC..Hα-helixtrans-56.1-47.2172.2173.50000109.4H236 S244 V259 A352 V355 H356H236-V240 VanDerWaalsContact O-CG2 3.24Å; H236-V240 WeakPolarHBondContact O-CG2 3.41Å; H236-V240 PolarHBondContact O-N 3.26Å; V240-S244 WeakPolarHBondContact O-CB 3.48Å; V240-S244 PolarHBondContact O-N 2.05Å; V240-S244 PolarHBondContact O-OG 3.21Å; V240-V259 HydrophobicContact CB-CG2 4.17Å; V240-V259 HydrophobicContact CG2-CB 4.31Å; V240-V259 HydrophobicContact CG2-CG1 3.94Å; V240-V259 HydrophobicContact CG2-CG2 3.58Å; V240-A352 HydrophobicContact CG2-CB 4.49Å; V240-V355 HydrophobicContact CB-CG1 4.2Å; V240-V355 HydrophobicContact CG1-CB 4.16Å; V240-V355 HydrophobicContact CG1-CG1 3.79Å; V240-H356 HydrophobicContact CG1-CB 4Å
241T98.3Very high95.8Very high0 Ų035.7 Ų35.70%018%0.183CC..Hα-helixtrans-59.5-54.5179.7-55.50000110.7A237 I238 T239 L243 S244 Q245 V355 S359 V367 I370A237-T241 WeakPolarHBondContact O-CB 3.19Å; A237-T241 PolarHBondContact O-N 3.13Å; A237-T241 PolarHBondContact O-OG1 2.98Å; I238-T241 WeakPolarHBondContact O-CB 3.33Å; I238-T241 PolarHBondContact O-N 2.88Å; T239-T241 VanDerWaalsContact C-N 3.28Å; T239-T241 PolarHBondContact O-N 3.27Å; T241-L243 PolarHBondContact O-N 3.48Å; T241-S244 PolarHBondContact O-N 3.18Å; T241-Q245 VanDerWaalsContact O-CG 3.29Å; T241-Q245 WeakPolarHBondContact O-CG 3.06Å; T241-Q245 PolarHBondContact O-N 2.94Å; T241-V355 VanDerWaalsContact OG1-CG1 3.23Å; T241-V355 WeakPolarHBondContact OG1-CG1 3.32Å; T241-S359 WeakPolarHBondContact CA-OG 3.46Å; T241-S359 WeakPolarHBondContact CG2-OG 3.37Å; T241-V367 HydrophobicContact CG2-CB 4.18Å; T241-V367 HydrophobicContact CG2-CG1 4.03Å; T241-V367 HydrophobicContact CG2-CG2 3.96Å; T241-I370 HydrophobicContact CG2-CB 3.9Å; T241-I370 HydrophobicContact CG2-CG1 3.96Å; T241-I370 HydrophobicContact CG2-CG2 3.87Å
242K97.3Very high95.9Very high99 Ų9935.6 Ų35.643%0.4317%0.174SC..Hα-helixtrans-60.2-46.8-178.1-72.8-179175-176.80112.6I238 T239 Q245 K246 V367I238-K242 HydrophobicContact CG2-CD 4.16Å; I238-K242 WeakPolarHBondContact O-CG 3.48Å; I238-K242 PolarHBondContact O-N 3.36Å; T239-K242 PolarHBondContact O-N 3.38Å; K242-Q245 PolarHBondContact O-N 2.92Å; K242-K246 WeakPolarHBondContact O-CB 3.41Å; K242-K246 PolarHBondContact O-N 3.27Å; K242-V367 HydrophobicContact CG-CG2 3.79Å
243L97.9Very high96.1Very high21 Ų2137 Ų3711%0.1118%0.183CC..Hα-helixtrans-70.2-36.2-179.1-68.6179.3000112.2T239 T241 Q245 K246 F247 I255 L258 V259 V262T239-L243 HydrophobicContact CG2-CD1 3.8Å; T239-L243 HydrophobicContact CG2-CG 4.19Å; T239-L243 WeakPolarHBondContact O-CB 3.49Å; T239-L243 WeakPolarHBondContact O-CG 3.31Å; T239-L243 PolarHBondContact O-N 2.91Å; T241-L243 PolarHBondContact O-N 3.48Å; L243-Q245 VanDerWaalsContact C-N 3.34Å; L243-K246 PolarHBondContact O-N 3.48Å; L243-F247 HydrophobicContact CD2-CD2 4.3Å; L243-F247 HydrophobicContact CD2-CE2 3.94Å; L243-F247 PolarHBondContact O-N 3.33Å; L243-I255 HydrophobicContact CB-CD1 4.11Å; L243-I255 HydrophobicContact CB-CG2 4.32Å; L243-L258 HydrophobicContact CD1-CB 3.71Å; L243-V259 HydrophobicContact CD1-CG2 3.9Å; L243-V262 HydrophobicContact CD1-CG2 4.48Å
244S98.4Very high96.3Very high0 Ų033 Ų330%017%0.17CC..Hα-helixtrans-70.6-30176.2-55.80000112.8V240 T241 T248 H356 R360V240-S244 WeakPolarHBondContact O-CB 3.48Å; V240-S244 PolarHBondContact O-N 2.05Å; V240-S244 PolarHBondContact O-OG 3.21Å; T241-S244 PolarHBondContact O-N 3.18Å; S244-T248 WeakPolarHBondContact O-CA 3.34Å; S244-H356 WeakPolarHBondContact OG-CA 3.34Å; S244-H356 PolarHBondContact OG-ND1 3.3Å; S244-R360 WeakPolarHBondContact O-CA 3.38Å; S244-R360 WeakPolarHBondContact O-CB 3.46Å
245Q97.3Very high96.3Very high10 Ų1031.1 Ų31.15%0.04716%0.158CC..Hα-helixtrans-75.4-37.3171.2-69.5-179.2-40.900111.7T241 K242 L243 T248 N319 H362 L365T241-Q245 VanDerWaalsContact O-CG 3.29Å; T241-Q245 WeakPolarHBondContact O-CG 3.06Å; T241-Q245 PolarHBondContact O-N 2.94Å; K242-Q245 PolarHBondContact O-N 2.92Å; L243-Q245 VanDerWaalsContact C-N 3.34Å; Q245-T248 WeakPolarHBondContact O-CG2 3.33Å; Q245-N319 VanDerWaalsContact O-CB 3.31Å; Q245-N319 WeakPolarHBondContact O-CB 3.11Å; Q245-H362 PolarHBondContact NE2-O 3.12Å; Q245-L365 PolarHBondContact NE2-O 3.37Å
246K96.6Very high96.2Very high26 Ų2631.7 Ų31.711%0.11316%0.161CC..Hα-helixtrans-71.1-44.2180-170.1175.9-74.3-83.40112K242 L243 I314 I315 A317 D320K242-K246 WeakPolarHBondContact O-CB 3.41Å; K242-K246 PolarHBondContact O-N 3.27Å; L243-K246 PolarHBondContact O-N 3.48Å; K246-I314 PolarHBondContact NZ-O 3.48Å; K246-I315 PolarHBondContact NZ-O 3.23Å; K246-A317 PolarHBondContact NZ-O 3.48Å; K246-D320 WeakPolarHBondContact O-CB 3.22Å; K246-D320 VanDerWaalsContact O-CG 3.26Å; K246-D320 PolarHBondContact O-N 3.12Å; K246-D320 VanDerWaalsContact O-N 3.11Å
247F97.1Very high96.1Very high0 Ų031.9 Ų31.90%016%0.161CC..SBendtrans-115.865.4-175.9-51.7-48.1000110.4L243 K249 V250 I255 L258 I288 L295 I299L243-F247 HydrophobicContact CD2-CD2 4.3Å; L243-F247 HydrophobicContact CD2-CE2 3.94Å; L243-F247 PolarHBondContact O-N 3.33Å; F247-K249 PolarHBondContact O-N 2.94Å; F247-V250 HydrophobicContact CB-CB 4.17Å; F247-V250 HydrophobicContact CB-CG2 3.59Å; F247-V250 WeakPolarHBondContact O-CB 3.05Å; F247-V250 PolarHBondContact O-N 2.8Å; F247-V250 VanDerWaalsContact O-N 3.1Å; F247-I255 HydrophobicContact CB-CD1 4.28Å; F247-I255 HydrophobicContact CD2-CD1 4.43Å; F247-L258 HydrophobicContact CD2-CD1 4.46Å; F247-L258 HydrophobicContact CE2-CD1 4.45Å; F247-I288 HydrophobicContact CZ-CG2 4.09Å; F247-L295 HydrophobicContact CD1-CB 4.11Å; F247-L295 HydrophobicContact CE1-CB 4.31Å; F247-L295 HydrophobicContact CG-CB 4.38Å; F247-I299 HydrophobicContact CE1-CD1 4.43Å; F247-I299 HydrophobicContact CE1-CG2 4.49Å
248T96.3Very high95.9Very high0 Ų030.6 Ų30.60%015%0.15CC..THydrogen-bonded Turntrans-63.5-17.8-167.4640000114.1S244 Q245 D320 E321 P323 R360 P363S244-T248 WeakPolarHBondContact O-CA 3.34Å; Q245-T248 WeakPolarHBondContact O-CG2 3.33Å; T248-D320 HydrophobicContact CG2-CB 3.93Å; T248-D320 WeakPolarHBondContact OG1-CB 3.44Å; T248-E321 WeakPolarHBondContact CB-O 3.33Å; T248-E321 PolarHBondContact OG1-O 3.43Å; T248-P323 WeakPolarHBondContact O-CG 3.49Å; T248-R360 PolarHBondContact O-NE 2.04Å; T248-R360 PolarHBondContact O-NH2 2.67Å; T248-P363 HydrophobicContact CG2-CB 4.39Å
249K93.7Very high95.8Very high129 Ų12930.3 Ų30.356%0.56115%0.149SC*.THydrogen-bonded Turntrans-88.5-17-179.4-64.4174.8-172.7166.70113.4F247 R360F247-K249 PolarHBondContact O-N 2.94Å; K249-R360 PolarHBondContact O-NH2 3.04Å; K249-R360 VanDerWaalsContact O-NH2 3.12Å
250V95Very high95.6Very high11 Ų1130.8 Ų30.87%0.06715%0.151CC..SBendtrans-74.7147.7-173.6-177.30000110.8F247 E254 I255 L295 H356 R360F247-V250 HydrophobicContact CB-CB 4.17Å; F247-V250 HydrophobicContact CB-CG2 3.59Å; F247-V250 WeakPolarHBondContact O-CB 3.05Å; F247-V250 PolarHBondContact O-N 2.8Å; F247-V250 VanDerWaalsContact O-N 3.1Å; V250-E254 HydrophobicContact CG1-CB 3.61Å; V250-E254 HydrophobicContact CG1-CG 3.75Å; V250-I255 HydrophobicContact CB-CD1 3.95Å; V250-I255 HydrophobicContact CB-CG1 4.15Å; V250-I255 HydrophobicContact CG1-CD1 3.87Å; V250-I255 HydrophobicContact CG1-CG1 3.91Å; V250-L295 HydrophobicContact CB-CD2 4.49Å; V250-L295 HydrophobicContact CG1-CD2 4.12Å; V250-L295 HydrophobicContact CG2-CB 4.47Å; V250-L295 HydrophobicContact CG2-CD2 3.53Å; V250-H356 PolarHBondContact O-CE1 3.23Å; V250-H356 PolarHBondContact O-NE2 2.98Å; V250-R360 PolarHBondContact O-NH2 3.39Å
251N94.3Very high95.4Very high93 Ų9330.6 Ų30.650%0.49715%0.15SC..  trans-80.3162.9178.768.855.1000112T253 E254 I255N251-T253 VanDerWaalsContact C-N 3.34Å; N251-T253 PolarHBondContact O-N 2.86Å; N251-T253 PolarHBondContact OD1-N 2.8Å; N251-T253 VanDerWaalsContact OD1-N 3.14Å; N251-E254 PolarHBondContact O-N 3.49Å; N251-E254 PolarHBondContact OD1-N 2.88Å; N251-I255 WeakPolarHBondContact O-CG1 3.27Å; N251-I255 PolarHBondContact O-N 3.21Å; N251-I255 VanDerWaalsContact O-N 3.08Å
252F95.2Very high95.2Very high28 Ų2831.9 Ų31.912%0.12316%0.158CC..Hα-helixtrans-60.2-39.3-176.9178-120.1000113.7E254 I255 Q256 I349 A352 H356F252-E254 PolarHBondContact O-N 3.44Å; F252-I255 PolarHBondContact O-N 2.82Å; F252-Q256 VanDerWaalsContact CE1-OE1 3.27Å; F252-Q256 HydrophobicContact CE2-CB 4.29Å; F252-Q256 HydrophobicContact CZ-CB 4.28Å; F252-Q256 HydrophobicContact CZ-CG 4.37Å; F252-Q256 VanDerWaalsContact O-CB 3.27Å; F252-Q256 WeakPolarHBondContact O-CB 3.06Å; F252-Q256 PolarHBondContact O-N 3.5Å; F252-I349 HydrophobicContact CE1-CG2 4.08Å; F252-A352 VanDerWaalsContact CE2-C 3.49Å; F252-A352 HydrophobicContact CE2-CB 3.94Å; F252-A352 HydrophobicContact CZ-CB 3.77Å; F252-H356 HydrophobicContact CD2-CB 3.58Å; F252-H356 AromaticContact CD2-CG 3.83Å; F252-H356 HydrophobicContact CE2-CB 4.2Å; F252-H356 HydrophobicContact CG-CB 4.49Å; F252-H356 PolarHBondContact N-NE2 3.29Å
253T93.4Very high95.1Very high98 Ų9827.4 Ų27.460%0.60114%0.139SC*.Hα-helixtrans-61.5-45.2-178.2-57.20000111.6N251 Q256 K257N251-T253 VanDerWaalsContact C-N 3.34Å; N251-T253 PolarHBondContact O-N 2.86Å; N251-T253 PolarHBondContact OD1-N 2.8Å; N251-T253 VanDerWaalsContact OD1-N 3.14Å; T253-Q256 PolarHBondContact O-N 3.28Å; T253-K257 PolarHBondContact O-N 2.71Å
254E93.8Very high94.8Very high43 Ų4328 Ų2820%0.20114%0.141CC..Hα-helixtrans-70.1-39.7178.4-171.355.6-12500111.7V250 N251 F252 Q256 K257 L258 Y287 L295V250-E254 HydrophobicContact CG1-CB 3.61Å; V250-E254 HydrophobicContact CG1-CG 3.75Å; N251-E254 PolarHBondContact O-N 3.49Å; N251-E254 PolarHBondContact OD1-N 2.88Å; F252-E254 PolarHBondContact O-N 3.44Å; E254-Q256 VanDerWaalsContact C-N 3.34Å; E254-Q256 PolarHBondContact O-N 3.24Å; E254-K257 WeakPolarHBondContact O-CB 3.5Å; E254-K257 PolarHBondContact O-N 2.77Å; E254-L258 PolarHBondContact O-N 3.11Å; E254-L258 VanDerWaalsContact O-N 3.15Å; E254-Y287 VanDerWaalsContact CD-OH 3.25Å; E254-Y287 WeakPolarHBondContact OE1-CE1 3.46Å; E254-Y287 PolarHBondContact OE1-OH 2.89Å; E254-Y287 PolarHBondContact OE2-OH 3.44Å; E254-L295 HydrophobicContact CG-CD2 4.49Å
255I96.1Very high94.6Very high0 Ų028.8 Ų28.80%015%0.146CC..Hα-helixtrans-60-45.6171.6-68.8-58.3000111L243 F247 V250 N251 F252 K257 L258 V259L243-I255 HydrophobicContact CB-CD1 4.11Å; L243-I255 HydrophobicContact CB-CG2 4.32Å; F247-I255 HydrophobicContact CB-CD1 4.28Å; F247-I255 HydrophobicContact CD2-CD1 4.43Å; V250-I255 HydrophobicContact CB-CD1 3.95Å; V250-I255 HydrophobicContact CB-CG1 4.15Å; V250-I255 HydrophobicContact CG1-CD1 3.87Å; V250-I255 HydrophobicContact CG1-CG1 3.91Å; N251-I255 WeakPolarHBondContact O-CG1 3.27Å; N251-I255 PolarHBondContact O-N 3.21Å; N251-I255 VanDerWaalsContact O-N 3.08Å; F252-I255 PolarHBondContact O-N 2.82Å; I255-K257 VanDerWaalsContact C-N 3.29Å; I255-K257 PolarHBondContact O-N 2.93Å; I255-L258 PolarHBondContact O-N 3.33Å; I255-V259 HydrophobicContact CG2-CG2 4.02Å; I255-V259 WeakPolarHBondContact O-CG2 3.41Å; I255-V259 PolarHBondContact O-N 3.41Å
256Q94.1Very high94.5Very high21 Ų2130.4 Ų30.410%0.09815%0.153CC..Hα-helixtrans-63.4-38-177.8-172.2173.811.400111.5I28 F252 T253 E254 V259 L260I28-Q256 HydrophobicContact CD1-CB 4.48Å; I28-Q256 HydrophobicContact CD1-CG 3.65Å; F252-Q256 VanDerWaalsContact CE1-OE1 3.27Å; F252-Q256 HydrophobicContact CE2-CB 4.29Å; F252-Q256 HydrophobicContact CZ-CB 4.28Å; F252-Q256 HydrophobicContact CZ-CG 4.37Å; F252-Q256 VanDerWaalsContact O-CB 3.27Å; F252-Q256 WeakPolarHBondContact O-CB 3.06Å; F252-Q256 PolarHBondContact O-N 3.5Å; T253-Q256 PolarHBondContact O-N 3.28Å; E254-Q256 VanDerWaalsContact C-N 3.34Å; E254-Q256 PolarHBondContact O-N 3.24Å; Q256-V259 PolarHBondContact O-N 3.12Å; Q256-L260 WeakPolarHBondContact O-CG 3.29Å; Q256-L260 PolarHBondContact O-N 3.01Å; Q256-L260 VanDerWaalsContact O-N 3.15Å
257K91.8Very high94.4Very high40 Ų4032.6 Ų32.617%0.17416%0.164CC..Hα-helixtrans-57.1-54.4172.5-168.8-169.5-166-158.80111.4I28 A29 I31 T253 E254 I255 V259 L260 D261I28-K257 HydrophobicContact CG2-CB 4.39Å; I28-K257 HydrophobicContact CG2-CG 4.49Å; A29-K257 VanDerWaalsContact O-CE 3.25Å; A29-K257 WeakPolarHBondContact O-CE 3.36Å; A29-K257 WeakPolarHBondContact O-CG 3.29Å; I31-K257 HydrophobicContact CD1-CD 3.99Å; I31-K257 HydrophobicContact CD1-CG 4.18Å; I31-K257 HydrophobicContact CG1-CD 3.69Å; I31-K257 HydrophobicContact CG1-CG 4.05Å; I31-K257 VanDerWaalsContact CG1-NZ 3.31Å; T253-K257 PolarHBondContact O-N 2.71Å; E254-K257 WeakPolarHBondContact O-CB 3.5Å; E254-K257 PolarHBondContact O-N 2.77Å; I255-K257 VanDerWaalsContact C-N 3.29Å; I255-K257 PolarHBondContact O-N 2.93Å; K257-V259 VanDerWaalsContact C-N 3.29Å; K257-V259 PolarHBondContact O-N 3.44Å; K257-L260 PolarHBondContact O-N 3.1Å; K257-D261 PolarHBondContact O-N 3.42Å
258L94.7Very high94.3Very high1 Ų133.9 Ų33.91%0.00517%0.17CC..Hα-helixtrans-60.2-37.8177.4-71.1169.9000112.6I31 L243 F247 E254 I255 L260 D261 V262 Y287 I288 L295I31-L258 HydrophobicContact CD1-CD2 3.62Å; I31-L258 HydrophobicContact CD1-CG 4.36Å; L243-L258 HydrophobicContact CD1-CB 3.71Å; F247-L258 HydrophobicContact CD2-CD1 4.46Å; F247-L258 HydrophobicContact CE2-CD1 4.45Å; E254-L258 PolarHBondContact O-N 3.11Å; E254-L258 VanDerWaalsContact O-N 3.15Å; I255-L258 PolarHBondContact O-N 3.33Å; L258-L260 VanDerWaalsContact C-N 3.34Å; L258-L260 PolarHBondContact O-N 2.93Å; L258-D261 PolarHBondContact O-N 3.4Å; L258-V262 VanDerWaalsContact O-CB 3.25Å; L258-V262 WeakPolarHBondContact O-CB 3.33Å; L258-V262 WeakPolarHBondContact O-CG2 3.39Å; L258-V262 PolarHBondContact O-N 3.39Å; L258-Y287 HydrophobicContact CD2-CD1 3.85Å; L258-Y287 HydrophobicContact CD2-CE1 3.96Å; L258-I288 HydrophobicContact CD2-CG1 4.16Å; L258-L295 HydrophobicContact CD1-CD2 4.44Å
259V95.5Very high94.3Very high3 Ų334.4 Ų34.42%0.01817%0.173CC..Hα-helixtrans-59.6-45.7178.41650000111.5H236 T239 V240 L243 I255 Q256 K257 A263H236-V259 HydrophobicContact CB-CG1 4.09Å; T239-V259 HydrophobicContact CG2-CB 4.26Å; T239-V259 HydrophobicContact CG2-CG1 4.28Å; T239-V259 HydrophobicContact CG2-CG2 4.01Å; V240-V259 HydrophobicContact CB-CG2 4.17Å; V240-V259 HydrophobicContact CG2-CB 4.31Å; V240-V259 HydrophobicContact CG2-CG1 3.94Å; V240-V259 HydrophobicContact CG2-CG2 3.58Å; L243-V259 HydrophobicContact CD1-CG2 3.9Å; I255-V259 HydrophobicContact CG2-CG2 4.02Å; I255-V259 WeakPolarHBondContact O-CG2 3.41Å; I255-V259 PolarHBondContact O-N 3.41Å; Q256-V259 PolarHBondContact O-N 3.12Å; K257-V259 VanDerWaalsContact C-N 3.29Å; K257-V259 PolarHBondContact O-N 3.44Å; V259-A263 VanDerWaalsContact O-CB 3.27Å; V259-A263 WeakPolarHBondContact O-CB 3.4Å; V259-A263 PolarHBondContact O-N 3.37Å
260L92.7Very high94.4Very high18 Ų1828.9 Ų28.99%0.09415%0.151CC..Hα-helixtrans-66.8-46-177.9-66.9172.6000110.7N24 Y26 I28 Q256 K257 L258 V262 A263 H264N24-L260 HydrophobicContact CB-CD1 4.12Å; N24-L260 WeakPolarHBondContact ND2-CD1 3.29Å; Y26-L260 HydrophobicContact CD2-CD2 4.42Å; I28-L260 HydrophobicContact CB-CD1 4.14Å; I28-L260 HydrophobicContact CD1-CD1 3.98Å; I28-L260 HydrophobicContact CG2-CD1 4.44Å; Q256-L260 WeakPolarHBondContact O-CG 3.29Å; Q256-L260 PolarHBondContact O-N 3.01Å; Q256-L260 VanDerWaalsContact O-N 3.15Å; K257-L260 PolarHBondContact O-N 3.1Å; L258-L260 VanDerWaalsContact C-N 3.34Å; L258-L260 PolarHBondContact O-N 2.93Å; L260-V262 PolarHBondContact O-N 2.99Å; L260-A263 PolarHBondContact O-N 3.02Å; L260-H264 WeakPolarHBondContact O-CB 3.3Å; L260-H264 PolarHBondContact O-N 2.97Å
261D93.3Very high94.4Very high1 Ų131.9 Ų31.91%0.00516%0.161CC..Hα-helixtrans-65.4-41.3178.6-65.2-21.1000111.2S30 I31 L32 K257 L258 H264 V265 I284S30-D261 WeakPolarHBondContact CB-OD1 3.49Å; S30-D261 PolarHBondContact OG-OD1 3.31Å; I31-D261 WeakPolarHBondContact CB-OD2 3.47Å; I31-D261 WeakPolarHBondContact CD1-OD2 3.24Å; I31-D261 VanDerWaalsContact CG1-OD2 3.24Å; I31-D261 WeakPolarHBondContact CG1-OD2 3.43Å; I31-D261 PolarHBondContact N-OD2 3.46Å; L32-D261 HydrophobicContact CD1-CB 4.33Å; L32-D261 HydrophobicContact CG-CB 4.28Å; K257-D261 PolarHBondContact O-N 3.42Å; L258-D261 PolarHBondContact O-N 3.4Å; D261-H264 WeakPolarHBondContact O-CB 3.27Å; D261-H264 PolarHBondContact O-N 2.84Å; D261-V265 PolarHBondContact O-N 3.11Å; D261-I284 VanDerWaalsContact C-CD1 3.41Å; D261-I284 HydrophobicContact CB-CD1 3.78Å; D261-I284 HydrophobicContact CB-CG1 4.08Å; D261-I284 WeakPolarHBondContact O-CD1 2.95Å
262V95Very high94.5Very high28 Ų2827.5 Ų27.517%0.1714%0.138CC..Hα-helixtrans-64.3-43.2176.1167.60000111.3T239 L243 L258 L260 H264 V265 H266 I284T239-V262 HydrophobicContact CG2-CB 3.96Å; T239-V262 HydrophobicContact CG2-CG1 3.64Å; L243-V262 HydrophobicContact CD1-CG2 4.48Å; L258-V262 VanDerWaalsContact O-CB 3.25Å; L258-V262 WeakPolarHBondContact O-CB 3.33Å; L258-V262 WeakPolarHBondContact O-CG2 3.39Å; L258-V262 PolarHBondContact O-N 3.39Å; L260-V262 PolarHBondContact O-N 2.99Å; V262-H264 VanDerWaalsContact C-N 3.28Å; V262-H264 PolarHBondContact O-N 2.68Å; V262-V265 PolarHBondContact O-N 3.33Å; V262-H266 PolarHBondContact O-CD2 3.26Å; V262-H266 PolarHBondContact O-N 2.88Å; V262-I284 HydrophobicContact CG2-CD1 4.03Å; V262-I284 HydrophobicContact CG2-CG2 4.14Å
263A94.3Very high94.4Very high4 Ų426.3 Ų26.33%0.03313%0.133CC..Hα-helixtrans-61.9-39.3176.700000111.8F235 H236 V259 L260 H266 E267F235-A263 HydrophobicContact CD1-CB 4.02Å; F235-A263 HydrophobicContact CE1-CB 4.33Å; H236-A263 WeakPolarHBondContact CD2-CB 3.31Å; H236-A263 VanDerWaalsContact NE2-CB 3.3Å; H236-A263 WeakPolarHBondContact NE2-CB 3.36Å; V259-A263 VanDerWaalsContact O-CB 3.27Å; V259-A263 WeakPolarHBondContact O-CB 3.4Å; V259-A263 PolarHBondContact O-N 3.37Å; L260-A263 PolarHBondContact O-N 3.02Å; A263-H266 PolarHBondContact O-N 3.27Å; A263-E267 PolarHBondContact O-N 3.47Å
264H92.9Very high94.5Very high35 Ų3521.9 Ų21.916%0.16211%0.106CC..Hα-helixtrans-62.7-44.9175.5-171.754.3000112.5H22 L260 D261 V262 H266 E267 H268 D280H22-H264 AromaticContact CE1-CD2 3.27Å; H22-H264 PolarHBondContact CE1-CD2 2.96Å; H22-H264 AromaticContact CE1-CE1 3.37Å; H22-H264 PolarHBondContact CE1-CE1 3.41Å; H22-H264 AromaticContact CE1-CG 3.48Å; H22-H264 VanDerWaalsContact CE1-CG 3.48Å; H22-H264 AromaticContact CE1-ND1 3.54Å; H22-H264 AromaticContact CE1-NE2 3.16Å; H22-H264 PolarHBondContact CE1-NE2 3.13Å; H22-H264 AromaticContact ND1-NE2 3.89Å; H22-H264 AromaticContact NE2-CD2 3.48Å; H22-H264 PolarHBondContact NE2-CD2 3Å; H22-H264 AromaticContact NE2-CG 3.5Å; H22-H264 AromaticContact NE2-ND1 3.93Å; H22-H264 AromaticContact NE2-NE2 3.87Å; L260-H264 WeakPolarHBondContact O-CB 3.3Å; L260-H264 PolarHBondContact O-N 2.97Å; D261-H264 WeakPolarHBondContact O-CB 3.27Å; D261-H264 PolarHBondContact O-N 2.84Å; V262-H264 VanDerWaalsContact C-N 3.28Å; V262-H264 PolarHBondContact O-N 2.68Å; H264-H266 VanDerWaalsContact C-N 3.34Å; H264-H266 PolarHBondContact O-N 2.83Å; H264-E267 WeakPolarHBondContact O-CB 3.22Å; H264-E267 PolarHBondContact O-N 3.21Å; H264-E267 VanDerWaalsContact O-N 3.11Å; H264-H268 AromaticContact CD2-CD2 3.83Å; H264-H268 AromaticContact CD2-NE2 3.7Å; H264-H268 AromaticContact CE1-CD2 3.76Å; H264-H268 AromaticContact CE1-CE1 3.73Å; H264-H268 AromaticContact CE1-NE2 3.13Å; H264-H268 PolarHBondContact CE1-NE2 3.28Å; H264-H268 AromaticContact NE2-CD2 3.49Å; H264-H268 PolarHBondContact NE2-CD2 3.29Å; H264-H268 AromaticContact NE2-CE1 3.87Å; H264-H268 AromaticContact NE2-NE2 2.89Å; H264-H268 PolarHBondContact NE2-NE2 3.45Å; H264-H268 PolarHBondContact O-N 2.81Å; H264-H268 VanDerWaalsContact O-N 3.08Å; H264-D280 IonicContact CD2-OD2 3.33Å
265V93.8Very high94.3Very high16 Ų1619.9 Ų19.910%0.09710%0.096CC..Hα-helixtrans-58.9-45.9174170.80000111.4D261 V262 E267 H268 C269 D280 I284D261-V265 PolarHBondContact O-N 3.11Å; V262-V265 PolarHBondContact O-N 3.33Å; V265-E267 VanDerWaalsContact C-N 3.26Å; V265-E267 PolarHBondContact O-N 3.04Å; V265-H268 PolarHBondContact O-N 3.49Å; V265-C269 WeakPolarHBondContact O-CB 3.44Å; V265-C269 PolarHBondContact O-N 2.04Å; V265-C269 PolarHBondContact O-SG 2.81Å; V265-D280 HydrophobicContact CG2-CB 3.5Å; V265-D280 VanDerWaalsContact CG2-CB 3.5Å; V265-I284 HydrophobicContact CB-CD1 4.34Å; V265-I284 HydrophobicContact CG2-CD1 3.48Å; V265-I284 VanDerWaalsContact CG2-CD1 3.48Å; V265-I284 HydrophobicContact CG2-CG1 4.49Å
266H95.9Very high94.1Very high44 Ų4420.9 Ų20.920%0.20410%0.102CC..Hα-helixtrans-61.3-36.2176.9-84.1-80.9000112.1Y174 F235 V262 A263 H264 C270Y174-H266 AromaticContact CE2-CE1 3.66Å; Y174-H266 AromaticContact CE2-ND1 3.42Å; Y174-H266 WeakPolarHBondContact CE2-ND1 3.31Å; Y174-H266 AromaticContact CZ-ND1 3.53Å; Y174-H266 PolarHBondContact OH-ND1 2.8Å; F235-H266 HydrophobicContact CE1-CB 3.72Å; F235-H266 AromaticContact CE1-CD2 3.63Å; F235-H266 AromaticContact CE1-CG 3.71Å; F235-H266 HydrophobicContact CZ-CB 3.67Å; F235-H266 AromaticContact CZ-CD2 3.42Å; F235-H266 VanDerWaalsContact CZ-CD2 3.42Å; F235-H266 WeakPolarHBondContact CZ-CD2 3.5Å; F235-H266 AromaticContact CZ-CE1 3.97Å; F235-H266 AromaticContact CZ-CG 3.33Å; F235-H266 AromaticContact CZ-ND1 3.68Å; F235-H266 AromaticContact CZ-NE2 3.82Å; V262-H266 PolarHBondContact O-CD2 3.26Å; V262-H266 PolarHBondContact O-N 2.88Å; A263-H266 PolarHBondContact O-N 3.27Å; H264-H266 VanDerWaalsContact C-N 3.34Å; H264-H266 PolarHBondContact O-N 2.83Å; H266-C270 WeakPolarHBondContact O-CB 3.48Å; H266-C270 PolarHBondContact O-N 2.95Å; H266-C270 PolarHBondContact O-SG 3.34Å
267E94.6Very high94Very high71 Ų7120 Ų2033%0.33210%0.098SC..Hα-helixtrans-58.3-55173.4-171.5174.3-17700111.8M227 A263 H264 V265 C269 C270 R271M227-E267 VanDerWaalsContact CE-CA 3.48Å; M227-E267 HydrophobicContact CE-CB 4.18Å; M227-E267 HydrophobicContact CE-CG 4.46Å; M227-E267 HydrophobicContact SD-CB 4.48Å; A263-E267 PolarHBondContact O-N 3.47Å; H264-E267 WeakPolarHBondContact O-CB 3.22Å; H264-E267 PolarHBondContact O-N 3.21Å; H264-E267 VanDerWaalsContact O-N 3.11Å; V265-E267 VanDerWaalsContact C-N 3.26Å; V265-E267 PolarHBondContact O-N 3.04Å; E267-C269 PolarHBondContact O-N 3.12Å; E267-C270 PolarHBondContact O-N 3.46Å; E267-R271 HydrophobicContact CG-CG 4.45Å; E267-R271 WeakPolarHBondContact O-CB 3.05Å; E267-R271 VanDerWaalsContact O-CG 3.28Å; E267-R271 WeakPolarHBondContact O-CG 3.1Å; E267-R271 PolarHBondContact O-N 2.04Å; E267-R271 IonicContact OE1-NH1 3.4Å
268H94Very high94Very high27 Ų2718.7 Ų18.713%0.1259%0.093CC..Hα-helixtrans-54.9-51.9176.2-76-44.6000112.2H264 V265 C270 R271 G272 D273 D276 C277 D280H264-H268 AromaticContact CD2-CD2 3.83Å; H264-H268 AromaticContact CD2-NE2 3.7Å; H264-H268 AromaticContact CE1-CD2 3.76Å; H264-H268 AromaticContact CE1-CE1 3.73Å; H264-H268 AromaticContact CE1-NE2 3.13Å; H264-H268 PolarHBondContact CE1-NE2 3.28Å; H264-H268 AromaticContact NE2-CD2 3.49Å; H264-H268 PolarHBondContact NE2-CD2 3.29Å; H264-H268 AromaticContact NE2-CE1 3.87Å; H264-H268 AromaticContact NE2-NE2 2.89Å; H264-H268 PolarHBondContact NE2-NE2 3.45Å; H264-H268 PolarHBondContact O-N 2.81Å; H264-H268 VanDerWaalsContact O-N 3.08Å; V265-H268 PolarHBondContact O-N 3.49Å; H268-C270 VanDerWaalsContact C-N 3.33Å; H268-C270 PolarHBondContact O-N 2.99Å; H268-R271 CarbonylContact O-C 3.21Å; H268-R271 PolarHBondContact O-N 3.5Å; H268-G272 PolarHBondContact O-N 2.85Å; H268-D273 HydrophobicContact CB-CB 4.05Å; H268-D273 IonicContact ND1-OD2 2.85Å; H268-D273 PolarHBondContact O-N 3.49Å; H268-D276 HydrophobicContact CB-CB 4.29Å; H268-D276 IonicContact CE1-OD2 2.64Å; H268-D276 IonicContact NE2-OD2 3.7Å; H268-C277 HydrophobicContact CB-CB 4.43Å; H268-D280 IonicContact CD2-OD2 3.54Å; H268-D280 IonicContact NE2-OD2 3.52Å
269C96.6Very high93.7Very high11 Ų1118.7 Ų18.77%0.0749%0.093CC..Hα-helixtrans-59.8-42-179.7-60.80000112.5Y174 V265 E267 G272 C277Y174-C269 HydrophobicContact CD1-CB 3.46Å; Y174-C269 VanDerWaalsContact CD1-CB 3.46Å; Y174-C269 HydrophobicContact CD2-CB 3.81Å; Y174-C269 HydrophobicContact CE1-CB 3.42Å; Y174-C269 VanDerWaalsContact CE1-CB 3.42Å; Y174-C269 HydrophobicContact CE2-CB 3.78Å; Y174-C269 HydrophobicContact CG-CB 3.65Å; V265-C269 WeakPolarHBondContact O-CB 3.44Å; V265-C269 PolarHBondContact O-N 2.04Å; V265-C269 PolarHBondContact O-SG 2.81Å; E267-C269 PolarHBondContact O-N 3.12Å; C269-G272 PolarHBondContact O-N 3.25Å; C269-C277 VanDerWaalsContact CA-SG 3.55Å; C269-C277 HydrophobicContact CB-CB 3.87Å; C269-C277 WeakPolarHBondContact CB-SG 3.5Å; C269-C277 WeakPolarHBondContact SG-CB 3.18Å; C269-C277 CovalentContact SG-SG 2.02Å; C269-C277 PolarHBondContact SG-SG 3.13Å
270C96.3Very high93.4Very high13 Ų1319.1 Ų19.19%0.08810%0.095CC..Hα-helixtrans-72.7-28.8179.5-69.80000113.3Y174 C224 M227 H266 E267 H268Y174-C270 PolarHBondContact OH-SG 2.89Å; C224-C270 WeakPolarHBondContact CA-SG 3.42Å; C224-C270 HydrophobicContact CB-CB 3.73Å; C224-C270 WeakPolarHBondContact CB-SG 3.34Å; C224-C270 WeakPolarHBondContact SG-CA 3.43Å; C224-C270 WeakPolarHBondContact SG-CB 3.36Å; C224-C270 CovalentContact SG-SG 2.04Å; C224-C270 PolarHBondContact SG-SG 3.25Å; M227-C270 HydrophobicContact CE-CB 3.62Å; H266-C270 WeakPolarHBondContact O-CB 3.48Å; H266-C270 PolarHBondContact O-N 2.95Å; H266-C270 PolarHBondContact O-SG 3.34Å; E267-C270 PolarHBondContact O-N 3.46Å; H268-C270 VanDerWaalsContact C-N 3.33Å; H268-C270 PolarHBondContact O-N 2.99Å
271R95.3Very high93.3Very high74 Ų7419 Ų1928%0.27910%0.098SC..Hα-helixtrans-82-0.5172.6-67.6-174.473.4141.22.3112.9H122 L126 E267 H268 D273H122-R271 PolarHBondContact CE1-NE 3.37Å; H122-R271 PolarHBondContact CE1-O 2.94Å; H122-R271 PolarHBondContact ND1-NH2 3.09Å; H122-R271 VanDerWaalsContact ND1-NH2 3.2Å; H122-R271 PolarHBondContact NE2-O 3.43Å; L126-R271 HydrophobicContact CD1-CB 4.31Å; L126-R271 HydrophobicContact CD1-CG 4.4Å; L126-R271 WeakPolarHBondContact CD2-O 3.32Å; E267-R271 HydrophobicContact CG-CG 4.45Å; E267-R271 WeakPolarHBondContact O-CB 3.05Å; E267-R271 VanDerWaalsContact O-CG 3.28Å; E267-R271 WeakPolarHBondContact O-CG 3.1Å; E267-R271 PolarHBondContact O-N 2.04Å; E267-R271 IonicContact OE1-NH1 3.4Å; H268-R271 CarbonylContact O-C 3.21Å; H268-R271 PolarHBondContact O-N 3.5Å; R271-D273 VanDerWaalsContact C-N 3.28Å; R271-D273 PolarHBondContact O-N 3.32Å
272G94.4Very high93.1Very high1 Ų119.4 Ų19.41%0.0110%0.1CC..THydrogen-bonded Turntrans73.819.3178.400000113.8F50 H268 C269 V274F50-G272 WeakPolarHBondContact CD2-O 3.47Å; H268-G272 PolarHBondContact O-N 2.85Å; C269-G272 PolarHBondContact O-N 3.25Å; G272-V274 VanDerWaalsContact C-N 3.27Å; G272-V274 PolarHBondContact O-N 3.42Å
273D94.8Very high92.8Very high4 Ų418.4 Ų18.42%0.0219%0.093CC..  trans-7684.6167.1-165.2-33000108.7N89 L91 H268 R271 L275 D276 C277N89-D273 VanDerWaalsContact CG-OD2 3.31Å; N89-D273 PolarHBondContact ND2-OD2 3.03Å; N89-D273 PolarHBondContact OD1-OD2 3.43Å; L91-D273 HydrophobicContact CD2-CB 4.24Å; H268-D273 HydrophobicContact CB-CB 4.05Å; H268-D273 IonicContact ND1-OD2 2.85Å; H268-D273 PolarHBondContact O-N 3.49Å; R271-D273 VanDerWaalsContact C-N 3.28Å; R271-D273 PolarHBondContact O-N 3.32Å; D273-L275 VanDerWaalsContact C-N 3.25Å; D273-L275 PolarHBondContact O-N 2.02Å; D273-D276 PolarHBondContact OD1-N 2.89Å; D273-D276 VanDerWaalsContact OD1-N 3.13Å; D273-C277 WeakPolarHBondContact O-CB 3.3Å; D273-C277 PolarHBondContact O-N 3.07Å
274V94.4Very high92.7Very high5 Ų518.5 Ų18.53%0.039%0.093CC..Hα-helixtrans-66.5-27.3-171.3-65.30000113L46 I49 F50 F94 A175 G272 L278L46-V274 HydrophobicContact CB-CG2 4.03Å; L46-V274 HydrophobicContact CD2-CB 4.26Å; L46-V274 HydrophobicContact CD2-CG2 4.44Å; I49-V274 HydrophobicContact CB-CG1 4.49Å; I49-V274 HydrophobicContact CG2-CG1 3.88Å; F50-V274 HydrophobicContact CB-CG1 4.26Å; F50-V274 HydrophobicContact CB-CG2 4.13Å; F94-V274 HydrophobicContact CD2-CG2 4.44Å; F94-V274 HydrophobicContact CE2-CG2 3.82Å; A175-V274 HydrophobicContact CB-CB 3.91Å; A175-V274 HydrophobicContact CB-CG1 4.19Å; G272-V274 VanDerWaalsContact C-N 3.27Å; G272-V274 PolarHBondContact O-N 3.42Å; V274-L278 PolarHBondContact O-N 3.47Å
275L90.8Very high92.7Very high0 Ų018.5 Ų18.50%09%0.094CC..Hα-helixtrans-81.4-53-177.2-179.362.8000110.7I41 L46 L87 E88 Q90 D273 C277 L278 Q279I41-L275 HydrophobicContact CD1-CD1 4.13Å; I41-L275 HydrophobicContact CG2-CD1 3.86Å; L46-L275 HydrophobicContact CD1-CB 4.46Å; L46-L275 HydrophobicContact CD1-CD1 3.66Å; L87-L275 HydrophobicContact CB-CD2 3.96Å; E88-L275 VanDerWaalsContact O-CD2 3.25Å; E88-L275 WeakPolarHBondContact O-CD2 3.37Å; Q90-L275 HydrophobicContact CB-CD2 4.22Å; Q90-L275 HydrophobicContact CG-CD2 3.63Å; D273-L275 VanDerWaalsContact C-N 3.25Å; D273-L275 PolarHBondContact O-N 2.02Å; L275-C277 VanDerWaalsContact C-N 3.29Å; L275-C277 PolarHBondContact O-N 3.39Å; L275-L278 PolarHBondContact O-N 3.2Å; L275-Q279 HydrophobicContact CD1-CG 4.11Å; L275-Q279 HydrophobicContact CG-CG 4.44Å; L275-Q279 PolarHBondContact O-N 3.24Å
276D90.1Very high92.5Very high22 Ų2218.3 Ų18.312%0.1189%0.093CC..Hα-helixtrans-66.8-35.8179.7-73-6.1000110.2N89 H268 D273 L278 Q279 D280N89-D276 PolarHBondContact ND2-OD2 3.27Å; H268-D276 HydrophobicContact CB-CB 4.29Å; H268-D276 IonicContact CE1-OD2 2.64Å; H268-D276 IonicContact NE2-OD2 3.7Å; D273-D276 PolarHBondContact OD1-N 2.89Å; D273-D276 VanDerWaalsContact OD1-N 3.13Å; D276-L278 VanDerWaalsContact C-N 3.27Å; D276-L278 PolarHBondContact O-N 2.64Å; D276-Q279 PolarHBondContact O-N 3.05Å; D276-D280 VanDerWaalsContact O-CB 3.31Å; D276-D280 WeakPolarHBondContact O-CB 3.49Å; D276-D280 PolarHBondContact O-N 3.3Å
277C93.3Very high92.3Very high2 Ų217.4 Ų17.41%0.0149%0.088CC..Hα-helixtrans-53.4-41.6169.8174.80000113.1H268 C269 D273 L275 G281H268-C277 HydrophobicContact CB-CB 4.43Å; C269-C277 VanDerWaalsContact CA-SG 3.55Å; C269-C277 HydrophobicContact CB-CB 3.87Å; C269-C277 WeakPolarHBondContact CB-SG 3.5Å; C269-C277 WeakPolarHBondContact SG-CB 3.18Å; C269-C277 CovalentContact SG-SG 2.02Å; C269-C277 PolarHBondContact SG-SG 3.13Å; D273-C277 WeakPolarHBondContact O-CB 3.3Å; D273-C277 PolarHBondContact O-N 3.07Å; L275-C277 VanDerWaalsContact C-N 3.29Å; L275-C277 PolarHBondContact O-N 3.39Å; C277-G281 PolarHBondContact O-N 3.36Å
278L91.3Very high92.3Very high12 Ų1214.3 Ų14.36%0.0637%0.074CC..Hα-helixtrans-76.1-51.7179.1175.964.2000111.5L46 P176 L179 V274 L275 D276 G281 E282 L308L46-L278 HydrophobicContact CD1-CD2 4.17Å; L46-L278 HydrophobicContact CD2-CD2 4.17Å; P176-L278 HydrophobicContact CB-CD1 3.87Å; L179-L278 HydrophobicContact CD1-CD1 4.34Å; L179-L278 HydrophobicContact CD1-CD2 3.91Å; V274-L278 PolarHBondContact O-N 3.47Å; L275-L278 PolarHBondContact O-N 3.2Å; D276-L278 VanDerWaalsContact C-N 3.27Å; D276-L278 PolarHBondContact O-N 2.64Å; L278-G281 PolarHBondContact O-N 2.81Å; L278-E282 PolarHBondContact O-N 3.31Å; L278-L308 HydrophobicContact CD1-CD2 4.03Å
279Q88.6Confident92.3Very high2 Ų213.8 Ų13.81%0.0097%0.073CC..Hα-helixtrans-65.6-48.4-173.8-71.2-174.32.200111.8I41 L87 L275 D276 G281 E282 K283I41-Q279 HydrophobicContact CD1-CG 4.29Å; I41-Q279 VanDerWaalsContact CD1-NE2 3.29Å; L87-Q279 PolarHBondContact O-NE2 2.95Å; L87-Q279 PolarHBondContact O-OE1 3.5Å; L275-Q279 HydrophobicContact CD1-CG 4.11Å; L275-Q279 HydrophobicContact CG-CG 4.44Å; L275-Q279 PolarHBondContact O-N 3.24Å; D276-Q279 PolarHBondContact O-N 3.05Å; Q279-G281 VanDerWaalsContact C-N 3.32Å; Q279-G281 PolarHBondContact O-N 3.22Å; Q279-E282 WeakPolarHBondContact O-CB 3.24Å; Q279-E282 PolarHBondContact O-N 2.9Å; Q279-K283 WeakPolarHBondContact O-CG 3.06Å; Q279-K283 PolarHBondContact O-N 3.39Å
280D89.6Confident92.2Very high12 Ų1216.1 Ų16.16%0.0649%0.089CC..Hα-helixtrans-71-33.7-179-71.2-15.8000111.2L32 H264 V265 H268 D276 E282 K283 I284L32-D280 HydrophobicContact CD1-CB 4.3Å; L32-D280 HydrophobicContact CD2-CB 3.81Å; H264-D280 IonicContact CD2-OD2 3.33Å; V265-D280 HydrophobicContact CG2-CB 3.5Å; V265-D280 VanDerWaalsContact CG2-CB 3.5Å; H268-D280 IonicContact CD2-OD2 3.54Å; H268-D280 IonicContact NE2-OD2 3.52Å; D276-D280 VanDerWaalsContact O-CB 3.31Å; D276-D280 WeakPolarHBondContact O-CB 3.49Å; D276-D280 PolarHBondContact O-N 3.3Å; D280-E282 PolarHBondContact O-N 2.87Å; D280-K283 PolarHBondContact O-N 3.08Å; D280-K283 IonicContact OD1-NZ 3.58Å; D280-K283 PolarHBondContact OD1-NZ 2.91Å; D280-I284 WeakPolarHBondContact O-CG1 3.02Å; D280-I284 PolarHBondContact O-N 2.91Å
281G91.1Very high92Very high16 Ų1618.6 Ų18.617%0.16510%0.1CC..Hα-helixtrans-57.1-46.5168.500000112.4C277 L278 Q279 I284 M285C277-G281 PolarHBondContact O-N 3.36Å; L278-G281 PolarHBondContact O-N 2.81Å; Q279-G281 VanDerWaalsContact C-N 3.32Å; Q279-G281 PolarHBondContact O-N 3.22Å; G281-I284 PolarHBondContact O-N 3.04Å; G281-M285 VanDerWaalsContact O-CG 3.26Å; G281-M285 WeakPolarHBondContact O-CG 3.37Å; G281-M285 PolarHBondContact O-N 2.81Å; G281-M285 VanDerWaalsContact O-N 3.09Å
282E88.9Confident91.9Very high8 Ų817.3 Ų17.34%0.03710%0.097CC..Hα-helixtrans-60.5-44.6175173.5179.9-14400112T38 A39 L278 Q279 D280 I284 M285 S286 T307T38-E282 PolarHBondContact N-OE2 3.49Å; T38-E282 PolarHBondContact OG1-OE1 3.45Å; A39-E282 WeakPolarHBondContact CB-OE2 3.45Å; A39-E282 PolarHBondContact N-OE1 2.93Å; A39-E282 PolarHBondContact N-OE2 2.93Å; L278-E282 PolarHBondContact O-N 3.31Å; Q279-E282 WeakPolarHBondContact O-CB 3.24Å; Q279-E282 PolarHBondContact O-N 2.9Å; D280-E282 PolarHBondContact O-N 2.87Å; E282-I284 PolarHBondContact O-N 3.18Å; E282-M285 PolarHBondContact O-N 3.28Å; E282-S286 WeakPolarHBondContact O-CB 3.45Å; E282-S286 PolarHBondContact O-N 3.24Å; E282-S286 PolarHBondContact O-OG 3.45Å; E282-T307 HydrophobicContact CB-CG2 4.08Å; E282-T307 HydrophobicContact CG-CG2 3.63Å; E282-T307 WeakPolarHBondContact OE1-CG2 3.02Å
283K88.8Confident91.7Very high8 Ų824.5 Ų24.54%0.03514%0.135CC..Hα-helixtrans-59.8-46.6179.5-68.7174.7-163.5156.50111.2L32 C37 Q279 D280 M285 S286 Y287L32-K283 HydrophobicContact CD2-CB 3.93Å; L32-K283 HydrophobicContact CD2-CD 3.98Å; C37-K283 WeakPolarHBondContact SG-CE 3.22Å; Q279-K283 WeakPolarHBondContact O-CG 3.06Å; Q279-K283 PolarHBondContact O-N 3.39Å; D280-K283 PolarHBondContact O-N 3.08Å; D280-K283 IonicContact OD1-NZ 3.58Å; D280-K283 PolarHBondContact OD1-NZ 2.91Å; K283-M285 PolarHBondContact O-N 2.81Å; K283-S286 PolarHBondContact O-N 3.2Å; K283-Y287 WeakPolarHBondContact O-CB 3.28Å; K283-Y287 PolarHBondContact O-N 2.81Å
284I91.6Very high91.6Very high6 Ų628.6 Ų28.63%0.03116%0.16CC..Hα-helixtrans-60.7-47.9177.9-67.8176000110.7L32 D261 V262 V265 D280 G281 E282 S286 Y287 I288L32-I284 HydrophobicContact CD2-CG1 4.09Å; D261-I284 VanDerWaalsContact C-CD1 3.41Å; D261-I284 HydrophobicContact CB-CD1 3.78Å; D261-I284 HydrophobicContact CB-CG1 4.08Å; D261-I284 WeakPolarHBondContact O-CD1 2.95Å; V262-I284 HydrophobicContact CG2-CD1 4.03Å; V262-I284 HydrophobicContact CG2-CG2 4.14Å; V265-I284 HydrophobicContact CB-CD1 4.34Å; V265-I284 HydrophobicContact CG2-CD1 3.48Å; V265-I284 VanDerWaalsContact CG2-CD1 3.48Å; V265-I284 HydrophobicContact CG2-CG1 4.49Å; D280-I284 WeakPolarHBondContact O-CG1 3.02Å; D280-I284 PolarHBondContact O-N 2.91Å; G281-I284 PolarHBondContact O-N 3.04Å; E282-I284 PolarHBondContact O-N 3.18Å; I284-S286 VanDerWaalsContact C-N 3.3Å; I284-S286 PolarHBondContact O-N 3.06Å; I284-Y287 PolarHBondContact O-N 3.19Å; I284-I288 HydrophobicContact CG2-CD1 3.83Å; I284-I288 HydrophobicContact CG2-CG1 4.45Å; I284-I288 WeakPolarHBondContact O-CG1 3.32Å; I284-I288 PolarHBondContact O-N 2.76Å
285M92.4Very high91.5Very high34 Ų3428.4 Ų28.417%0.16716%0.159CC..Hα-helixtrans-65.7-35.4-178.8-63.8-60.2171.200112.1G281 E282 K283 I288 C289 I314 I315G281-M285 VanDerWaalsContact O-CG 3.26Å; G281-M285 WeakPolarHBondContact O-CG 3.37Å; G281-M285 PolarHBondContact O-N 2.81Å; G281-M285 VanDerWaalsContact O-N 3.09Å; E282-M285 PolarHBondContact O-N 3.28Å; K283-M285 PolarHBondContact O-N 2.81Å; M285-I288 HydrophobicContact SD-CD1 4.32Å; M285-C289 PolarHBondContact O-N 3.47Å; M285-C289 VanDerWaalsContact O-N 3.12Å; M285-I314 HydrophobicContact CB-CD1 4.36Å; M285-I314 HydrophobicContact SD-CB 4.05Å; M285-I314 HydrophobicContact SD-CD1 3.89Å; M285-I314 HydrophobicContact SD-CG2 4Å; M285-I315 HydrophobicContact CE-CD1 4.04Å; M285-I315 HydrophobicContact CE-CG1 3.96Å
286S90.5Very high91.7Very high12 Ų1228.8 Ų28.88%0.08416%0.161CC..Hα-helixtrans-69.1-41.3175.8-61.80000111.9Y35 E282 K283 I284 C289 S290Y35-S286 VanDerWaalsContact CE1-CB 3.47Å; Y35-S286 PolarHBondContact OH-O 3.17Å; E282-S286 WeakPolarHBondContact O-CB 3.45Å; E282-S286 PolarHBondContact O-N 3.24Å; E282-S286 PolarHBondContact O-OG 3.45Å; K283-S286 PolarHBondContact O-N 3.2Å; I284-S286 VanDerWaalsContact C-N 3.3Å; I284-S286 PolarHBondContact O-N 3.06Å; S286-C289 PolarHBondContact O-N 2.8Å; S286-S290 PolarHBondContact O-N 3.3Å
287Y91.9Very high91.9Very high25 Ų2532.5 Ų32.510%0.09818%0.181CC..Hα-helixtrans-60.4-47.9172.9175.6-97.7000111.8I31 Y35 E254 L258 K283 I284 C289 S290 Q291I31-Y287 HydrophobicContact CB-CG 4.47Å; I31-Y287 HydrophobicContact CD1-CD1 3.3Å; I31-Y287 HydrophobicContact CD1-CD2 4.27Å; I31-Y287 HydrophobicContact CD1-CE1 3.38Å; I31-Y287 HydrophobicContact CD1-CE2 4.37Å; I31-Y287 HydrophobicContact CD1-CG 3.76Å; I31-Y287 HydrophobicContact CG1-CD1 4.11Å; I31-Y287 HydrophobicContact CG1-CD2 4.2Å; I31-Y287 HydrophobicContact CG1-CE1 4.12Å; I31-Y287 HydrophobicContact CG1-CE2 4.24Å; I31-Y287 HydrophobicContact CG1-CG 4.13Å; I31-Y287 HydrophobicContact CG2-CD1 4.26Å; I31-Y287 HydrophobicContact CG2-CD2 3.57Å; I31-Y287 HydrophobicContact CG2-CE2 4.34Å; I31-Y287 HydrophobicContact CG2-CG 3.52Å; Y35-Y287 HydrophobicContact CE2-CD2 4.37Å; E254-Y287 VanDerWaalsContact CD-OH 3.25Å; E254-Y287 WeakPolarHBondContact OE1-CE1 3.46Å; E254-Y287 PolarHBondContact OE1-OH 2.89Å; E254-Y287 PolarHBondContact OE2-OH 3.44Å; L258-Y287 HydrophobicContact CD2-CD1 3.85Å; L258-Y287 HydrophobicContact CD2-CE1 3.96Å; K283-Y287 WeakPolarHBondContact O-CB 3.28Å; K283-Y287 PolarHBondContact O-N 2.81Å; I284-Y287 PolarHBondContact O-N 3.19Å; Y287-C289 PolarHBondContact O-N 2.87Å; Y287-S290 WeakPolarHBondContact O-CB 3.36Å; Y287-S290 PolarHBondContact O-N 3.08Å; Y287-S290 PolarHBondContact O-OG 3.11Å; Y287-Q291 HydrophobicContact CD2-CG 4.36Å; Y287-Q291 HydrophobicContact CE1-CG 4.04Å; Y287-Q291 HydrophobicContact CE2-CG 3.83Å; Y287-Q291 PolarHBondContact O-N 3.37Å; Y287-Q291 VanDerWaalsContact O-N 3.07Å
288I94.1Very high92Very high6 Ų635.9 Ų35.93%0.03120%0.196CC..Hα-helixtrans-54.7-44.2177.3-73.1169.3000110.4F247 L258 I284 M285 Q291 Q292 L295 I299 I314F247-I288 HydrophobicContact CZ-CG2 4.09Å; L258-I288 HydrophobicContact CD2-CG1 4.16Å; I284-I288 HydrophobicContact CG2-CD1 3.83Å; I284-I288 HydrophobicContact CG2-CG1 4.45Å; I284-I288 WeakPolarHBondContact O-CG1 3.32Å; I284-I288 PolarHBondContact O-N 2.76Å; M285-I288 HydrophobicContact SD-CD1 4.32Å; I288-Q291 CarbonylContact O-C 3.36Å; I288-Q291 PolarHBondContact O-N 3.23Å; I288-Q292 PolarHBondContact O-N 3.39Å; I288-Q292 VanDerWaalsContact O-N 3.09Å; I288-L295 HydrophobicContact CB-CD1 4.11Å; I288-L295 HydrophobicContact CG1-CD1 4.12Å; I288-L295 HydrophobicContact CG2-CD1 3.97Å; I288-I299 HydrophobicContact CG2-CD1 3.42Å; I288-I299 VanDerWaalsContact CG2-CD1 3.42Å; I288-I314 HydrophobicContact CD1-CG2 4.41Å; I288-I314 HydrophobicContact CG2-CD1 4.12Å; I288-I314 HydrophobicContact CG2-CG2 4.24Å
289C94.4Very high92.3Very high16 Ų1635.3 Ų35.311%0.10819%0.193CC..Hα-helixtrans-69.9-34.1176.9-74.20000114.1M285 S286 Y287 Q291 Q292 C303M285-C289 PolarHBondContact O-N 3.47Å; M285-C289 VanDerWaalsContact O-N 3.12Å; S286-C289 PolarHBondContact O-N 2.8Å; Y287-C289 PolarHBondContact O-N 2.87Å; C289-Q291 PolarHBondContact O-N 3Å; C289-Q292 WeakPolarHBondContact O-CG 3.4Å; C289-Q292 PolarHBondContact O-N 2.95Å; C289-C303 WeakPolarHBondContact CA-SG 3.4Å; C289-C303 HydrophobicContact CB-CB 3.68Å; C289-C303 WeakPolarHBondContact CB-SG 3.48Å; C289-C303 WeakPolarHBondContact SG-CA 3.45Å; C289-C303 WeakPolarHBondContact SG-CB 2.85Å; C289-C303 CovalentContact SG-SG 2.04Å; C289-C303 PolarHBondContact SG-SG 3.29Å
290S92.8Very high92.6Very high60 Ų6037.4 Ų37.442%0.4221%0.206SC..Hα-helixtrans-63-25173.382.50000112.7Y35 S286 Y287Y35-S290 WeakPolarHBondContact OH-CB 3.28Å; S286-S290 PolarHBondContact O-N 3.3Å; Y287-S290 WeakPolarHBondContact O-CB 3.36Å; Y287-S290 PolarHBondContact O-N 3.08Å; Y287-S290 PolarHBondContact O-OG 3.11Å
291Q92.8Very high92.9Very high66 Ų6642.8 Ų42.831%0.30823%0.231SC..THydrogen-bonded Turntrans-108.615.8180-58.5-54.1-50.400112.6Y287 I288 C289 D293 T294 L295Y287-Q291 HydrophobicContact CD2-CG 4.36Å; Y287-Q291 HydrophobicContact CE1-CG 4.04Å; Y287-Q291 HydrophobicContact CE2-CG 3.83Å; Y287-Q291 PolarHBondContact O-N 3.37Å; Y287-Q291 VanDerWaalsContact O-N 3.07Å; I288-Q291 CarbonylContact O-C 3.36Å; I288-Q291 PolarHBondContact O-N 3.23Å; C289-Q291 PolarHBondContact O-N 3Å; Q291-D293 PolarHBondContact O-N 2.93Å; Q291-D293 VanDerWaalsContact O-N 3.09Å; Q291-T294 PolarHBondContact O-N 2.99Å; Q291-T294 PolarHBondContact O-OG1 3.34Å; Q291-L295 HydrophobicContact CB-CD1 3.8Å; Q291-L295 HydrophobicContact CB-CG 3.78Å; Q291-L295 WeakPolarHBondContact O-CG 3.25Å; Q291-L295 PolarHBondContact O-N 3.32Å
292Q92.9Very high93.2Very high47 Ų4742.2 Ų42.222%0.2222%0.224CC..Hα-helixtrans-55.1-37.2-171.966.3178.6-28.900113.4I288 C289 T294 L295 S296 I299I288-Q292 PolarHBondContact O-N 3.39Å; I288-Q292 VanDerWaalsContact O-N 3.09Å; C289-Q292 WeakPolarHBondContact O-CG 3.4Å; C289-Q292 PolarHBondContact O-N 2.95Å; Q292-T294 PolarHBondContact O-N 2.83Å; Q292-L295 PolarHBondContact O-N 2.93Å; Q292-S296 CarbonylContact O-C 3.5Å; Q292-S296 PolarHBondContact O-N 2.72Å; Q292-I299 HydrophobicContact CB-CD1 4.04Å; Q292-I299 HydrophobicContact CB-CG1 4.27Å
293D91.3Very high93.6Very high152 Ų15242.9 Ų42.981%0.81323%0.23SC*.Hα-helixtrans-66.6-25.1-177.8-63.2-29.2000112.5Q291Q291-D293 PolarHBondContact O-N 2.93Å; Q291-D293 VanDerWaalsContact O-N 3.09Å
294T91.4Very high93.9Very high89 Ų8949.1 Ų49.155%0.54626%0.256SS..Hα-helixtrans-98.9-30.3177.763.10000112.3Q291 Q292Q291-T294 PolarHBondContact O-N 2.99Å; Q291-T294 PolarHBondContact O-OG1 3.34Å; Q292-T294 PolarHBondContact O-N 2.83Å
295L92.8Very high94Very high2 Ų251.9 Ų51.91%0.0127%0.271CS..Hα-helixtrans-82.6-56.6-177.1-65.3-177.5000113F247 V250 E254 L258 I288 Q291 Q292F247-L295 HydrophobicContact CD1-CB 4.11Å; F247-L295 HydrophobicContact CE1-CB 4.31Å; F247-L295 HydrophobicContact CG-CB 4.38Å; V250-L295 HydrophobicContact CB-CD2 4.49Å; V250-L295 HydrophobicContact CG1-CD2 4.12Å; V250-L295 HydrophobicContact CG2-CB 4.47Å; V250-L295 HydrophobicContact CG2-CD2 3.53Å; E254-L295 HydrophobicContact CG-CD2 4.49Å; L258-L295 HydrophobicContact CD1-CD2 4.44Å; I288-L295 HydrophobicContact CB-CD1 4.11Å; I288-L295 HydrophobicContact CG1-CD1 4.12Å; I288-L295 HydrophobicContact CG2-CD1 3.97Å; Q291-L295 HydrophobicContact CB-CD1 3.8Å; Q291-L295 HydrophobicContact CB-CG 3.78Å; Q291-L295 WeakPolarHBondContact O-CG 3.25Å; Q291-L295 PolarHBondContact O-N 3.32Å; Q292-L295 PolarHBondContact O-N 2.93Å
296S95.1Very high93.9Very high7 Ų754 Ų545%0.04929%0.286CS..  trans-172.7138.6-177.3169.70000112.2Q292 K298 I299 D320Q292-S296 CarbonylContact O-C 3.5Å; Q292-S296 PolarHBondContact O-N 2.72Å; S296-K298 VanDerWaalsContact C-N 3.29Å; S296-K298 WeakPolarHBondContact OG-CB 3.4Å; S296-K298 PolarHBondContact OG-N 2.94Å; S296-I299 WeakPolarHBondContact O-CG1 3.17Å; S296-D320 VanDerWaalsContact CB-OD1 3.26Å; S296-D320 WeakPolarHBondContact CB-OD1 3.16Å; S296-D320 WeakPolarHBondContact CB-OD2 3.33Å; S296-D320 PolarHBondContact OG-OD1 2.91Å
297N93.9Very high93.7Very high100 Ų10055.6 Ų55.654%0.53530%0.295SS..G310 helixtrans-79.2-9.8170.765.7-12.2000113.4I299 T300N297-I299 PolarHBondContact O-N 3.31Å; N297-T300 PolarHBondContact O-OG1 2.64Å
298K96.1Very high93.4Very high73 Ų7356.6 Ų56.632%0.31730%0.302SS..G310 helixtrans-73.9-14.8178.8-57.2-65.9-177.5174.20112.8S296 D320 E321S296-K298 VanDerWaalsContact C-N 3.29Å; S296-K298 WeakPolarHBondContact OG-CB 3.4Å; S296-K298 PolarHBondContact OG-N 2.94Å; K298-D320 WeakPolarHBondContact CG-OD1 3.35Å; K298-E321 WeakPolarHBondContact CE-OE1 3.4Å; K298-E321 IonicContact NZ-OE1 2.8Å; K298-E321 PolarHBondContact NZ-OE1 3.41Å
299I96.8Very high93.3Very high0 Ų058.2 Ų58.20%031%0.31CS..G310 helixtrans-101.11.3-179.158163.6000113.7F247 I288 Q292 S296 N297 E301 C302 C303 I314 A317F247-I299 HydrophobicContact CE1-CD1 4.43Å; F247-I299 HydrophobicContact CE1-CG2 4.49Å; I288-I299 HydrophobicContact CG2-CD1 3.42Å; I288-I299 VanDerWaalsContact CG2-CD1 3.42Å; Q292-I299 HydrophobicContact CB-CD1 4.04Å; Q292-I299 HydrophobicContact CB-CG1 4.27Å; S296-I299 WeakPolarHBondContact O-CG1 3.17Å; N297-I299 PolarHBondContact O-N 3.31Å; I299-E301 PolarHBondContact O-N 2.95Å; I299-C302 WeakPolarHBondContact O-CA 3.28Å; I299-C302 VanDerWaalsContact O-CB 3.3Å; I299-C302 WeakPolarHBondContact O-CB 3.32Å; I299-C302 PolarHBondContact O-N 3.39Å; I299-C303 PolarHBondContact O-N 3.34Å; I299-C303 PolarHBondContact O-SG 2.84Å; I299-C303 VanDerWaalsContact O-SG 3.41Å; I299-I314 HydrophobicContact CB-CG1 4.41Å; I299-I314 HydrophobicContact CG2-CG1 4.3Å; I299-I314 HydrophobicContact CG2-CG2 4.35Å; I299-A317 HydrophobicContact CG2-CB 3.89Å
300T96Very high93.3Very high46 Ų4659.7 Ų59.728%0.28231%0.313SS..THydrogen-bonded Turntrans-58.8-42.6-174.7-59.10000113.4N297 C302 C303N297-T300 PolarHBondContact O-OG1 2.64Å; T300-C302 VanDerWaalsContact C-N 3.35Å; T300-C303 PolarHBondContact O-N 2.95Å
301E96.3Very high93.2Very high125 Ų12557.3 Ų57.358%0.58430%0.298SS*.THydrogen-bonded Turntrans-70.9-32.6176-64-50.5130.300112.1I299 C303 K304I299-E301 PolarHBondContact O-N 2.95Å; E301-C303 VanDerWaalsContact C-N 3.31Å; E301-C303 PolarHBondContact O-N 3.46Å; E301-K304 PolarHBondContact O-N 3.07Å; E301-K304 IonicContact OE1-NZ 2.63Å; E301-K304 PolarHBondContact OE1-NZ 2.92Å; E301-K304 IonicContact OE2-NZ 2.84Å; E301-K304 PolarHBondContact OE2-NZ 2.88Å
302C96.9Very high93.1Very high5 Ų554.8 Ų54.83%0.03429%0.286CS..G310 helixtrans-62.8-39.2176-59.90000111.9I299 T300 K304 L305 R310 C313 I314I299-C302 WeakPolarHBondContact O-CA 3.28Å; I299-C302 VanDerWaalsContact O-CB 3.3Å; I299-C302 WeakPolarHBondContact O-CB 3.32Å; I299-C302 PolarHBondContact O-N 3.39Å; T300-C302 VanDerWaalsContact C-N 3.35Å; C302-K304 PolarHBondContact O-N 3.47Å; C302-K304 VanDerWaalsContact O-N 3.15Å; C302-L305 WeakPolarHBondContact O-CB 3.37Å; C302-L305 WeakPolarHBondContact O-CG 3.37Å; C302-L305 PolarHBondContact O-N 3.19Å; C302-R310 WeakPolarHBondContact O-CG 3.39Å; C302-C313 WeakPolarHBondContact CA-SG 3.33Å; C302-C313 HydrophobicContact CB-CB 3.52Å; C302-C313 WeakPolarHBondContact CB-SG 3.4Å; C302-C313 WeakPolarHBondContact SG-CB 3.45Å; C302-C313 PolarHBondContact SG-O 3.35Å; C302-C313 CovalentContact SG-SG 2.04Å; C302-C313 PolarHBondContact SG-SG 3.2Å; C302-I314 HydrophobicContact CB-CG1 3.79Å
303C96.3Very high93.3Very high22 Ų2254.4 Ų54.415%0.14929%0.288CS..G310 helixtrans-68.5-10.2-178.3-68.50000114.6C289 I299 T300 E301C289-C303 WeakPolarHBondContact CA-SG 3.4Å; C289-C303 HydrophobicContact CB-CB 3.68Å; C289-C303 WeakPolarHBondContact CB-SG 3.48Å; C289-C303 WeakPolarHBondContact SG-CA 3.45Å; C289-C303 WeakPolarHBondContact SG-CB 2.85Å; C289-C303 CovalentContact SG-SG 2.04Å; C289-C303 PolarHBondContact SG-SG 3.29Å; I299-C303 PolarHBondContact O-N 3.34Å; I299-C303 PolarHBondContact O-SG 2.84Å; I299-C303 VanDerWaalsContact O-SG 3.41Å; T300-C303 PolarHBondContact O-N 2.95Å; E301-C303 VanDerWaalsContact C-N 3.31Å; E301-C303 PolarHBondContact O-N 3.46Å
304K95.6Very high93.5Very high138 Ų13847.4 Ų47.460%0.625%0.25SS*.G310 helixtrans-88.9-10172.8-58.5173.8-168.3167.70113.3E301 C302E301-K304 PolarHBondContact O-N 3.07Å; E301-K304 IonicContact OE1-NZ 2.63Å; E301-K304 PolarHBondContact OE1-NZ 2.92Å; E301-K304 IonicContact OE2-NZ 2.84Å; E301-K304 PolarHBondContact OE2-NZ 2.88Å; C302-K304 PolarHBondContact O-N 3.47Å; C302-K304 VanDerWaalsContact O-N 3.15Å
305L93.6Very high93.5Very high65 Ų6547.2 Ų47.234%0.3425%0.245SC..SBendtrans-81.7164.7-176.4-57.6176.8000112.4C302 E309 R310 C313C302-L305 WeakPolarHBondContact O-CB 3.37Å; C302-L305 WeakPolarHBondContact O-CG 3.37Å; C302-L305 PolarHBondContact O-N 3.19Å; L305-E309 HydrophobicContact CB-CB 3.9Å; L305-E309 HydrophobicContact CD1-CB 4.2Å; L305-R310 HydrophobicContact CB-CB 4.28Å; L305-R310 PolarHBondContact O-NE 2.95Å; L305-R310 PolarHBondContact O-NH2 3.3Å; L305-R310 VanDerWaalsContact O-NH2 3.09Å; L305-C313 HydrophobicContact CD1-CB 3.62Å
306T89.8Confident93.5Very high79 Ų7952 Ų5249%0.48527%0.268SS..  trans-58.8157.4171.266.70000110.9L308 E309 R310T306-L308 VanDerWaalsContact C-N 3.35Å; T306-L308 PolarHBondContact O-N 2.99Å; T306-E309 WeakPolarHBondContact CG2-OE2 3.26Å; T306-E309 PolarHBondContact O-N 3.46Å; T306-E309 VanDerWaalsContact O-N 3.11Å; T306-E309 WeakPolarHBondContact OG1-CB 3.47Å; T306-E309 VanDerWaalsContact OG1-CD 3.24Å; T306-E309 WeakPolarHBondContact OG1-CG 3.47Å; T306-E309 PolarHBondContact OG1-OE2 3.09Å; T306-R310 WeakPolarHBondContact O-CB 3.38Å; T306-R310 PolarHBondContact O-N 3.49Å
307T86.3Confident93.5Very high44 Ų4452.5 Ų52.527%0.2727%0.272SS..Hα-helixtrans-49.6-49.7-173.4-60.50000113.6E282 G311E282-T307 HydrophobicContact CB-CG2 4.08Å; E282-T307 HydrophobicContact CG-CG2 3.63Å; E282-T307 WeakPolarHBondContact OE1-CG2 3.02Å; T307-G311 PolarHBondContact O-N 2.66Å
308L87.3Confident93.4Very high47 Ų4753.3 Ų53.325%0.24627%0.273CS..Hα-helixtrans-70-40-179.5-64.1175.9000112.6P176 L179 L180 L278 T306 Q312P176-L308 HydrophobicContact CB-CD2 4.25Å; L179-L308 HydrophobicContact CB-CD1 3.79Å; L179-L308 HydrophobicContact CB-CD2 4.41Å; L180-L308 HydrophobicContact CB-CB 4.19Å; L180-L308 HydrophobicContact CD1-CB 4.04Å; L278-L308 HydrophobicContact CD1-CD2 4.03Å; T306-L308 VanDerWaalsContact C-N 3.35Å; T306-L308 PolarHBondContact O-N 2.99Å; L308-Q312 PolarHBondContact O-N 3.37Å
309E91.8Very high93.3Very high40 Ų4052.9 Ų52.919%0.18727%0.274CS..Hα-helixtrans-70.5-34.5178.8-70.7167.7156.300111.9L180 K187 L305 T306 Q312 C313L180-E309 HydrophobicContact CD1-CG 3.76Å; K187-E309 IonicContact NZ-OE1 2.8Å; K187-E309 PolarHBondContact NZ-OE1 3.08Å; K187-E309 IonicContact NZ-OE2 3.18Å; L305-E309 HydrophobicContact CB-CB 3.9Å; L305-E309 HydrophobicContact CD1-CB 4.2Å; T306-E309 WeakPolarHBondContact CG2-OE2 3.26Å; T306-E309 PolarHBondContact O-N 3.46Å; T306-E309 VanDerWaalsContact O-N 3.11Å; T306-E309 WeakPolarHBondContact OG1-CB 3.47Å; T306-E309 VanDerWaalsContact OG1-CD 3.24Å; T306-E309 WeakPolarHBondContact OG1-CG 3.47Å; T306-E309 PolarHBondContact OG1-OE2 3.09Å; E309-Q312 PolarHBondContact O-N 2.97Å; E309-C313 VanDerWaalsContact O-CB 3.27Å; E309-C313 WeakPolarHBondContact O-CB 3.42Å; E309-C313 PolarHBondContact O-N 3.41Å
310R93.4Very high93.2Very high47 Ų4753 Ų5318%0.17727%0.274CS..Hα-helixtrans-60.4-52.2177.2177.7-171-49169.510.6111.2C302 L305 T306 Q312 C313 I314C302-R310 WeakPolarHBondContact O-CG 3.39Å; L305-R310 HydrophobicContact CB-CB 4.28Å; L305-R310 PolarHBondContact O-NE 2.95Å; L305-R310 PolarHBondContact O-NH2 3.3Å; L305-R310 VanDerWaalsContact O-NH2 3.09Å; T306-R310 WeakPolarHBondContact O-CB 3.38Å; T306-R310 PolarHBondContact O-N 3.49Å; R310-Q312 VanDerWaalsContact C-N 3.33Å; R310-Q312 PolarHBondContact O-N 3.2Å; R310-C313 PolarHBondContact O-N 3.42Å; R310-I314 HydrophobicContact CG-CD1 3.82Å; R310-I314 WeakPolarHBondContact O-CG1 3.48Å; R310-I314 PolarHBondContact O-N 3.18Å
311G91Very high93.1Very high10 Ų1055.6 Ų55.610%0.10328%0.283CS..Hα-helixtrans-58-47.4179.500000111.7T307 C313 I314 I315T307-G311 PolarHBondContact O-N 2.66Å; G311-C313 VanDerWaalsContact C-N 3.35Å; G311-C313 PolarHBondContact O-N 2.94Å; G311-I314 PolarHBondContact O-N 3.21Å; G311-I315 WeakPolarHBondContact O-CD1 3.11Å; G311-I315 VanDerWaalsContact O-CG1 3.26Å; G311-I315 WeakPolarHBondContact O-CG1 3.41Å; G311-I315 PolarHBondContact O-N 2.88Å; G311-I315 VanDerWaalsContact O-N 3.08Å
312Q91.7Very high92.8Very high13 Ų1353.7 Ų53.76%0.06127%0.273CS..Hα-helixtrans-60.7-43177.3-169.465.414.200112.8L180 E212 L308 E309 R310 H316L180-Q312 HydrophobicContact CD2-CB 3.51Å; L180-Q312 HydrophobicContact CD2-CG 3.63Å; E212-Q312 PolarHBondContact OE1-NE2 3.18Å; E212-Q312 PolarHBondContact OE2-NE2 3.41Å; L308-Q312 PolarHBondContact O-N 3.37Å; E309-Q312 PolarHBondContact O-N 2.97Å; R310-Q312 VanDerWaalsContact C-N 3.33Å; R310-Q312 PolarHBondContact O-N 3.2Å; Q312-H316 PolarHBondContact NE2-CE1 3.08Å; Q312-H316 PolarHBondContact NE2-ND1 3.46Å; Q312-H316 PolarHBondContact O-N 3.46Å; Q312-H316 PolarHBondContact O-ND1 2.8Å
313C95.9Very high92.5Very high38 Ų3854.4 Ų54.426%0.25728%0.278SS..Hα-helixtrans-64.3-45.9178.6-175.30000111.8C302 L305 E309 R310 G311 I315 H316 A317C302-C313 WeakPolarHBondContact CA-SG 3.33Å; C302-C313 HydrophobicContact CB-CB 3.52Å; C302-C313 WeakPolarHBondContact CB-SG 3.4Å; C302-C313 WeakPolarHBondContact SG-CB 3.45Å; C302-C313 PolarHBondContact SG-O 3.35Å; C302-C313 CovalentContact SG-SG 2.04Å; C302-C313 PolarHBondContact SG-SG 3.2Å; L305-C313 HydrophobicContact CD1-CB 3.62Å; E309-C313 VanDerWaalsContact O-CB 3.27Å; E309-C313 WeakPolarHBondContact O-CB 3.42Å; E309-C313 PolarHBondContact O-N 3.41Å; R310-C313 PolarHBondContact O-N 3.42Å; G311-C313 VanDerWaalsContact C-N 3.35Å; G311-C313 PolarHBondContact O-N 2.94Å; C313-I315 VanDerWaalsContact C-N 3.33Å; C313-I315 PolarHBondContact O-N 3.01Å; C313-H316 CarbonylContact O-C 3.21Å; C313-H316 PolarHBondContact O-N 3.16Å; C313-H316 VanDerWaalsContact O-N 3.16Å; C313-A317 PolarHBondContact O-N 2.04Å
314I95.3Very high92.2Very high5 Ų562.6 Ų62.63%0.02631%0.313CS..Hα-helixtrans-60.8-42.5178.7-68.9168.4000111.1K246 M285 I288 I299 C302 R310 G311 H316 A317K246-I314 PolarHBondContact NZ-O 3.48Å; M285-I314 HydrophobicContact CB-CD1 4.36Å; M285-I314 HydrophobicContact SD-CB 4.05Å; M285-I314 HydrophobicContact SD-CD1 3.89Å; M285-I314 HydrophobicContact SD-CG2 4Å; I288-I314 HydrophobicContact CD1-CG2 4.41Å; I288-I314 HydrophobicContact CG2-CD1 4.12Å; I288-I314 HydrophobicContact CG2-CG2 4.24Å; I299-I314 HydrophobicContact CB-CG1 4.41Å; I299-I314 HydrophobicContact CG2-CG1 4.3Å; I299-I314 HydrophobicContact CG2-CG2 4.35Å; C302-I314 HydrophobicContact CB-CG1 3.79Å; R310-I314 HydrophobicContact CG-CD1 3.82Å; R310-I314 WeakPolarHBondContact O-CG1 3.48Å; R310-I314 PolarHBondContact O-N 3.18Å; G311-I314 PolarHBondContact O-N 3.21Å; I314-H316 VanDerWaalsContact C-N 3.29Å; I314-H316 PolarHBondContact O-N 3.13Å; I314-A317 WeakPolarHBondContact O-CB 3.48Å; I314-A317 PolarHBondContact O-N 3.22Å
315I91.9Very high91.8Very high86 Ų8660.1 Ų60.144%0.44133%0.328SS..Hα-helixtrans-58.4-43.9177.2-69.4165.1000110.5K246 M285 G311 C313K246-I315 PolarHBondContact NZ-O 3.23Å; M285-I315 HydrophobicContact CE-CD1 4.04Å; M285-I315 HydrophobicContact CE-CG1 3.96Å; G311-I315 WeakPolarHBondContact O-CD1 3.11Å; G311-I315 VanDerWaalsContact O-CG1 3.26Å; G311-I315 WeakPolarHBondContact O-CG1 3.41Å; G311-I315 PolarHBondContact O-N 2.88Å; G311-I315 VanDerWaalsContact O-N 3.08Å; C313-I315 VanDerWaalsContact C-N 3.33Å; C313-I315 PolarHBondContact O-N 3.01Å
316H92.5Very high91.5Very high103 Ų10359.5 Ų59.548%0.47732%0.324SS..Hα-helixtrans-87.3-7.4-177.3-69.582.3000115.1Q312 C313 I314Q312-H316 PolarHBondContact NE2-CE1 3.08Å; Q312-H316 PolarHBondContact NE2-ND1 3.46Å; Q312-H316 PolarHBondContact O-N 3.46Å; Q312-H316 PolarHBondContact O-ND1 2.8Å; C313-H316 CarbonylContact O-C 3.21Å; C313-H316 PolarHBondContact O-N 3.16Å; C313-H316 VanDerWaalsContact O-N 3.16Å; I314-H316 VanDerWaalsContact C-N 3.29Å; I314-H316 PolarHBondContact O-N 3.13Å
317A94.6Very high91.3Very high17 Ų1758.7 Ų58.714%0.1432%0.322CS..SBendtrans-59.1141.617700000111K246 I299 C313 I314K246-A317 PolarHBondContact NZ-O 3.48Å; I299-A317 HydrophobicContact CG2-CB 3.89Å; C313-A317 PolarHBondContact O-N 2.04Å; I314-A317 WeakPolarHBondContact O-CB 3.48Å; I314-A317 PolarHBondContact O-N 3.22Å
318E92.8Very high91.1Very high117 Ų11759.4 Ų59.455%0.54733%0.327SS..PPolyproline II helixtrans-59.5154.8177.3-65.1-165.713900111.4K468E318-K468 IonicContact OE1-NZ 3.19Å; E318-K468 PolarHBondContact OE1-NZ 3.04Å
319N94.5Very high90.9Very high64 Ų6460.3 Ų60.334%0.34233%0.332SS..PPolyproline II helixtrans-65.2146.6171.7-70.4-14.5000110.5Q245 P363Q245-N319 VanDerWaalsContact O-CB 3.31Å; Q245-N319 WeakPolarHBondContact O-CB 3.11Å; N319-P363 HydrophobicContact CB-CB 4.29Å; N319-P363 PolarHBondContact ND2-O 2.92Å
320D95Very high90.6Very high3 Ų359.2 Ų59.22%0.01633%0.328CS..PPolyproline II helixtrans-60157167.5-82-4.3000111.5K246 T248 S296 K298K246-D320 WeakPolarHBondContact O-CB 3.22Å; K246-D320 VanDerWaalsContact O-CG 3.26Å; K246-D320 PolarHBondContact O-N 3.12Å; K246-D320 VanDerWaalsContact O-N 3.11Å; T248-D320 HydrophobicContact CG2-CB 3.93Å; T248-D320 WeakPolarHBondContact OG1-CB 3.44Å; S296-D320 VanDerWaalsContact CB-OD1 3.26Å; S296-D320 WeakPolarHBondContact CB-OD1 3.16Å; S296-D320 WeakPolarHBondContact CB-OD2 3.33Å; S296-D320 PolarHBondContact OG-OD1 2.91Å; K298-D320 WeakPolarHBondContact CG-OD1 3.35Å
321E92.3Very high90Very high100 Ų10061.8 Ų61.847%0.46735%0.345SS..PPolyproline II helixtrans-62.3153.1172.6-61.279.7-171.700111.1T248 K298T248-E321 WeakPolarHBondContact CB-O 3.33Å; T248-E321 PolarHBondContact OG1-O 3.43Å; K298-E321 WeakPolarHBondContact CE-OE1 3.4Å; K298-E321 IonicContact NZ-OE1 2.8Å; K298-E321 PolarHBondContact NZ-OE1 3.41Å
322K91.3Very high89.5Confident85 Ų8567.4 Ų67.437%0.3736%0.363SS..PPolyproline II helixtrans-55.2133.9171.4179.1-174.9172.3-1760109.5R361 P363K322-R361 WeakPolarHBondContact CD-O 3.38Å; K322-P363 HydrophobicContact CB-CG 4.22Å
323P90.2Very high89.4Confident20 Ų2069.1 Ų69.113%0.1337%0.37CS..PPolyproline II helixtrans-63.2138.6178-20.532.6000112T248 L326 R360T248-P323 WeakPolarHBondContact O-CG 3.49Å; P323-L326 HydrophobicContact CB-CD1 3.7Å; P323-L326 HydrophobicContact CB-CG 4.13Å; P323-L326 HydrophobicContact CG-CD1 3.94Å; P323-R360 WeakPolarHBondContact CD-O 3.27Å
324E89.9Confident89Confident193 Ų19367.5 Ų67.590%0.90236%0.359SS*.THydrogen-bonded Turntrans-67.3150.5175.5-64.7-176.1-179.300111.6L326E324-L326 PolarHBondContact O-N 2.99Å
325G86.2Confident88.6Confident87 Ų8768.1 Ų68.190%0.89737%0.367SS*.THydrogen-bonded Turntrans75.6-2.4175.200000116
326L87.4Confident88.3Confident52 Ų5270.5 Ų70.527%0.27238%0.38SS..  trans-90.8125.4176-59.6-173.3000112.4P323 E324 R361P323-L326 HydrophobicContact CB-CD1 3.7Å; P323-L326 HydrophobicContact CB-CG 4.13Å; P323-L326 HydrophobicContact CG-CD1 3.94Å; E324-L326 PolarHBondContact O-N 2.99Å; L326-R361 HydrophobicContact CB-CG 4.17Å; L326-R361 HydrophobicContact CD1-CG 4.3Å
327S86.8Confident88.1Confident61 Ų6171.3 Ų71.343%0.42738%0.379SS..  trans-54.8137.7166.8169.80000110.2N329 R361S327-N329 WeakPolarHBondContact CB-O 3.47Å; S327-N329 PolarHBondContact O-N 3.09Å; S327-N329 PolarHBondContact OG-N 3.19Å; S327-N329 PolarHBondContact OG-O 3.23Å; S327-R361 WeakPolarHBondContact O-CD 3.34Å; S327-R361 PolarHBondContact O-NE 2.97Å
328P81.8Confident87.7Confident60 Ų6072.4 Ų72.439%0.3938%0.383SS..SBendtrans-59.7-30.1172.5-19.930.3000113.8H362P328-H362 PolarHBondContact O-NE2 2.88Å
329N82.6Confident87.6Confident66 Ų6666.8 Ų66.835%0.35336%0.357SS..SBendtrans-102.7150-179.9-61.3-31.1000110.9S327 N331 Q402S327-N329 WeakPolarHBondContact CB-O 3.47Å; S327-N329 PolarHBondContact O-N 3.09Å; S327-N329 PolarHBondContact OG-N 3.19Å; S327-N329 PolarHBondContact OG-O 3.23Å; N329-N331 VanDerWaalsContact CB-OD1 3.24Å; N329-N331 WeakPolarHBondContact CB-OD1 3.42Å; N329-Q402 PolarHBondContact OD1-NE2 3.01Å
330L84.9Confident87.3Confident17 Ų1766.8 Ų66.89%0.08936%0.357CS..  trans-95.19.9-177.3-66.2177.2000114.3R332 F333 F354 E357 Y358L330-R332 PolarHBondContact O-N 3.21Å; L330-F333 HydrophobicContact CB-CB 4.05Å; L330-F333 HydrophobicContact CB-CD2 4.3Å; L330-F333 HydrophobicContact CB-CG 4.4Å; L330-F333 HydrophobicContact CD1-CD2 4.39Å; L330-F333 HydrophobicContact CD2-CD2 4.49Å; L330-F333 WeakPolarHBondContact O-CB 2.99Å; L330-F333 PolarHBondContact O-N 3.28Å; L330-F333 VanDerWaalsContact O-N 3.13Å; L330-F354 HydrophobicContact CB-CE2 4.43Å; L330-F354 HydrophobicContact CD1-CD2 3.67Å; L330-F354 HydrophobicContact CD1-CE2 3.69Å; L330-F354 HydrophobicContact CD1-CG 4.39Å; L330-F354 HydrophobicContact CD1-CZ 4.41Å; L330-E357 HydrophobicContact CD1-CB 3.8Å; L330-E357 HydrophobicContact CD2-CB 3.72Å; L330-E357 HydrophobicContact CG-CB 4.45Å; L330-Y358 HydrophobicContact CD1-CD2 4.11Å; L330-Y358 HydrophobicContact CG-CD2 4.39Å
331N80.8Confident87.2Confident101 Ų10174 Ų7454%0.5439%0.39SS..SBendtrans-1107179-63.70.1000114.9N329 E398N329-N331 VanDerWaalsContact CB-OD1 3.24Å; N329-N331 WeakPolarHBondContact CB-OD1 3.42Å; N331-E398 WeakPolarHBondContact CA-OE2 3.01Å; N331-E398 PolarHBondContact N-OE2 3.35Å
332R80.9Confident87.2Confident127 Ų12771 Ų7148%0.47938%0.376SS..SBendtrans63.440.7177.6-51.6177.2179.1179.8-3.2112.7L330 L334 G335 D395 E398L330-R332 PolarHBondContact O-N 3.21Å; R332-L334 PolarHBondContact O-N 3.43Å; R332-G335 PolarHBondContact O-N 3.46Å; R332-D395 WeakPolarHBondContact CG-OD1 3.48Å; R332-D395 IonicContact CZ-OD1 3.43Å; R332-D395 IonicContact CZ-OD2 3.8Å; R332-D395 IonicContact NE-OD1 3.27Å; R332-D395 PolarHBondContact NE-OD1 2.85Å; R332-D395 IonicContact NE-OD2 3.89Å; R332-D395 PolarHBondContact NE-OD2 3.29Å; R332-D395 IonicContact NH2-OD1 2.72Å; R332-D395 IonicContact NH2-OD2 3.73Å; R332-D395 PolarHBondContact NH2-OD2 2.93Å; R332-E398 PolarHBondContact N-OE1 3.38Å
333F88.9Confident87.3Confident50 Ų5069.9 Ų69.922%0.21938%0.379CS..SBendtrans-57.8-36.6-178.6-173.6-109000113.1L330 F350 F354 E357L330-F333 HydrophobicContact CB-CB 4.05Å; L330-F333 HydrophobicContact CB-CD2 4.3Å; L330-F333 HydrophobicContact CB-CG 4.4Å; L330-F333 HydrophobicContact CD1-CD2 4.39Å; L330-F333 HydrophobicContact CD2-CD2 4.49Å; L330-F333 WeakPolarHBondContact O-CB 2.99Å; L330-F333 PolarHBondContact O-N 3.28Å; L330-F333 VanDerWaalsContact O-N 3.13Å; F333-F350 HydrophobicContact CD1-CE1 4.36Å; F333-F350 AromaticContact CD1-CE2 3.75Å; F333-F350 HydrophobicContact CD1-CE2 3.75Å; F333-F350 AromaticContact CD1-CZ 3.52Å; F333-F350 HydrophobicContact CD1-CZ 3.52Å; F333-F350 HydrophobicContact CE1-CD2 4.38Å; F333-F350 AromaticContact CE1-CE2 3.77Å; F333-F350 HydrophobicContact CE1-CE2 3.77Å; F333-F350 AromaticContact CE1-CZ 3.92Å; F333-F350 HydrophobicContact CE1-CZ 3.92Å; F333-F354 HydrophobicContact CB-CD2 4.39Å; F333-F354 HydrophobicContact CD1-CB 3.92Å; F333-F354 AromaticContact CD1-CD2 3.75Å; F333-F354 HydrophobicContact CD1-CD2 3.75Å; F333-F354 HydrophobicContact CD1-CG 4.35Å; F333-F354 HydrophobicContact CE1-CB 3.69Å; F333-F354 HydrophobicContact CE1-CD2 4.33Å; F333-F354 HydrophobicContact CG-CD2 4.17Å; F333-E357 HydrophobicContact CE2-CB 4.24Å; F333-E357 HydrophobicContact CE2-CG 3.93Å; F333-E357 HydrophobicContact CZ-CG 4.19Å
334L88.3Confident87.3Confident3 Ų373.1 Ų73.12%0.01640%0.402CS..SBendtrans-74.2-38.9173.6-177.966000112.1R332 R337 F339 F342 F350 Y377 L381 F385R332-L334 PolarHBondContact O-N 3.43Å; L334-R337 HydrophobicContact CD1-CB 4.12Å; L334-R337 WeakPolarHBondContact CD2-O 3.38Å; L334-R337 HydrophobicContact CG-CB 4.33Å; L334-R337 WeakPolarHBondContact CG-O 3.37Å; L334-R337 PolarHBondContact O-NE 2.85Å; L334-R337 PolarHBondContact O-NH2 2.8Å; L334-R337 VanDerWaalsContact O-NH2 3.09Å; L334-F339 HydrophobicContact CD2-CB 3.77Å; L334-F342 HydrophobicContact CD1-CE2 3.99Å; L334-F342 HydrophobicContact CD1-CZ 3.86Å; L334-F350 HydrophobicContact CB-CE1 4.39Å; L334-F350 HydrophobicContact CB-CE2 4.3Å; L334-F350 HydrophobicContact CB-CZ 3.63Å; L334-F350 HydrophobicContact CD1-CD2 4.26Å; L334-F350 HydrophobicContact CD1-CE1 3.94Å; L334-F350 HydrophobicContact CD1-CE2 3.67Å; L334-F350 HydrophobicContact CD1-CZ 3.48Å; L334-F350 VanDerWaalsContact CD1-CZ 3.48Å; L334-F350 HydrophobicContact CG-CZ 4.12Å; L334-Y377 PolarHBondContact N-OH 3.07Å; L334-L381 HydrophobicContact CB-CD1 4.5Å; L334-L381 HydrophobicContact CB-CD2 4.15Å; L334-L381 HydrophobicContact CD2-CD1 3.99Å; L334-L381 HydrophobicContact CD2-CD2 3.57Å; L334-L381 HydrophobicContact CD2-CG 4.24Å; L334-F385 HydrophobicContact CD2-CD2 4.41Å; L334-F385 HydrophobicContact CD2-CE2 3.28Å; L334-F385 HydrophobicContact CD2-CZ 3.61Å; L334-F385 HydrophobicContact CG-CZ 4.49Å
335G87.3Confident87.2Confident19 Ų1965.2 Ų65.220%0.19637%0.372CS..THydrogen-bonded Turntrans80.6-139.7-172.600000112R332 L391 Q394R332-G335 PolarHBondContact O-N 3.46Å; G335-L391 WeakPolarHBondContact O-CD2 3.49Å; G335-Q394 PolarHBondContact O-NE2 3.39Å
336D84.4Confident87.5Confident135 Ų13566 Ų6672%0.72235%0.352SS*.THydrogen-bonded Turntrans-88.6-3.5179.361.6-18.8000113.9
337R88.3Confident87.8Confident120 Ų12065.8 Ų65.845%0.45335%0.35SS..SBendtrans-69.2133.5180-64.5179.3-69177-5.5111.7L334 F339 F342 F385L334-R337 HydrophobicContact CD1-CB 4.12Å; L334-R337 WeakPolarHBondContact CD2-O 3.38Å; L334-R337 HydrophobicContact CG-CB 4.33Å; L334-R337 WeakPolarHBondContact CG-O 3.37Å; L334-R337 PolarHBondContact O-NE 2.85Å; L334-R337 PolarHBondContact O-NH2 2.8Å; L334-R337 VanDerWaalsContact O-NH2 3.09Å; R337-F339 PolarHBondContact O-N 3.41Å; R337-F342 HydrophobicContact CB-CE1 4.28Å; R337-F342 HydrophobicContact CB-CZ 4.18Å; R337-F385 VanDerWaalsContact O-CE1 3.3Å; R337-F385 WeakPolarHBondContact O-CE1 3.32Å; R337-F385 WeakPolarHBondContact O-CE2 3.32Å; R337-F385 WeakPolarHBondContact O-CZ 3.2Å
338D87.9Confident88Confident40 Ų4064.3 Ų64.321%0.21434%0.337CS..  trans-77.9106.3177.1-175.6-1.7000112.2N340 Q341 F385D338-N340 PolarHBondContact O-N 2.68Å; D338-N340 VanDerWaalsContact O-N 3.17Å; D338-N340 VanDerWaalsContact OD1-CB 3.31Å; D338-N340 WeakPolarHBondContact OD1-CB 3.41Å; D338-N340 PolarHBondContact OD1-N 3.45Å; D338-Q341 HydrophobicContact CB-CB 4.39Å; D338-Q341 HydrophobicContact CB-CG 4Å; D338-Q341 PolarHBondContact O-N 2.75Å; D338-Q341 VanDerWaalsContact O-N 3.09Å; D338-Q341 WeakPolarHBondContact OD2-CG 3.41Å; D338-Q341 PolarHBondContact OD2-NE2 3.49Å; D338-F385 HydrophobicContact CB-CD1 3.89Å; D338-F385 HydrophobicContact CB-CE1 4.19Å; D338-F385 HydrophobicContact CB-CG 4.37Å; D338-F385 WeakPolarHBondContact OD1-CG 3.32Å
339F90.1Very high88.6Confident0 Ų064.6 Ų64.60%033%0.334CS..G310 helixtrans-58.2-28.2177.7-174.3-111.4000112.7L334 R337 Q341 F342 K347 F350 L351 Q378 L381 E382 F385L334-F339 HydrophobicContact CD2-CB 3.77Å; R337-F339 PolarHBondContact O-N 3.41Å; F339-Q341 VanDerWaalsContact C-N 3.25Å; F339-Q341 PolarHBondContact O-N 3.42Å; F339-F342 AromaticContact CD2-CD2 3.92Å; F339-F342 HydrophobicContact CD2-CD2 3.92Å; F339-F342 HydrophobicContact CD2-CE2 4.24Å; F339-F342 HydrophobicContact CE2-CD2 4.31Å; F339-F342 WeakPolarHBondContact O-CB 3.03Å; F339-F342 PolarHBondContact O-N 3.14Å; F339-K347 HydrophobicContact CD2-CG 4.39Å; F339-K347 HydrophobicContact CE1-CD 4.09Å; F339-K347 HydrophobicContact CE1-CG 4.24Å; F339-K347 HydrophobicContact CE2-CB 4.01Å; F339-K347 HydrophobicContact CE2-CD 4.49Å; F339-K347 HydrophobicContact CE2-CG 3.76Å; F339-K347 HydrophobicContact CZ-CB 3.87Å; F339-K347 HydrophobicContact CZ-CD 3.97Å; F339-K347 HydrophobicContact CZ-CG 3.67Å; F339-K347 WeakPolarHBondContact O-CE 3.41Å; F339-F350 HydrophobicContact CD2-CD1 4.02Å; F339-F350 HydrophobicContact CD2-CE1 4.34Å; F339-F350 AromaticContact CE2-CD1 3.76Å; F339-F350 HydrophobicContact CE2-CD1 3.76Å; F339-F350 HydrophobicContact CE2-CE1 4.37Å; F339-L351 HydrophobicContact CE2-CG 4.38Å; F339-L351 HydrophobicContact CZ-CD1 4.1Å; F339-L351 HydrophobicContact CZ-CD2 4.35Å; F339-L351 HydrophobicContact CZ-CG 4.15Å; F339-Q378 HydrophobicContact CE1-CG 4.03Å; F339-Q378 HydrophobicContact CZ-CG 4.26Å; F339-L381 HydrophobicContact CB-CB 4.05Å; F339-L381 HydrophobicContact CB-CD1 4.41Å; F339-L381 HydrophobicContact CD1-CB 3.85Å; F339-L381 HydrophobicContact CD1-CD1 4.44Å; F339-L381 HydrophobicContact CD2-CD1 4.01Å; F339-L381 HydrophobicContact CE2-CD1 4.39Å; F339-L381 HydrophobicContact CG-CB 3.98Å; F339-L381 HydrophobicContact CG-CD1 4.04Å; F339-E382 HydrophobicContact CD1-CG 4.08Å; F339-E382 HydrophobicContact CE1-CG 4.08Å; F339-F385 HydrophobicContact CB-CD2 4.4Å; F339-F385 HydrophobicContact CB-CE2 4.39Å
340N88.4Confident89.1Confident63 Ų6362.1 Ų62.134%0.33732%0.321SS..G310 helixtrans-71.8-22-179.3-65.4-52.3000112.8D338 F342D338-N340 PolarHBondContact O-N 2.68Å; D338-N340 VanDerWaalsContact O-N 3.17Å; D338-N340 VanDerWaalsContact OD1-CB 3.31Å; D338-N340 WeakPolarHBondContact OD1-CB 3.41Å; D338-N340 PolarHBondContact OD1-N 3.45Å; N340-F342 VanDerWaalsContact C-N 3.33Å
341Q91.8Very high89.7Confident154 Ų15462 Ų6272%0.7232%0.32SS*.G310 helixtrans-81.4-13.7177.2-67.5175.925.900113.2D338 F339D338-Q341 HydrophobicContact CB-CB 4.39Å; D338-Q341 HydrophobicContact CB-CG 4Å; D338-Q341 PolarHBondContact O-N 2.75Å; D338-Q341 VanDerWaalsContact O-N 3.09Å; D338-Q341 WeakPolarHBondContact OD2-CG 3.41Å; D338-Q341 PolarHBondContact OD2-NE2 3.49Å; F339-Q341 VanDerWaalsContact C-N 3.25Å; F339-Q341 PolarHBondContact O-N 3.42Å
342F93.1Very high90.4Very high38 Ų3858.3 Ų58.317%0.16730%0.303CS..SBendtrans-68137.5178.6-71.712.4000110.3L334 R337 F339 N340 E346 K347 F350L334-F342 HydrophobicContact CD1-CE2 3.99Å; L334-F342 HydrophobicContact CD1-CZ 3.86Å; R337-F342 HydrophobicContact CB-CE1 4.28Å; R337-F342 HydrophobicContact CB-CZ 4.18Å; F339-F342 AromaticContact CD2-CD2 3.92Å; F339-F342 HydrophobicContact CD2-CD2 3.92Å; F339-F342 HydrophobicContact CD2-CE2 4.24Å; F339-F342 HydrophobicContact CE2-CD2 4.31Å; F339-F342 WeakPolarHBondContact O-CB 3.03Å; F339-F342 PolarHBondContact O-N 3.14Å; N340-F342 VanDerWaalsContact C-N 3.33Å; F342-E346 HydrophobicContact CB-CB 3.79Å; F342-E346 HydrophobicContact CD2-CB 4.12Å; F342-E346 HydrophobicContact CG-CB 4.04Å; F342-K347 HydrophobicContact CB-CG 3.58Å; F342-K347 VanDerWaalsContact O-CE 3.3Å; F342-K347 WeakPolarHBondContact O-CE 3.35Å; F342-F350 HydrophobicContact CD2-CB 4.35Å; F342-F350 HydrophobicContact CE2-CB 4.09Å; F342-F350 HydrophobicContact CE2-CD2 4.17Å; F342-F350 HydrophobicContact CE2-CG 4.02Å
343S93.4Very high91.2Very high62 Ų6253.6 Ų53.643%0.43429%0.29SS..  trans-60.3163.7165.266.80000111.1G345 E346 K347S343-G345 VanDerWaalsContact C-N 3.25Å; S343-G345 PolarHBondContact O-N 2.97Å; S343-E346 VanDerWaalsContact CB-OE2 3.23Å; S343-E346 WeakPolarHBondContact CB-OE2 3.39Å; S343-E346 PolarHBondContact N-OE2 3.34Å; S343-E346 PolarHBondContact O-N 2.96Å; S343-E346 WeakPolarHBondContact OG-CG 3.35Å; S343-E346 PolarHBondContact OG-N 3.19Å; S343-E346 PolarHBondContact OG-OE2 3.02Å; S343-K347 WeakPolarHBondContact O-CG 3.49Å; S343-K347 PolarHBondContact O-N 3.44Å
344S89.7Confident91.5Very high87 Ų8751.4 Ų51.461%0.60828%0.28SS*.Hα-helixtrans-53.6-42.7176.8-176.50000112.5K347 N348S344-K347 PolarHBondContact O-N 3.36Å; S344-N348 PolarHBondContact O-N 3.3Å; S344-N348 PolarHBondContact O-ND2 2.94Å; S344-N348 PolarHBondContact O-OD1 3.3Å
345G88.7Confident92Very high28 Ų2851.5 Ų51.529%0.28928%0.281SS..Hα-helixtrans-65.4-43.6177.800000112.9S343 N348 I349S343-G345 VanDerWaalsContact C-N 3.25Å; S343-G345 PolarHBondContact O-N 2.97Å; G345-N348 PolarHBondContact O-N 3.1Å; G345-I349 WeakPolarHBondContact O-CG1 3.4Å; G345-I349 PolarHBondContact O-N 3.07Å
346E92.3Very high92.5Very high102 Ų10250.6 Ų50.648%0.47727%0.272SS..Hα-helixtrans-64.1-41.2176.7-72.8164.5131.400111.9F342 S343 N348 I349 F350F342-E346 HydrophobicContact CB-CB 3.79Å; F342-E346 HydrophobicContact CD2-CB 4.12Å; F342-E346 HydrophobicContact CG-CB 4.04Å; S343-E346 VanDerWaalsContact CB-OE2 3.23Å; S343-E346 WeakPolarHBondContact CB-OE2 3.39Å; S343-E346 PolarHBondContact N-OE2 3.34Å; S343-E346 PolarHBondContact O-N 2.96Å; S343-E346 WeakPolarHBondContact OG-CG 3.35Å; S343-E346 PolarHBondContact OG-N 3.19Å; S343-E346 PolarHBondContact OG-OE2 3.02Å; E346-N348 VanDerWaalsContact C-N 3.32Å; E346-N348 PolarHBondContact O-N 2.99Å; E346-I349 PolarHBondContact O-N 3.33Å; E346-F350 WeakPolarHBondContact O-CB 3.33Å; E346-F350 PolarHBondContact O-N 3.44Å
347K93.1Very high93.1Very high49 Ų4945.9 Ų45.921%0.21325%0.245CC..Hα-helixtrans-59.2-44.2173.4-70.3-176.2175179.30111.3F339 F342 S343 S344 L351F339-K347 HydrophobicContact CD2-CG 4.39Å; F339-K347 HydrophobicContact CE1-CD 4.09Å; F339-K347 HydrophobicContact CE1-CG 4.24Å; F339-K347 HydrophobicContact CE2-CB 4.01Å; F339-K347 HydrophobicContact CE2-CD 4.49Å; F339-K347 HydrophobicContact CE2-CG 3.76Å; F339-K347 HydrophobicContact CZ-CB 3.87Å; F339-K347 HydrophobicContact CZ-CD 3.97Å; F339-K347 HydrophobicContact CZ-CG 3.67Å; F339-K347 WeakPolarHBondContact O-CE 3.41Å; F342-K347 HydrophobicContact CB-CG 3.58Å; F342-K347 VanDerWaalsContact O-CE 3.3Å; F342-K347 WeakPolarHBondContact O-CE 3.35Å; S343-K347 WeakPolarHBondContact O-CG 3.49Å; S343-K347 PolarHBondContact O-N 3.44Å; S344-K347 PolarHBondContact O-N 3.36Å; K347-L351 WeakPolarHBondContact O-CB 3.49Å; K347-L351 VanDerWaalsContact O-CG 3.25Å; K347-L351 WeakPolarHBondContact O-CG 3.4Å; K347-L351 PolarHBondContact O-N 3.49Å
348N91.9Very high93.5Very high30 Ų3040.6 Ų40.616%0.1623%0.225CC..Hα-helixtrans-64-49.5-179.8-70.4-16.6000112.1R233 S344 G345 E346 L351 A352R233-N348 PolarHBondContact NE-OD1 3.5Å; R233-N348 PolarHBondContact NH1-OD1 2.74Å; R233-N348 PolarHBondContact NH2-OD1 3.48Å; S344-N348 PolarHBondContact O-N 3.3Å; S344-N348 PolarHBondContact O-ND2 2.94Å; S344-N348 PolarHBondContact O-OD1 3.3Å; G345-N348 PolarHBondContact O-N 3.1Å; E346-N348 VanDerWaalsContact C-N 3.32Å; E346-N348 PolarHBondContact O-N 2.99Å; N348-L351 PolarHBondContact O-N 3.43Å; N348-A352 WeakPolarHBondContact O-CB 3.39Å; N348-A352 PolarHBondContact O-N 3.38Å
349I92.9Very high93.9Very high65 Ų6538.7 Ų38.733%0.33322%0.215SC..Hα-helixtrans-63.4-43.7179.2-66.8173000110.5Y26 F252 G345 E346 A352 S353Y26-I349 HydrophobicContact CD1-CD1 3.74Å; Y26-I349 HydrophobicContact CD1-CG1 3.98Å; Y26-I349 HydrophobicContact CE1-CD1 4.11Å; Y26-I349 HydrophobicContact CE1-CG1 3.92Å; F252-I349 HydrophobicContact CE1-CG2 4.08Å; G345-I349 WeakPolarHBondContact O-CG1 3.4Å; G345-I349 PolarHBondContact O-N 3.07Å; E346-I349 PolarHBondContact O-N 3.33Å; I349-A352 PolarHBondContact O-N 3.04Å; I349-S353 WeakPolarHBondContact O-CB 3.22Å; I349-S353 PolarHBondContact O-N 3.5Å
350F95Very high94.2Very high15 Ų1540.2 Ų40.27%0.06622%0.221CC..Hα-helixtrans-61.5-46.8178.7176.8-95.2000111.9F333 L334 F339 F342 E346 A352 S353 F354 Y377 L381F333-F350 HydrophobicContact CD1-CE1 4.36Å; F333-F350 AromaticContact CD1-CE2 3.75Å; F333-F350 HydrophobicContact CD1-CE2 3.75Å; F333-F350 AromaticContact CD1-CZ 3.52Å; F333-F350 HydrophobicContact CD1-CZ 3.52Å; F333-F350 HydrophobicContact CE1-CD2 4.38Å; F333-F350 AromaticContact CE1-CE2 3.77Å; F333-F350 HydrophobicContact CE1-CE2 3.77Å; F333-F350 AromaticContact CE1-CZ 3.92Å; F333-F350 HydrophobicContact CE1-CZ 3.92Å; L334-F350 HydrophobicContact CB-CE1 4.39Å; L334-F350 HydrophobicContact CB-CE2 4.3Å; L334-F350 HydrophobicContact CB-CZ 3.63Å; L334-F350 HydrophobicContact CD1-CD2 4.26Å; L334-F350 HydrophobicContact CD1-CE1 3.94Å; L334-F350 HydrophobicContact CD1-CE2 3.67Å; L334-F350 HydrophobicContact CD1-CZ 3.48Å; L334-F350 VanDerWaalsContact CD1-CZ 3.48Å; L334-F350 HydrophobicContact CG-CZ 4.12Å; F339-F350 HydrophobicContact CD2-CD1 4.02Å; F339-F350 HydrophobicContact CD2-CE1 4.34Å; F339-F350 AromaticContact CE2-CD1 3.76Å; F339-F350 HydrophobicContact CE2-CD1 3.76Å; F339-F350 HydrophobicContact CE2-CE1 4.37Å; F342-F350 HydrophobicContact CD2-CB 4.35Å; F342-F350 HydrophobicContact CE2-CB 4.09Å; F342-F350 HydrophobicContact CE2-CD2 4.17Å; F342-F350 HydrophobicContact CE2-CG 4.02Å; E346-F350 WeakPolarHBondContact O-CB 3.33Å; E346-F350 PolarHBondContact O-N 3.44Å; F350-A352 VanDerWaalsContact C-N 3.35Å; F350-A352 PolarHBondContact O-N 3.25Å; F350-S353 WeakPolarHBondContact O-CB 3.49Å; F350-S353 PolarHBondContact O-N 2.9Å; F350-F354 PolarHBondContact O-N 2.91Å; F350-Y377 AromaticContact CE1-CE1 3.91Å; F350-Y377 HydrophobicContact CE1-CE1 3.91Å; F350-Y377 HydrophobicContact CZ-CE1 4.29Å; F350-L381 HydrophobicContact CD1-CD1 4.48Å; F350-L381 HydrophobicContact CE1-CD1 3.61Å; F350-L381 HydrophobicContact CZ-CD1 4.38Å
351L96Very high94.6Very high14 Ų1438.3 Ų38.37%0.07321%0.209CC..Hα-helixtrans-65.9-37.1177-71.1171.6000111.9F339 K347 N348 S353 F354 V355 Y377 Q378F339-L351 HydrophobicContact CE2-CG 4.38Å; F339-L351 HydrophobicContact CZ-CD1 4.1Å; F339-L351 HydrophobicContact CZ-CD2 4.35Å; F339-L351 HydrophobicContact CZ-CG 4.15Å; K347-L351 WeakPolarHBondContact O-CB 3.49Å; K347-L351 VanDerWaalsContact O-CG 3.25Å; K347-L351 WeakPolarHBondContact O-CG 3.4Å; K347-L351 PolarHBondContact O-N 3.49Å; N348-L351 PolarHBondContact O-N 3.43Å; L351-S353 VanDerWaalsContact C-N 3.32Å; L351-S353 PolarHBondContact O-N 3.25Å; L351-F354 PolarHBondContact O-N 2.95Å; L351-V355 VanDerWaalsContact O-CG2 3.29Å; L351-V355 WeakPolarHBondContact O-CG2 3.49Å; L351-V355 PolarHBondContact O-N 3.42Å; L351-Y377 HydrophobicContact CD2-CD1 4.49Å; L351-Q378 HydrophobicContact CD1-CB 4.24Å; L351-Q378 HydrophobicContact CD1-CG 3.95Å; L351-Q378 HydrophobicContact CD2-CB 3.94Å; L351-Q378 HydrophobicContact CD2-CG 4.37Å
352A96.6Very high94.7Very high23 Ų2331.7 Ų31.719%0.1918%0.178CC..Hα-helixtrans-63.5-38.9173.500000111.7V240 F252 N348 I349 F350 V355 H356V240-A352 HydrophobicContact CG2-CB 4.49Å; F252-A352 VanDerWaalsContact CE2-C 3.49Å; F252-A352 HydrophobicContact CE2-CB 3.94Å; F252-A352 HydrophobicContact CZ-CB 3.77Å; N348-A352 WeakPolarHBondContact O-CB 3.39Å; N348-A352 PolarHBondContact O-N 3.38Å; I349-A352 PolarHBondContact O-N 3.04Å; F350-A352 VanDerWaalsContact C-N 3.35Å; F350-A352 PolarHBondContact O-N 3.25Å; A352-V355 PolarHBondContact O-N 3.22Å; A352-H356 WeakPolarHBondContact O-CB 3.43Å; A352-H356 PolarHBondContact O-N 2.97Å
353S97.1Very high94.7Very high28 Ų2830.9 Ų30.920%0.19618%0.177CC..Hα-helixtrans-65.2-41.4173.9-174.10000112I349 F350 L351 H356 E357I349-S353 WeakPolarHBondContact O-CB 3.22Å; I349-S353 PolarHBondContact O-N 3.5Å; F350-S353 WeakPolarHBondContact O-CB 3.49Å; F350-S353 PolarHBondContact O-N 2.9Å; L351-S353 VanDerWaalsContact C-N 3.32Å; L351-S353 PolarHBondContact O-N 3.25Å; S353-H356 WeakPolarHBondContact O-CB 3.39Å; S353-H356 PolarHBondContact O-N 3.37Å; S353-E357 WeakPolarHBondContact O-CG 3.28Å; S353-E357 PolarHBondContact O-N 3.49Å
354F96.4Very high94.6Very high4 Ų430.9 Ų30.92%0.01817%0.17CC..Hα-helixtrans-60-47.4171.9176-91.1000111.4L330 F333 F350 L351 H356 E357 Y358 V373 A374 Y377L330-F354 HydrophobicContact CB-CE2 4.43Å; L330-F354 HydrophobicContact CD1-CD2 3.67Å; L330-F354 HydrophobicContact CD1-CE2 3.69Å; L330-F354 HydrophobicContact CD1-CG 4.39Å; L330-F354 HydrophobicContact CD1-CZ 4.41Å; F333-F354 HydrophobicContact CB-CD2 4.39Å; F333-F354 HydrophobicContact CD1-CB 3.92Å; F333-F354 AromaticContact CD1-CD2 3.75Å; F333-F354 HydrophobicContact CD1-CD2 3.75Å; F333-F354 HydrophobicContact CD1-CG 4.35Å; F333-F354 HydrophobicContact CE1-CB 3.69Å; F333-F354 HydrophobicContact CE1-CD2 4.33Å; F333-F354 HydrophobicContact CG-CD2 4.17Å; F350-F354 PolarHBondContact O-N 2.91Å; L351-F354 PolarHBondContact O-N 2.95Å; F354-H356 VanDerWaalsContact C-N 3.32Å; F354-H356 PolarHBondContact O-N 3.5Å; F354-E357 PolarHBondContact O-N 3.39Å; F354-Y358 HydrophobicContact CZ-CD2 4.18Å; F354-Y358 VanDerWaalsContact O-CB 3.29Å; F354-Y358 WeakPolarHBondContact O-CB 3.23Å; F354-Y358 PolarHBondContact O-N 3.45Å; F354-V373 HydrophobicContact CE1-CG1 4.31Å; F354-V373 HydrophobicContact CZ-CG1 4.3Å; F354-A374 HydrophobicContact CD1-CB 4.18Å; F354-A374 HydrophobicContact CE1-CB 4.19Å; F354-Y377 HydrophobicContact CB-CD1 4.44Å; F354-Y377 HydrophobicContact CB-CE1 4.33Å; F354-Y377 AromaticContact CD1-CD1 3.86Å; F354-Y377 HydrophobicContact CD1-CD1 3.86Å; F354-Y377 HydrophobicContact CD1-CE1 4.45Å; F354-Y377 HydrophobicContact CD1-CG 4.42Å; F354-Y377 AromaticContact CD2-CD1 3.48Å; F354-Y377 HydrophobicContact CD2-CD1 3.48Å; F354-Y377 VanDerWaalsContact CD2-CD1 3.48Å; F354-Y377 AromaticContact CD2-CE1 3.3Å; F354-Y377 HydrophobicContact CD2-CE1 3.3Å; F354-Y377 HydrophobicContact CD2-CE2 4.45Å; F354-Y377 HydrophobicContact CD2-CG 4.13Å; F354-Y377 AromaticContact CD2-CZ 3.86Å; F354-Y377 AromaticContact CE1-CD1 3.91Å; F354-Y377 HydrophobicContact CE1-CD1 3.91Å; F354-Y377 HydrophobicContact CE1-CG 4Å; F354-Y377 AromaticContact CE2-CD1 3.51Å; F354-Y377 HydrophobicContact CE2-CD1 3.51Å; F354-Y377 AromaticContact CE2-CD2 3.87Å; F354-Y377 HydrophobicContact CE2-CD2 3.87Å; F354-Y377 AromaticContact CE2-CE1 3.59Å; F354-Y377 HydrophobicContact CE2-CE1 3.59Å; F354-Y377 AromaticContact CE2-CE2 3.97Å; F354-Y377 HydrophobicContact CE2-CE2 3.97Å; F354-Y377 AromaticContact CE2-CG 3.65Å; F354-Y377 HydrophobicContact CE2-CG 3.65Å; F354-Y377 AromaticContact CE2-CZ 3.84Å; F354-Y377 AromaticContact CG-CD1 3.65Å; F354-Y377 HydrophobicContact CG-CD1 3.65Å; F354-Y377 AromaticContact CG-CE1 3.78Å; F354-Y377 HydrophobicContact CG-CE1 3.78Å; F354-Y377 HydrophobicContact CG-CG 4.48Å; F354-Y377 AromaticContact CZ-CD1 3.73Å; F354-Y377 HydrophobicContact CZ-CD1 3.73Å; F354-Y377 HydrophobicContact CZ-CD2 4.04Å; F354-Y377 HydrophobicContact CZ-CE1 4.3Å; F354-Y377 AromaticContact CZ-CG 3.59Å; F354-Y377 HydrophobicContact CZ-CG 3.59Å
355V97.8Very high94.7Very high6 Ų627 Ų274%0.03614%0.142CC..Hα-helixtrans-59-451771720000110.2V240 T241 L351 A352 Y358 S359 I370 L371 A374V240-V355 HydrophobicContact CB-CG1 4.2Å; V240-V355 HydrophobicContact CG1-CB 4.16Å; V240-V355 HydrophobicContact CG1-CG1 3.79Å; T241-V355 VanDerWaalsContact OG1-CG1 3.23Å; T241-V355 WeakPolarHBondContact OG1-CG1 3.32Å; L351-V355 VanDerWaalsContact O-CG2 3.29Å; L351-V355 WeakPolarHBondContact O-CG2 3.49Å; L351-V355 PolarHBondContact O-N 3.42Å; A352-V355 PolarHBondContact O-N 3.22Å; V355-Y358 PolarHBondContact O-N 3.21Å; V355-S359 WeakPolarHBondContact O-CB 3.42Å; V355-S359 PolarHBondContact O-N 3.01Å; V355-S359 PolarHBondContact O-OG 3.12Å; V355-I370 HydrophobicContact CG1-CG2 4.29Å; V355-L371 HydrophobicContact CG1-CD2 4.46Å; V355-A374 HydrophobicContact CG2-CB 3.56Å
356H98.1Very high95Very high0 Ų025.9 Ų25.90%013%0.13CC..Hα-helixtrans-57-54.7176.4167.770.3000112.1V240 S244 V250 F252 A352 S353 F354 Y358 S359 R360V240-H356 HydrophobicContact CG1-CB 4Å; S244-H356 WeakPolarHBondContact OG-CA 3.34Å; S244-H356 PolarHBondContact OG-ND1 3.3Å; V250-H356 PolarHBondContact O-CE1 3.23Å; V250-H356 PolarHBondContact O-NE2 2.98Å; F252-H356 HydrophobicContact CD2-CB 3.58Å; F252-H356 AromaticContact CD2-CG 3.83Å; F252-H356 HydrophobicContact CE2-CB 4.2Å; F252-H356 HydrophobicContact CG-CB 4.49Å; F252-H356 PolarHBondContact N-NE2 3.29Å; A352-H356 WeakPolarHBondContact O-CB 3.43Å; A352-H356 PolarHBondContact O-N 2.97Å; S353-H356 WeakPolarHBondContact O-CB 3.39Å; S353-H356 PolarHBondContact O-N 3.37Å; F354-H356 VanDerWaalsContact C-N 3.32Å; F354-H356 PolarHBondContact O-N 3.5Å; H356-Y358 VanDerWaalsContact C-N 3.33Å; H356-Y358 PolarHBondContact O-N 2.78Å; H356-S359 PolarHBondContact O-N 3.19Å; H356-R360 PolarHBondContact NE2-NH1 3.45Å; H356-R360 WeakPolarHBondContact O-CG 3.34Å; H356-R360 PolarHBondContact O-N 3.21Å
357E97.1Very high95.2Very high35 Ų3522.1 Ų22.116%0.16411%0.114CC..Hα-helixtrans-64.5-38-177.2-73.5-65.3125.200111.7L330 F333 S353 F354 R360 R361L330-E357 HydrophobicContact CD1-CB 3.8Å; L330-E357 HydrophobicContact CD2-CB 3.72Å; L330-E357 HydrophobicContact CG-CB 4.45Å; F333-E357 HydrophobicContact CE2-CB 4.24Å; F333-E357 HydrophobicContact CE2-CG 3.93Å; F333-E357 HydrophobicContact CZ-CG 4.19Å; S353-E357 WeakPolarHBondContact O-CG 3.28Å; S353-E357 PolarHBondContact O-N 3.49Å; F354-E357 PolarHBondContact O-N 3.39Å; E357-R360 WeakPolarHBondContact O-CG 3.21Å; E357-R360 IonicContact OE1-NH1 3.86Å; E357-R360 PolarHBondContact OE1-NH1 3.01Å; E357-R361 VanDerWaalsContact O-CD 3.29Å; E357-R361 WeakPolarHBondContact O-CD 3.39Å; E357-R361 WeakPolarHBondContact O-CG 3.38Å; E357-R361 PolarHBondContact O-NH1 3.13Å; E357-R361 IonicContact OE2-CZ 3.83Å; E357-R361 IonicContact OE2-NH1 2.68Å; E357-R361 PolarHBondContact OE2-NH1 3.26Å; E357-R361 IonicContact OE2-NH2 2.91Å; E357-R361 PolarHBondContact OE2-NH2 3.23Å
358Y96.3Very high95.2Very high9 Ų920.1 Ų20.14%0.03511%0.106CC..Hα-helixtrans-70.9-44.8177.3-160.3-96.2000110.7L330 F354 V355 H356 R360 R361 H362 L365 I370 V373 I405L330-Y358 HydrophobicContact CD1-CD2 4.11Å; L330-Y358 HydrophobicContact CG-CD2 4.39Å; F354-Y358 HydrophobicContact CZ-CD2 4.18Å; F354-Y358 VanDerWaalsContact O-CB 3.29Å; F354-Y358 WeakPolarHBondContact O-CB 3.23Å; F354-Y358 PolarHBondContact O-N 3.45Å; V355-Y358 PolarHBondContact O-N 3.21Å; H356-Y358 VanDerWaalsContact C-N 3.33Å; H356-Y358 PolarHBondContact O-N 2.78Å; Y358-R360 PolarHBondContact O-N 3.49Å; Y358-R361 PolarHBondContact O-N 3.41Å; Y358-H362 AromaticContact CD1-CD2 3.84Å; Y358-H362 AromaticContact CE1-CD2 3.65Å; Y358-H362 AromaticContact CE2-NE2 3.89Å; Y358-H362 AromaticContact CZ-CD2 3.75Å; Y358-H362 AromaticContact CZ-NE2 3.77Å; Y358-H362 PolarHBondContact O-CD2 3.38Å; Y358-H362 PolarHBondContact O-N 2.91Å; Y358-L365 HydrophobicContact CE1-CD1 4.28Å; Y358-I370 HydrophobicContact CD1-CD1 3.49Å; Y358-I370 VanDerWaalsContact CD1-CD1 3.49Å; Y358-I370 HydrophobicContact CD1-CG2 4.36Å; Y358-I370 HydrophobicContact CE1-CD1 3.77Å; Y358-V373 HydrophobicContact CD1-CG1 4.25Å; Y358-V373 HydrophobicContact CD2-CG1 4.47Å; Y358-V373 HydrophobicContact CE1-CB 4.13Å; Y358-V373 HydrophobicContact CE1-CG1 3.81Å; Y358-V373 HydrophobicContact CE1-CG2 4.14Å; Y358-V373 HydrophobicContact CE2-CG1 4.04Å; Y358-I405 VanDerWaalsContact OH-CD1 3.27Å; Y358-I405 WeakPolarHBondContact OH-CD1 3.49Å
359S97.2Very high95.4Very high0 Ų018.7 Ų18.70%010%0.099CC..Hα-helixtrans-60.4-48-178.9-620000113T241 V355 H356 R361 H362 I370T241-S359 WeakPolarHBondContact CA-OG 3.46Å; T241-S359 WeakPolarHBondContact CG2-OG 3.37Å; V355-S359 WeakPolarHBondContact O-CB 3.42Å; V355-S359 PolarHBondContact O-N 3.01Å; V355-S359 PolarHBondContact O-OG 3.12Å; H356-S359 PolarHBondContact O-N 3.19Å; S359-R361 PolarHBondContact O-N 3.21Å; S359-H362 CarbonylContact O-C 3.57Å; S359-H362 PolarHBondContact O-N 3.17Å; S359-I370 WeakPolarHBondContact OG-CG2 3.42Å
360R96.3Very high95.6Very high32 Ų3215.6 Ų15.612%0.1218%0.083CC..Hα-helixtrans-65.5-22.9-179.170.9-171.2-62.3-168.95.3113.4S244 T248 K249 V250 P323 H356 E357 Y358S244-R360 WeakPolarHBondContact O-CA 3.38Å; S244-R360 WeakPolarHBondContact O-CB 3.46Å; T248-R360 PolarHBondContact O-NE 2.04Å; T248-R360 PolarHBondContact O-NH2 2.67Å; K249-R360 PolarHBondContact O-NH2 3.04Å; K249-R360 VanDerWaalsContact O-NH2 3.12Å; V250-R360 PolarHBondContact O-NH2 3.39Å; P323-R360 WeakPolarHBondContact CD-O 3.27Å; H356-R360 PolarHBondContact NE2-NH1 3.45Å; H356-R360 WeakPolarHBondContact O-CG 3.34Å; H356-R360 PolarHBondContact O-N 3.21Å; E357-R360 WeakPolarHBondContact O-CG 3.21Å; E357-R360 IonicContact OE1-NH1 3.86Å; E357-R360 PolarHBondContact OE1-NH1 3.01Å; Y358-R360 PolarHBondContact O-N 3.49Å
361R95.1Very high95.7Very high23 Ų2315.5 Ų15.59%0.0878%0.083CC..Hα-helixtrans-81.8-17.6173.8-74.6164.8177.272.8-6.1113.1K322 L326 S327 E357 Y358 S359 P363K322-R361 WeakPolarHBondContact CD-O 3.38Å; L326-R361 HydrophobicContact CB-CG 4.17Å; L326-R361 HydrophobicContact CD1-CG 4.3Å; S327-R361 WeakPolarHBondContact O-CD 3.34Å; S327-R361 PolarHBondContact O-NE 2.97Å; E357-R361 VanDerWaalsContact O-CD 3.29Å; E357-R361 WeakPolarHBondContact O-CD 3.39Å; E357-R361 WeakPolarHBondContact O-CG 3.38Å; E357-R361 PolarHBondContact O-NH1 3.13Å; E357-R361 IonicContact OE2-CZ 3.83Å; E357-R361 IonicContact OE2-NH1 2.68Å; E357-R361 PolarHBondContact OE2-NH1 3.26Å; E357-R361 IonicContact OE2-NH2 2.91Å; E357-R361 PolarHBondContact OE2-NH2 3.23Å; Y358-R361 PolarHBondContact O-N 3.41Å; S359-R361 PolarHBondContact O-N 3.21Å; R361-P363 VanDerWaalsContact C-CD 3.46Å
362H94.1Very high95.7Very high15 Ų1515 Ų157%0.0698%0.08CC..  trans-132.257.2-172.1-65.2-71.9000112.3Q245 P328 Y358 S359 Q364 L365 I370Q245-H362 PolarHBondContact NE2-O 3.12Å; P328-H362 PolarHBondContact O-NE2 2.88Å; Y358-H362 AromaticContact CD1-CD2 3.84Å; Y358-H362 AromaticContact CE1-CD2 3.65Å; Y358-H362 AromaticContact CE2-NE2 3.89Å; Y358-H362 AromaticContact CZ-CD2 3.75Å; Y358-H362 AromaticContact CZ-NE2 3.77Å; Y358-H362 PolarHBondContact O-CD2 3.38Å; Y358-H362 PolarHBondContact O-N 2.91Å; S359-H362 CarbonylContact O-C 3.57Å; S359-H362 PolarHBondContact O-N 3.17Å; H362-Q364 PolarHBondContact ND1-NE2 3.45Å; H362-Q364 PolarHBondContact O-N 3.4Å; H362-Q364 VanDerWaalsContact O-N 3.09Å; H362-L365 HydrophobicContact CB-CB 4.26Å; H362-L365 HydrophobicContact CB-CD1 3.65Å; H362-L365 HydrophobicContact CB-CG 3.84Å; H362-L365 PolarHBondContact O-N 2.91Å; H362-L365 VanDerWaalsContact O-N 3.15Å; H362-I370 HydrophobicContact CB-CD1 4.02Å
363P93.2Very high95.7Very high22 Ų2213.9 Ų13.914%0.1437%0.071CC..THydrogen-bonded Turntrans-63.4-14.5-179.928.3-36000114.1T248 N319 K322 R361T248-P363 HydrophobicContact CG2-CB 4.39Å; N319-P363 HydrophobicContact CB-CB 4.29Å; N319-P363 PolarHBondContact ND2-O 2.92Å; K322-P363 HydrophobicContact CB-CG 4.22Å; R361-P363 VanDerWaalsContact C-CD 3.46Å
364Q90.9Very high95.6Very high61 Ų6113.1 Ų13.129%0.2857%0.066SC..THydrogen-bonded Turntrans-86.7-18.2178.381.5-71.30.200114H362 D467H362-Q364 PolarHBondContact ND1-NE2 3.45Å; H362-Q364 PolarHBondContact O-N 3.4Å; H362-Q364 VanDerWaalsContact O-N 3.09Å; Q364-D467 HydrophobicContact CB-CB 4.08Å; Q364-D467 WeakPolarHBondContact CB-O 3.35Å
365L93.6Very high95.6Very high5 Ų516.6 Ų16.63%0.0268%0.081CC..SBendtrans-81.3146.2-178.9-64.8-176.1000111.2Q245 Y358 H362 I370 I405 L470Q245-L365 PolarHBondContact NE2-O 3.37Å; Y358-L365 HydrophobicContact CE1-CD1 4.28Å; H362-L365 HydrophobicContact CB-CB 4.26Å; H362-L365 HydrophobicContact CB-CD1 3.65Å; H362-L365 HydrophobicContact CB-CG 3.84Å; H362-L365 PolarHBondContact O-N 2.91Å; H362-L365 VanDerWaalsContact O-N 3.15Å; L365-I370 HydrophobicContact CB-CD1 3.89Å; L365-I370 HydrophobicContact CB-CG1 4.14Å; L365-I370 HydrophobicContact CD1-CD1 3.9Å; L365-I370 HydrophobicContact CG-CD1 4.49Å; L365-I405 HydrophobicContact CD1-CD1 3.67Å; L365-I405 HydrophobicContact CD1-CG1 3.95Å; L365-I405 HydrophobicContact CD2-CG1 4.46Å; L365-I405 HydrophobicContact CD2-CG2 4.12Å; L365-L470 HydrophobicContact CD2-CD2 3.53Å
366A94.2Very high95.4Very high5 Ų516.6 Ų16.64%0.0418%0.082CC..  trans-68.1148.2173.900000111.8S368 V369 I370 E474A366-S368 VanDerWaalsContact C-N 3.28Å; A366-S368 PolarHBondContact O-N 3.24Å; A366-V369 HydrophobicContact CB-CG2 3.91Å; A366-V369 WeakPolarHBondContact O-CA 3.13Å; A366-V369 WeakPolarHBondContact O-CB 3.46Å; A366-V369 PolarHBondContact O-N 2.96Å; A366-I370 PolarHBondContact O-N 2.85Å; A366-I370 VanDerWaalsContact O-N 3.13Å; A366-E474 HydrophobicContact CB-CB 3.34Å; A366-E474 HydrophobicContact CB-CG 3.97Å
367V95.6Very high95.2Very high23 Ų2316.6 Ų16.614%0.1398%0.082CC..Hα-helixtrans-52.9-46178.3176.20000111.9I238 T241 K242 V369 I370 L371I238-V367 HydrophobicContact CB-CG1 4.35Å; I238-V367 HydrophobicContact CG1-CG1 4.2Å; I238-V367 HydrophobicContact CG2-CG1 4.18Å; T241-V367 HydrophobicContact CG2-CB 4.18Å; T241-V367 HydrophobicContact CG2-CG1 4.03Å; T241-V367 HydrophobicContact CG2-CG2 3.96Å; K242-V367 HydrophobicContact CG-CG2 3.79Å; V367-V369 PolarHBondContact O-N 3.12Å; V367-I370 PolarHBondContact O-N 2.69Å; V367-L371 HydrophobicContact CG1-CD1 3.99Å; V367-L371 HydrophobicContact CG1-CG 4.26Å; V367-L371 WeakPolarHBondContact O-CG 3.16Å; V367-L371 PolarHBondContact O-N 2.89Å
368S94.6Very high95Very high7 Ų717.4 Ų17.45%0.0499%0.086CC..Hα-helixtrans-61.1-32178.959.90000113A366 R372A366-S368 VanDerWaalsContact C-N 3.28Å; A366-S368 PolarHBondContact O-N 3.24Å; S368-R372 VanDerWaalsContact O-CG 3.31Å; S368-R372 WeakPolarHBondContact O-CG 3.37Å; S368-R372 PolarHBondContact O-N 3.48Å; S368-R372 VanDerWaalsContact O-N 3.09Å
369V95.8Very high94.8Very high0 Ų020.3 Ų20.30%010%0.1CC..Hα-helixtrans-70.5-48.2176.6-178.80000110A366 V367 L371 R372 V373 I405 E474A366-V369 HydrophobicContact CB-CG2 3.91Å; A366-V369 WeakPolarHBondContact O-CA 3.13Å; A366-V369 WeakPolarHBondContact O-CB 3.46Å; A366-V369 PolarHBondContact O-N 2.96Å; V367-V369 PolarHBondContact O-N 3.12Å; V369-L371 VanDerWaalsContact C-N 3.28Å; V369-L371 PolarHBondContact O-N 3.34Å; V369-R372 PolarHBondContact O-N 2.9Å; V369-R372 VanDerWaalsContact O-N 3.14Å; V369-V373 PolarHBondContact O-N 3.5Å; V369-I405 HydrophobicContact CG1-CG1 3.78Å; V369-E474 HydrophobicContact CG2-CG 4.19Å
370I96.9Very high94.6Very high1 Ų121.4 Ų21.41%0.00511%0.106CC..Hα-helixtrans-56.1-45.4176.2-62.1-70.9000110.6T241 V355 Y358 S359 H362 L365 A366 V367 R372 V373 A374T241-I370 HydrophobicContact CG2-CB 3.9Å; T241-I370 HydrophobicContact CG2-CG1 3.96Å; T241-I370 HydrophobicContact CG2-CG2 3.87Å; V355-I370 HydrophobicContact CG1-CG2 4.29Å; Y358-I370 HydrophobicContact CD1-CD1 3.49Å; Y358-I370 VanDerWaalsContact CD1-CD1 3.49Å; Y358-I370 HydrophobicContact CD1-CG2 4.36Å; Y358-I370 HydrophobicContact CE1-CD1 3.77Å; S359-I370 WeakPolarHBondContact OG-CG2 3.42Å; H362-I370 HydrophobicContact CB-CD1 4.02Å; L365-I370 HydrophobicContact CB-CD1 3.89Å; L365-I370 HydrophobicContact CB-CG1 4.14Å; L365-I370 HydrophobicContact CD1-CD1 3.9Å; L365-I370 HydrophobicContact CG-CD1 4.49Å; A366-I370 PolarHBondContact O-N 2.85Å; A366-I370 VanDerWaalsContact O-N 3.13Å; V367-I370 PolarHBondContact O-N 2.69Å; I370-R372 VanDerWaalsContact C-N 3.33Å; I370-R372 PolarHBondContact O-N 3.33Å; I370-V373 WeakPolarHBondContact O-CB 3.16Å; I370-V373 PolarHBondContact O-N 3.07Å; I370-A374 PolarHBondContact O-N 2.98Å
371L97.4Very high94.3Very high13 Ų1319.9 Ų19.97%0.06810%0.1CC..Hα-helixtrans-69.7-28.9-179.7-64-176.5000113.3A237 I238 V355 V367 V369 K375 Y505 A506A237-L371 HydrophobicContact CB-CD2 3.71Å; I238-L371 HydrophobicContact CG1-CD1 3.69Å; V355-L371 HydrophobicContact CG1-CD2 4.46Å; V367-L371 HydrophobicContact CG1-CD1 3.99Å; V367-L371 HydrophobicContact CG1-CG 4.26Å; V367-L371 WeakPolarHBondContact O-CG 3.16Å; V367-L371 PolarHBondContact O-N 2.89Å; V369-L371 VanDerWaalsContact C-N 3.28Å; V369-L371 PolarHBondContact O-N 3.34Å; L371-K375 WeakPolarHBondContact O-CB 3.22Å; L371-K375 PolarHBondContact O-N 3.45Å; L371-Y505 HydrophobicContact CD1-CD1 3.86Å; L371-Y505 HydrophobicContact CD1-CE1 3.72Å; L371-A506 HydrophobicContact CB-CB 3.75Å
372R96.3Very high94.1Very high3 Ų321.7 Ų21.71%0.01111%0.11CC..Hα-helixtrans-67.4-41.8170-75.4-176.2-63.5140.911.1111.4S368 V369 I370 K375 G376 Y404 E407 E474 A506 N507S368-R372 VanDerWaalsContact O-CG 3.31Å; S368-R372 WeakPolarHBondContact O-CG 3.37Å; S368-R372 PolarHBondContact O-N 3.48Å; S368-R372 VanDerWaalsContact O-N 3.09Å; V369-R372 PolarHBondContact O-N 2.9Å; V369-R372 VanDerWaalsContact O-N 3.14Å; I370-R372 VanDerWaalsContact C-N 3.33Å; I370-R372 PolarHBondContact O-N 3.33Å; R372-K375 PolarHBondContact O-N 2.8Å; R372-G376 PolarHBondContact O-N 3.29Å; R372-Y404 HydrophobicContact CB-CD1 4.27Å; R372-Y404 HydrophobicContact CB-CG 4.15Å; R372-Y404 PolarHBondContact NH2-O 3.29Å; R372-E407 IonicContact NH1-OE2 2.69Å; R372-E474 IonicContact NH2-OE1 3.2Å; R372-A506 VanDerWaalsContact CD-O 3.28Å; R372-A506 WeakPolarHBondContact CD-O 3.23Å; R372-A506 HydrophobicContact CG-CB 3.82Å; R372-A506 VanDerWaalsContact CG-O 3.27Å; R372-A506 WeakPolarHBondContact CG-O 3.41Å; R372-N507 WeakPolarHBondContact CD-OD1 3.32Å; R372-N507 WeakPolarHBondContact CG-OD1 3.38Å
373V96.1Very high93.9Very high0 Ų027 Ų270%013%0.132CC..Hα-helixtrans-60.3-47.9173.2172.70000110.5F354 Y358 V369 I370 K375 G376 Y377 L401 Y404 I405F354-V373 HydrophobicContact CE1-CG1 4.31Å; F354-V373 HydrophobicContact CZ-CG1 4.3Å; Y358-V373 HydrophobicContact CD1-CG1 4.25Å; Y358-V373 HydrophobicContact CD2-CG1 4.47Å; Y358-V373 HydrophobicContact CE1-CB 4.13Å; Y358-V373 HydrophobicContact CE1-CG1 3.81Å; Y358-V373 HydrophobicContact CE1-CG2 4.14Å; Y358-V373 HydrophobicContact CE2-CG1 4.04Å; V369-V373 PolarHBondContact O-N 3.5Å; I370-V373 WeakPolarHBondContact O-CB 3.16Å; I370-V373 PolarHBondContact O-N 3.07Å; V373-K375 PolarHBondContact O-N 3.45Å; V373-G376 PolarHBondContact O-N 3.04Å; V373-Y377 WeakPolarHBondContact O-CB 3.46Å; V373-Y377 PolarHBondContact O-N 2.96Å; V373-L401 HydrophobicContact CG1-CB 4.22Å; V373-L401 HydrophobicContact CG1-CD1 4.13Å; V373-Y404 HydrophobicContact CG2-CD2 4.32Å; V373-I405 HydrophobicContact CG2-CG1 4.44Å
374A95.5Very high93.6Very high11 Ų1126 Ų269%0.09113%0.125CC..Hα-helixtrans-62.5-39.9178.800000112.9F354 V355 I370 Y377 Q378F354-A374 HydrophobicContact CD1-CB 4.18Å; F354-A374 HydrophobicContact CE1-CB 4.19Å; V355-A374 HydrophobicContact CG2-CB 3.56Å; I370-A374 PolarHBondContact O-N 2.98Å; A374-Y377 PolarHBondContact O-N 3Å; A374-Q378 PolarHBondContact O-N 3.02Å
375K94.7Very high93.1Very high78 Ų7824.9 Ų24.934%0.33912%0.12SC..Hα-helixtrans-64.2-46.9174.1-176175.3178.8-179.90111.6L371 R372 V373 Y377 Q378 E379L371-K375 WeakPolarHBondContact O-CB 3.22Å; L371-K375 PolarHBondContact O-N 3.45Å; R372-K375 PolarHBondContact O-N 2.8Å; V373-K375 PolarHBondContact O-N 3.45Å; K375-Y377 VanDerWaalsContact C-N 3.27Å; K375-Y377 PolarHBondContact O-N 3.38Å; K375-Q378 WeakPolarHBondContact O-CB 3.08Å; K375-Q378 PolarHBondContact O-N 3.21Å; K375-E379 WeakPolarHBondContact CE-OE1 3.44Å; K375-E379 WeakPolarHBondContact O-CG 3.35Å; K375-E379 PolarHBondContact O-N 2.86Å
376G94.5Very high92.6Very high5 Ų532 Ų325%0.05215%0.153CC..Hα-helixtrans-61.9-36.6175.900000112.4R372 V373 E379 L380 L401R372-G376 PolarHBondContact O-N 3.29Å; V373-G376 PolarHBondContact O-N 3.04Å; G376-E379 PolarHBondContact O-N 3.35Å; G376-L380 VanDerWaalsContact O-CB 3.32Å; G376-L380 WeakPolarHBondContact O-CB 3.41Å; G376-L380 PolarHBondContact O-N 3.08Å; G376-L401 VanDerWaalsContact C-CD2 3.45Å
377Y94.1Very high92.2Very high0 Ų034.8 Ų34.80%017%0.17CC..Hα-helixtrans-64.9-43.9174.6-175.5-114000111.6L334 F350 L351 F354 V373 A374 K375 E379 L380 L381 E398 L401L334-Y377 PolarHBondContact N-OH 3.07Å; F350-Y377 AromaticContact CE1-CE1 3.91Å; F350-Y377 HydrophobicContact CE1-CE1 3.91Å; F350-Y377 HydrophobicContact CZ-CE1 4.29Å; L351-Y377 HydrophobicContact CD2-CD1 4.49Å; F354-Y377 HydrophobicContact CB-CD1 4.44Å; F354-Y377 HydrophobicContact CB-CE1 4.33Å; F354-Y377 AromaticContact CD1-CD1 3.86Å; F354-Y377 HydrophobicContact CD1-CD1 3.86Å; F354-Y377 HydrophobicContact CD1-CE1 4.45Å; F354-Y377 HydrophobicContact CD1-CG 4.42Å; F354-Y377 AromaticContact CD2-CD1 3.48Å; F354-Y377 HydrophobicContact CD2-CD1 3.48Å; F354-Y377 VanDerWaalsContact CD2-CD1 3.48Å; F354-Y377 AromaticContact CD2-CE1 3.3Å; F354-Y377 HydrophobicContact CD2-CE1 3.3Å; F354-Y377 HydrophobicContact CD2-CE2 4.45Å; F354-Y377 HydrophobicContact CD2-CG 4.13Å; F354-Y377 AromaticContact CD2-CZ 3.86Å; F354-Y377 AromaticContact CE1-CD1 3.91Å; F354-Y377 HydrophobicContact CE1-CD1 3.91Å; F354-Y377 HydrophobicContact CE1-CG 4Å; F354-Y377 AromaticContact CE2-CD1 3.51Å; F354-Y377 HydrophobicContact CE2-CD1 3.51Å; F354-Y377 AromaticContact CE2-CD2 3.87Å; F354-Y377 HydrophobicContact CE2-CD2 3.87Å; F354-Y377 AromaticContact CE2-CE1 3.59Å; F354-Y377 HydrophobicContact CE2-CE1 3.59Å; F354-Y377 AromaticContact CE2-CE2 3.97Å; F354-Y377 HydrophobicContact CE2-CE2 3.97Å; F354-Y377 AromaticContact CE2-CG 3.65Å; F354-Y377 HydrophobicContact CE2-CG 3.65Å; F354-Y377 AromaticContact CE2-CZ 3.84Å; F354-Y377 AromaticContact CG-CD1 3.65Å; F354-Y377 HydrophobicContact CG-CD1 3.65Å; F354-Y377 AromaticContact CG-CE1 3.78Å; F354-Y377 HydrophobicContact CG-CE1 3.78Å; F354-Y377 HydrophobicContact CG-CG 4.48Å; F354-Y377 AromaticContact CZ-CD1 3.73Å; F354-Y377 HydrophobicContact CZ-CD1 3.73Å; F354-Y377 HydrophobicContact CZ-CD2 4.04Å; F354-Y377 HydrophobicContact CZ-CE1 4.3Å; F354-Y377 AromaticContact CZ-CG 3.59Å; F354-Y377 HydrophobicContact CZ-CG 3.59Å; V373-Y377 WeakPolarHBondContact O-CB 3.46Å; V373-Y377 PolarHBondContact O-N 2.96Å; A374-Y377 PolarHBondContact O-N 3Å; K375-Y377 VanDerWaalsContact C-N 3.27Å; K375-Y377 PolarHBondContact O-N 3.38Å; Y377-E379 PolarHBondContact O-N 3.14Å; Y377-L380 HydrophobicContact CD2-CD2 4.32Å; Y377-L380 WeakPolarHBondContact O-CB 3.37Å; Y377-L380 PolarHBondContact O-N 2.82Å; Y377-L381 HydrophobicContact CD1-CD1 3.95Å; Y377-L381 HydrophobicContact CD1-CG 4.34Å; Y377-L381 HydrophobicContact CD2-CG 4.49Å; Y377-L381 HydrophobicContact CE1-CD1 3.43Å; Y377-L381 VanDerWaalsContact CE1-CD1 3.43Å; Y377-L381 HydrophobicContact CE1-CD2 4.42Å; Y377-L381 HydrophobicContact CE1-CG 4.02Å; Y377-L381 HydrophobicContact CE2-CD1 4.44Å; Y377-L381 HydrophobicContact CE2-CD2 3.97Å; Y377-L381 HydrophobicContact CE2-CG 4.17Å; Y377-L381 WeakPolarHBondContact O-CG 3.48Å; Y377-L381 PolarHBondContact O-N 2.97Å; Y377-E398 HydrophobicContact CD2-CG 4.44Å; Y377-E398 HydrophobicContact CE2-CG 4.21Å; Y377-L401 HydrophobicContact CD2-CD1 3.94Å; Y377-L401 HydrophobicContact CG-CD1 4.31Å
378Q93.1Very high91.6Very high52 Ų5243.6 Ų43.624%0.24321%0.209CC..Hα-helixtrans-56.6-50.2173.2-176.6-171.3-25.700111.5F339 L351 A374 K375 L380 L381 E382F339-Q378 HydrophobicContact CE1-CG 4.03Å; F339-Q378 HydrophobicContact CZ-CG 4.26Å; L351-Q378 HydrophobicContact CD1-CB 4.24Å; L351-Q378 HydrophobicContact CD1-CG 3.95Å; L351-Q378 HydrophobicContact CD2-CB 3.94Å; L351-Q378 HydrophobicContact CD2-CG 4.37Å; A374-Q378 PolarHBondContact O-N 3.02Å; K375-Q378 WeakPolarHBondContact O-CB 3.08Å; K375-Q378 PolarHBondContact O-N 3.21Å; Q378-L380 VanDerWaalsContact C-N 3.26Å; Q378-L380 PolarHBondContact O-N 3.32Å; Q378-L381 PolarHBondContact O-N 2.75Å; Q378-E382 PolarHBondContact NE2-OE1 2.91Å; Q378-E382 WeakPolarHBondContact O-CG 3.47Å; Q378-E382 PolarHBondContact O-N 3.33Å
379E92.6Very high91.3Very high71 Ų7146.8 Ų46.833%0.33223%0.226SC..Hα-helixtrans-62.7-33.9179.3-68.7173.4-166.800112.2K375 G376 Y377 K383K375-E379 WeakPolarHBondContact CE-OE1 3.44Å; K375-E379 WeakPolarHBondContact O-CG 3.35Å; K375-E379 PolarHBondContact O-N 2.86Å; G376-E379 PolarHBondContact O-N 3.35Å; Y377-E379 PolarHBondContact O-N 3.14Å; E379-K383 WeakPolarHBondContact O-CD 3.44Å; E379-K383 VanDerWaalsContact O-CG 3.26Å; E379-K383 WeakPolarHBondContact O-CG 3.14Å; E379-K383 PolarHBondContact O-N 3.42Å
380L92.1Very high90.9Very high23 Ų2348.3 Ų48.312%0.1224%0.236CC..Hα-helixtrans-65-49.1174.2174.867000111.1G376 Y377 Q378 E382 K383 C384 G397 E398G376-L380 VanDerWaalsContact O-CB 3.32Å; G376-L380 WeakPolarHBondContact O-CB 3.41Å; G376-L380 PolarHBondContact O-N 3.08Å; Y377-L380 HydrophobicContact CD2-CD2 4.32Å; Y377-L380 WeakPolarHBondContact O-CB 3.37Å; Y377-L380 PolarHBondContact O-N 2.82Å; Q378-L380 VanDerWaalsContact C-N 3.26Å; Q378-L380 PolarHBondContact O-N 3.32Å; L380-E382 VanDerWaalsContact C-N 3.34Å; L380-E382 PolarHBondContact O-N 3.18Å; L380-K383 PolarHBondContact O-N 3.11Å; L380-K383 VanDerWaalsContact O-N 3.14Å; L380-C384 WeakPolarHBondContact CD1-SG 3.39Å; L380-C384 PolarHBondContact O-N 3.2Å; L380-C384 PolarHBondContact O-SG 2.92Å; L380-C384 VanDerWaalsContact O-SG 3.4Å; L380-G397 VanDerWaalsContact CD2-C 3.41Å; L380-E398 HydrophobicContact CD2-CG 4.44Å
381L91.1Very high90.5Very high0 Ų051.1 Ų51.10%025%0.251CS..Hα-helixtrans-60.3-44.4-179.9-68.7-176000111.6L334 F339 F350 Y377 Q378 K383 C384 F385 Q394L334-L381 HydrophobicContact CB-CD1 4.5Å; L334-L381 HydrophobicContact CB-CD2 4.15Å; L334-L381 HydrophobicContact CD2-CD1 3.99Å; L334-L381 HydrophobicContact CD2-CD2 3.57Å; L334-L381 HydrophobicContact CD2-CG 4.24Å; F339-L381 HydrophobicContact CB-CB 4.05Å; F339-L381 HydrophobicContact CB-CD1 4.41Å; F339-L381 HydrophobicContact CD1-CB 3.85Å; F339-L381 HydrophobicContact CD1-CD1 4.44Å; F339-L381 HydrophobicContact CD2-CD1 4.01Å; F339-L381 HydrophobicContact CE2-CD1 4.39Å; F339-L381 HydrophobicContact CG-CB 3.98Å; F339-L381 HydrophobicContact CG-CD1 4.04Å; F350-L381 HydrophobicContact CD1-CD1 4.48Å; F350-L381 HydrophobicContact CE1-CD1 3.61Å; F350-L381 HydrophobicContact CZ-CD1 4.38Å; Y377-L381 HydrophobicContact CD1-CD1 3.95Å; Y377-L381 HydrophobicContact CD1-CG 4.34Å; Y377-L381 HydrophobicContact CD2-CG 4.49Å; Y377-L381 HydrophobicContact CE1-CD1 3.43Å; Y377-L381 VanDerWaalsContact CE1-CD1 3.43Å; Y377-L381 HydrophobicContact CE1-CD2 4.42Å; Y377-L381 HydrophobicContact CE1-CG 4.02Å; Y377-L381 HydrophobicContact CE2-CD1 4.44Å; Y377-L381 HydrophobicContact CE2-CD2 3.97Å; Y377-L381 HydrophobicContact CE2-CG 4.17Å; Y377-L381 WeakPolarHBondContact O-CG 3.48Å; Y377-L381 PolarHBondContact O-N 2.97Å; Q378-L381 PolarHBondContact O-N 2.75Å; L381-K383 PolarHBondContact O-N 3.02Å; L381-C384 PolarHBondContact O-N 3.17Å; L381-F385 WeakPolarHBondContact O-CD2 3.37Å; L381-Q394 HydrophobicContact CD2-CG 4.1Å
382E89.8Confident90Very high61 Ų6154.7 Ų54.729%0.28527%0.267SS..Hα-helixtrans-58.9-33.4177.5-71170-178.300112.3F339 Q378 L380 Q386F339-E382 HydrophobicContact CD1-CG 4.08Å; F339-E382 HydrophobicContact CE1-CG 4.08Å; Q378-E382 PolarHBondContact NE2-OE1 2.91Å; Q378-E382 WeakPolarHBondContact O-CG 3.47Å; Q378-E382 PolarHBondContact O-N 3.33Å; L380-E382 VanDerWaalsContact C-N 3.34Å; L380-E382 PolarHBondContact O-N 3.18Å; E382-Q386 PolarHBondContact O-NE2 3.44Å; E382-Q386 VanDerWaalsContact O-NE2 3.09Å
383K89.3Confident89.6Confident126 Ų12656.1 Ų56.155%0.54828%0.277SS..Hα-helixtrans-81.6-43.2178-69.7169.5-171.8169.50113.2E379 L380 L381 F385 Q386E379-K383 WeakPolarHBondContact O-CD 3.44Å; E379-K383 VanDerWaalsContact O-CG 3.26Å; E379-K383 WeakPolarHBondContact O-CG 3.14Å; E379-K383 PolarHBondContact O-N 3.42Å; L380-K383 PolarHBondContact O-N 3.11Å; L380-K383 VanDerWaalsContact O-N 3.14Å; L381-K383 PolarHBondContact O-N 3.02Å; K383-F385 VanDerWaalsContact C-N 3.33Å; K383-F385 PolarHBondContact O-N 2.85Å; K383-Q386 WeakPolarHBondContact O-CB 3.28Å; K383-Q386 PolarHBondContact O-N 3.16Å
384C88.2Confident89.2Confident0 Ų056.1 Ų56.10%028%0.277CS..Hα-helixtrans-65.8-31.3-169.9-75.30000114.3L380 L381 Q386 T387 C393 Q394L380-C384 WeakPolarHBondContact CD1-SG 3.39Å; L380-C384 PolarHBondContact O-N 3.2Å; L380-C384 PolarHBondContact O-SG 2.92Å; L380-C384 VanDerWaalsContact O-SG 3.4Å; L381-C384 PolarHBondContact O-N 3.17Å; C384-Q386 PolarHBondContact O-N 2.99Å; C384-T387 WeakPolarHBondContact O-CB 3.38Å; C384-T387 PolarHBondContact O-N 3.18Å; C384-T387 VanDerWaalsContact O-N 3.1Å; C384-T387 PolarHBondContact O-OG1 3.43Å; C384-C393 WeakPolarHBondContact CA-SG 3.16Å; C384-C393 HydrophobicContact CB-CB 3.63Å; C384-C393 WeakPolarHBondContact CB-SG 3.31Å; C384-C393 WeakPolarHBondContact SG-CB 3.38Å; C384-C393 CovalentContact SG-SG 2.05Å; C384-C393 PolarHBondContact SG-SG 2.89Å; C384-Q394 HydrophobicContact CB-CG 4.3Å
385F80.4Confident88.8Confident39 Ų3958 Ų5817%0.17129%0.285CS..THydrogen-bonded Turntrans-73.9-2.1175.2-73.8-80.4000114.2L334 R337 D338 F339 L381 K383 P390L334-F385 HydrophobicContact CD2-CD2 4.41Å; L334-F385 HydrophobicContact CD2-CE2 3.28Å; L334-F385 HydrophobicContact CD2-CZ 3.61Å; L334-F385 HydrophobicContact CG-CZ 4.49Å; R337-F385 VanDerWaalsContact O-CE1 3.3Å; R337-F385 WeakPolarHBondContact O-CE1 3.32Å; R337-F385 WeakPolarHBondContact O-CE2 3.32Å; R337-F385 WeakPolarHBondContact O-CZ 3.2Å; D338-F385 HydrophobicContact CB-CD1 3.89Å; D338-F385 HydrophobicContact CB-CE1 4.19Å; D338-F385 HydrophobicContact CB-CG 4.37Å; D338-F385 WeakPolarHBondContact OD1-CG 3.32Å; F339-F385 HydrophobicContact CB-CD2 4.4Å; F339-F385 HydrophobicContact CB-CE2 4.39Å; L381-F385 WeakPolarHBondContact O-CD2 3.37Å; K383-F385 VanDerWaalsContact C-N 3.33Å; K383-F385 PolarHBondContact O-N 2.85Å; F385-P390 HydrophobicContact CD1-CB 4.05Å; F385-P390 HydrophobicContact CD1-CG 4.23Å; F385-P390 HydrophobicContact CE1-CB 3.96Å; F385-P390 HydrophobicContact CE1-CG 4.47Å; F385-P390 HydrophobicContact CZ-CB 4.36Å
386Q83.2Confident88.3Confident155 Ų15559.9 Ų59.972%0.72429%0.293SS*.THydrogen-bonded Turntrans-93.7-1.1170.7-52.7177.31600112.1E382 K383 C384E382-Q386 PolarHBondContact O-NE2 3.44Å; E382-Q386 VanDerWaalsContact O-NE2 3.09Å; K383-Q386 WeakPolarHBondContact O-CB 3.28Å; K383-Q386 PolarHBondContact O-N 3.16Å; C384-Q386 PolarHBondContact O-N 2.99Å
387T84.1Confident87.7Confident63 Ų6359.9 Ų59.939%0.38729%0.293SS..SBendtrans-102.2159-176.672.50000112.1C384 N389C384-T387 WeakPolarHBondContact O-CB 3.38Å; C384-T387 PolarHBondContact O-N 3.18Å; C384-T387 VanDerWaalsContact O-N 3.1Å; C384-T387 PolarHBondContact O-OG1 3.43Å; T387-N389 PolarHBondContact O-N 3.15Å
388E84.8Confident87.1Confident207 Ų20760.9 Ų60.997%0.96730%0.298SS*.SBendtrans-63.2-27.9177.7-66.4-178.6175.200113.1
389N87.9Confident86.6Confident74 Ų7465.6 Ų65.640%0.39632%0.32SS..  trans-13184179.2-168.7-8000111.7T387 L391 E392 C393T387-N389 PolarHBondContact O-N 3.15Å; N389-L391 VanDerWaalsContact C-N 3.28Å; N389-L391 PolarHBondContact O-N 3.32Å; N389-E392 HydrophobicContact CB-CB 4.17Å; N389-E392 VanDerWaalsContact CG-CB 3.49Å; N389-E392 VanDerWaalsContact ND2-CB 3.29Å; N389-E392 WeakPolarHBondContact ND2-CB 3.4Å; N389-E392 PolarHBondContact ND2-OE2 3.48Å; N389-E392 PolarHBondContact O-N 3.28Å; N389-E392 PolarHBondContact OD1-N 3.39Å; N389-C393 PolarHBondContact O-N 3.06Å
390P86.6Confident86.3Confident33 Ų3367.9 Ų67.921%0.21433%0.331CS..Hα-helixtrans-61.7-30.7-176.7-25.835.2000114.5F385 Q394F385-P390 HydrophobicContact CD1-CB 4.05Å; F385-P390 HydrophobicContact CD1-CG 4.23Å; F385-P390 HydrophobicContact CE1-CB 3.96Å; F385-P390 HydrophobicContact CE1-CG 4.47Å; F385-P390 HydrophobicContact CZ-CB 4.36Å; P390-Q394 VanDerWaalsContact O-CG 3.31Å; P390-Q394 WeakPolarHBondContact O-CG 3.43Å; P390-Q394 PolarHBondContact O-N 2.95Å; P390-Q394 PolarHBondContact O-NE2 2.95Å
391L88Confident86.3Confident60 Ų6067.3 Ų67.331%0.31433%0.328SS..Hα-helixtrans-73-44.3-180-68177.9000111.7G335 N389 C393 Q394 D395G335-L391 WeakPolarHBondContact O-CD2 3.49Å; N389-L391 VanDerWaalsContact C-N 3.28Å; N389-L391 PolarHBondContact O-N 3.32Å; L391-C393 VanDerWaalsContact C-N 3.3Å; L391-C393 PolarHBondContact O-N 3.23Å; L391-Q394 PolarHBondContact O-N 3.48Å; L391-D395 PolarHBondContact O-N 2.89Å
392E88.2Confident86.2Confident88 Ų8869.8 Ų69.841%0.41134%0.339SS..Hα-helixtrans-66.5-35.3175.3-174.4-174.9165.400111.6N389 D395 K396N389-E392 HydrophobicContact CB-CB 4.17Å; N389-E392 VanDerWaalsContact CG-CB 3.49Å; N389-E392 VanDerWaalsContact ND2-CB 3.29Å; N389-E392 WeakPolarHBondContact ND2-CB 3.4Å; N389-E392 PolarHBondContact ND2-OE2 3.48Å; N389-E392 PolarHBondContact O-N 3.28Å; N389-E392 PolarHBondContact OD1-N 3.39Å; E392-D395 PolarHBondContact O-N 3.22Å; E392-K396 PolarHBondContact O-N 3.38Å; E392-K396 VanDerWaalsContact O-N 3.15Å; E392-K396 WeakPolarHBondContact OE1-CE 3.34Å; E392-K396 IonicContact OE1-NZ 3.81Å; E392-K396 PolarHBondContact OE1-NZ 3.38Å
393C88.2Confident86.4Confident32 Ų3270.8 Ų70.822%0.21634%0.343CS..Hα-helixtrans-61.5-44.4171.9178.80000111.9C384 N389 L391 G397C384-C393 WeakPolarHBondContact CA-SG 3.16Å; C384-C393 HydrophobicContact CB-CB 3.63Å; C384-C393 WeakPolarHBondContact CB-SG 3.31Å; C384-C393 WeakPolarHBondContact SG-CB 3.38Å; C384-C393 CovalentContact SG-SG 2.05Å; C384-C393 PolarHBondContact SG-SG 2.89Å; N389-C393 PolarHBondContact O-N 3.06Å; L391-C393 VanDerWaalsContact C-N 3.3Å; L391-C393 PolarHBondContact O-N 3.23Å; C393-G397 PolarHBondContact O-N 3.05Å
394Q87.7Confident86.5Confident0 Ų066.6 Ų66.60%032%0.324CS..Hα-helixtrans-61.5-47.9176-78176.273.900111.6G335 L381 C384 P390 L391 K396 G397 E398G335-Q394 PolarHBondContact O-NE2 3.39Å; L381-Q394 HydrophobicContact CD2-CG 4.1Å; C384-Q394 HydrophobicContact CB-CG 4.3Å; P390-Q394 VanDerWaalsContact O-CG 3.31Å; P390-Q394 WeakPolarHBondContact O-CG 3.43Å; P390-Q394 PolarHBondContact O-N 2.95Å; P390-Q394 PolarHBondContact O-NE2 2.95Å; L391-Q394 PolarHBondContact O-N 3.48Å; Q394-K396 PolarHBondContact O-N 2.62Å; Q394-G397 PolarHBondContact O-N 3.4Å; Q394-E398 WeakPolarHBondContact O-CG 3.26Å; Q394-E398 PolarHBondContact O-N 3.36Å
395D85.8Confident86.8Confident50 Ų5067 Ų6727%0.26733%0.326SS..Hα-helixtrans-56.2-48.2-179.8-69.8-21.4000111.2R332 L391 E392R332-D395 WeakPolarHBondContact CG-OD1 3.48Å; R332-D395 IonicContact CZ-OD1 3.43Å; R332-D395 IonicContact CZ-OD2 3.8Å; R332-D395 IonicContact NE-OD1 3.27Å; R332-D395 PolarHBondContact NE-OD1 2.85Å; R332-D395 IonicContact NE-OD2 3.89Å; R332-D395 PolarHBondContact NE-OD2 3.29Å; R332-D395 IonicContact NH2-OD1 2.72Å; R332-D395 IonicContact NH2-OD2 3.73Å; R332-D395 PolarHBondContact NH2-OD2 2.93Å; L391-D395 PolarHBondContact O-N 2.89Å; E392-D395 PolarHBondContact O-N 3.22Å
396K84.1Confident87.4Confident118 Ų11870.9 Ų70.951%0.51335%0.345SS..Hα-helixtrans-67.1-42.3177.6-69.6177.2-172.81660112.3E392 Q394 E398 E399 E400E392-K396 PolarHBondContact O-N 3.38Å; E392-K396 VanDerWaalsContact O-N 3.15Å; E392-K396 WeakPolarHBondContact OE1-CE 3.34Å; E392-K396 IonicContact OE1-NZ 3.81Å; E392-K396 PolarHBondContact OE1-NZ 3.38Å; Q394-K396 PolarHBondContact O-N 2.62Å; K396-E398 PolarHBondContact O-N 2.7Å; K396-E399 WeakPolarHBondContact O-CB 3.39Å; K396-E399 PolarHBondContact O-N 3.38Å; K396-E400 PolarHBondContact O-N 3.44Å
397G82.6Confident87.8Confident5 Ų568 Ų685%0.05233%0.331CS..Hα-helixtrans-67.8-35.1-177.500000113.5L380 C393 Q394 E399 E400 L401L380-G397 VanDerWaalsContact CD2-C 3.41Å; C393-G397 PolarHBondContact O-N 3.05Å; Q394-G397 PolarHBondContact O-N 3.4Å; G397-E399 VanDerWaalsContact C-N 3.3Å; G397-E399 PolarHBondContact O-N 2.91Å; G397-E400 WeakPolarHBondContact O-CB 3.28Å; G397-E400 PolarHBondContact O-N 3.24Å; G397-E400 VanDerWaalsContact O-N 3.14Å; G397-L401 WeakPolarHBondContact O-CG 3.44Å; G397-L401 PolarHBondContact O-N 3.42Å
398E81.8Confident88.2Confident21 Ų2165.1 Ų65.110%0.09831%0.314CS..Hα-helixtrans-63.9-35175.4-76.1-173.6-153.400112.1N331 R332 Y377 L380 Q394 K396 E400 L401N331-E398 WeakPolarHBondContact CA-OE2 3.01Å; N331-E398 PolarHBondContact N-OE2 3.35Å; R332-E398 PolarHBondContact N-OE1 3.38Å; Y377-E398 HydrophobicContact CD2-CG 4.44Å; Y377-E398 HydrophobicContact CE2-CG 4.21Å; L380-E398 HydrophobicContact CD2-CG 4.44Å; Q394-E398 WeakPolarHBondContact O-CG 3.26Å; Q394-E398 PolarHBondContact O-N 3.36Å; K396-E398 PolarHBondContact O-N 2.7Å; E398-E400 VanDerWaalsContact C-N 3.35Å; E398-L401 WeakPolarHBondContact O-CB 3.41Å; E398-L401 PolarHBondContact O-N 3.08Å
399E83.1Confident88.6Confident152 Ų15259.4 Ų59.471%0.7129%0.287SS*.Hα-helixtrans-63.6-40.6171.3-66.4-177.9174.500111.5K396 G397 L401 Q402K396-E399 WeakPolarHBondContact O-CB 3.39Å; K396-E399 PolarHBondContact O-N 3.38Å; G397-E399 VanDerWaalsContact C-N 3.3Å; G397-E399 PolarHBondContact O-N 2.91Å; E399-L401 PolarHBondContact O-N 3.36Å; E399-Q402 VanDerWaalsContact O-CB 3.31Å; E399-Q402 WeakPolarHBondContact O-CB 3.49Å; E399-Q402 WeakPolarHBondContact O-CG 3.21Å; E399-Q402 PolarHBondContact O-N 2.9Å; E399-Q402 VanDerWaalsContact O-N 3.17Å
400E86.5Confident88.8Confident119 Ų11958.8 Ų58.856%0.55629%0.292SS*.Hα-helixtrans-63.5-26.4177.5-67.2-172.9-171.800113.2K396 G397 E398 Q402 K403K396-E400 PolarHBondContact O-N 3.44Å; G397-E400 WeakPolarHBondContact O-CB 3.28Å; G397-E400 PolarHBondContact O-N 3.24Å; G397-E400 VanDerWaalsContact O-N 3.14Å; E398-E400 VanDerWaalsContact C-N 3.35Å; E400-Q402 PolarHBondContact O-N 3.07Å; E400-K403 WeakPolarHBondContact O-CB 3.47Å; E400-K403 WeakPolarHBondContact O-CD 3.42Å; E400-K403 WeakPolarHBondContact O-CG 3.34Å; E400-K403 PolarHBondContact O-N 2.97Å; E400-K403 VanDerWaalsContact O-N 3.12Å; E400-K403 IonicContact OE2-NZ 2.83Å
401L90.3Very high89Confident11 Ų1159.8 Ų59.86%0.05830%0.295CS..THydrogen-bonded Turntrans-64.4-21.3178-61178.6000112.6V373 G376 Y377 G397 E398 E399 K403 Y404V373-L401 HydrophobicContact CG1-CB 4.22Å; V373-L401 HydrophobicContact CG1-CD1 4.13Å; G376-L401 VanDerWaalsContact C-CD2 3.45Å; Y377-L401 HydrophobicContact CD2-CD1 3.94Å; Y377-L401 HydrophobicContact CG-CD1 4.31Å; G397-L401 WeakPolarHBondContact O-CG 3.44Å; G397-L401 PolarHBondContact O-N 3.42Å; E398-L401 WeakPolarHBondContact O-CB 3.41Å; E398-L401 PolarHBondContact O-N 3.08Å; E399-L401 PolarHBondContact O-N 3.36Å; L401-K403 PolarHBondContact O-N 3.5Å; L401-K403 VanDerWaalsContact O-N 3.15Å; L401-Y404 HydrophobicContact CD2-CD2 4.39Å; L401-Y404 HydrophobicContact CD2-CE2 3.88Å; L401-Y404 WeakPolarHBondContact O-CD2 3.46Å; L401-Y404 PolarHBondContact O-N 3.3Å
402Q89.9Confident89.2Confident51 Ų5157.9 Ų57.924%0.23829%0.288CS..Hα-helixtrans-60.2-22.8174.5-66.8-63.6-30.500112.6N329 E399 E400 Y404 I405 Q406N329-Q402 PolarHBondContact OD1-NE2 3.01Å; E399-Q402 VanDerWaalsContact O-CB 3.31Å; E399-Q402 WeakPolarHBondContact O-CB 3.49Å; E399-Q402 WeakPolarHBondContact O-CG 3.21Å; E399-Q402 PolarHBondContact O-N 2.9Å; E399-Q402 VanDerWaalsContact O-N 3.17Å; E400-Q402 PolarHBondContact O-N 3.07Å; Q402-Y404 PolarHBondContact O-N 3.25Å; Q402-I405 PolarHBondContact O-N 3.44Å; Q402-I405 VanDerWaalsContact O-N 3.09Å; Q402-Q406 WeakPolarHBondContact O-CG 3.5Å; Q402-Q406 PolarHBondContact O-N 3.02Å
403K92.9Very high89.4Confident83 Ų8359.5 Ų59.536%0.36129%0.294SS..Hα-helixtrans-55.6-37176.276.6-164.2167.5-165.80112.5E400 L401 I405 Q406 E407E400-K403 WeakPolarHBondContact O-CB 3.47Å; E400-K403 WeakPolarHBondContact O-CD 3.42Å; E400-K403 WeakPolarHBondContact O-CG 3.34Å; E400-K403 PolarHBondContact O-N 2.97Å; E400-K403 VanDerWaalsContact O-N 3.12Å; E400-K403 IonicContact OE2-NZ 2.83Å; L401-K403 PolarHBondContact O-N 3.5Å; L401-K403 VanDerWaalsContact O-N 3.15Å; K403-I405 VanDerWaalsContact C-N 3.29Å; K403-I405 PolarHBondContact O-N 2.93Å; K403-Q406 PolarHBondContact O-N 3.4Å; K403-E407 WeakPolarHBondContact O-CB 3.48Å; K403-E407 WeakPolarHBondContact O-CG 3.29Å; K403-E407 PolarHBondContact O-N 3.31Å
404Y93.2Very high89.5Confident37 Ų3766.7 Ų66.715%0.14532%0.316CS..Hα-helixtrans-67-31.8-179-62.1-57.2000113.1R372 V373 L401 Q402 S408R372-Y404 HydrophobicContact CB-CD1 4.27Å; R372-Y404 HydrophobicContact CB-CG 4.15Å; R372-Y404 PolarHBondContact NH2-O 3.29Å; V373-Y404 HydrophobicContact CG2-CD2 4.32Å; L401-Y404 HydrophobicContact CD2-CD2 4.39Å; L401-Y404 HydrophobicContact CD2-CE2 3.88Å; L401-Y404 WeakPolarHBondContact O-CD2 3.46Å; L401-Y404 PolarHBondContact O-N 3.3Å; Q402-Y404 PolarHBondContact O-N 3.25Å; Y404-S408 PolarHBondContact O-N 3.42Å
405I92.6Very high89.7Confident10 Ų1068.3 Ų68.35%0.05133%0.327CS..Hα-helixtrans-74.1-49.7174.1-64.9167.3000109.2Y358 L365 V369 V373 Q402 K403 E407 S408 Q409Y358-I405 VanDerWaalsContact OH-CD1 3.27Å; Y358-I405 WeakPolarHBondContact OH-CD1 3.49Å; L365-I405 HydrophobicContact CD1-CD1 3.67Å; L365-I405 HydrophobicContact CD1-CG1 3.95Å; L365-I405 HydrophobicContact CD2-CG1 4.46Å; L365-I405 HydrophobicContact CD2-CG2 4.12Å; V369-I405 HydrophobicContact CG1-CG1 3.78Å; V373-I405 HydrophobicContact CG2-CG1 4.44Å; Q402-I405 PolarHBondContact O-N 3.44Å; Q402-I405 VanDerWaalsContact O-N 3.09Å; K403-I405 VanDerWaalsContact C-N 3.29Å; K403-I405 PolarHBondContact O-N 2.93Å; I405-E407 VanDerWaalsContact C-N 3.34Å; I405-E407 PolarHBondContact O-N 3.26Å; I405-S408 WeakPolarHBondContact O-CB 3.09Å; I405-S408 PolarHBondContact O-N 3.31Å; I405-S408 VanDerWaalsContact O-N 3.11Å; I405-Q409 HydrophobicContact CG2-CG 4.24Å; I405-Q409 WeakPolarHBondContact O-CG 3.39Å; I405-Q409 PolarHBondContact O-N 3.37Å
406Q93.1Very high90.1Very high119 Ų11966.5 Ų66.556%0.55632%0.319SS*.Hα-helixtrans-59.1-42.3-179.6-68.5173.4-0.600112.4Q402 K403 S408 Q409 A410Q402-Q406 WeakPolarHBondContact O-CG 3.5Å; Q402-Q406 PolarHBondContact O-N 3.02Å; K403-Q406 PolarHBondContact O-N 3.4Å; Q406-S408 VanDerWaalsContact C-N 3.34Å; Q406-S408 PolarHBondContact O-N 3.39Å; Q406-Q409 PolarHBondContact O-N 3.17Å; Q406-A410 VanDerWaalsContact O-CB 3.28Å; Q406-A410 WeakPolarHBondContact O-CB 3.46Å; Q406-A410 PolarHBondContact O-N 2.81Å
407E93.1Very high90.6Very high96 Ų9662.5 Ų62.545%0.44931%0.311SS..Hα-helixtrans-58.6-44.2174.6-77.4170.3-173.100112.2R372 K403 I405 L411R372-E407 IonicContact NH1-OE2 2.69Å; K403-E407 WeakPolarHBondContact O-CB 3.48Å; K403-E407 WeakPolarHBondContact O-CG 3.29Å; K403-E407 PolarHBondContact O-N 3.31Å; I405-E407 VanDerWaalsContact C-N 3.34Å; I405-E407 PolarHBondContact O-N 3.26Å; E407-L411 WeakPolarHBondContact O-CB 3.33Å; E407-L411 PolarHBondContact O-N 2.71Å
408S92Very high91.1Very high2 Ų265.3 Ų65.31%0.01433%0.325CS..Hα-helixtrans-67.7-43.6179.4-173.90000111.2Y404 I405 Q406 L411 A412 L470 E474Y404-S408 PolarHBondContact O-N 3.42Å; I405-S408 WeakPolarHBondContact O-CB 3.09Å; I405-S408 PolarHBondContact O-N 3.31Å; I405-S408 VanDerWaalsContact O-N 3.11Å; Q406-S408 VanDerWaalsContact C-N 3.34Å; Q406-S408 PolarHBondContact O-N 3.39Å; S408-L411 PolarHBondContact O-N 3.07Å; S408-A412 PolarHBondContact O-N 2.69Å; S408-L470 WeakPolarHBondContact OG-CD1 3.39Å; S408-E474 WeakPolarHBondContact CB-OE1 3.18Å; S408-E474 WeakPolarHBondContact OG-CG 3.45Å; S408-E474 PolarHBondContact OG-OE1 2.96Å
409Q92.1Very high91.7Very high87 Ų8765.5 Ų65.541%0.40733%0.325SS..Hα-helixtrans-62.8-43.2175.3-72175.3-2000112I405 Q406 L411 A412 K413 L470I405-Q409 HydrophobicContact CG2-CG 4.24Å; I405-Q409 WeakPolarHBondContact O-CG 3.39Å; I405-Q409 PolarHBondContact O-N 3.37Å; Q406-Q409 PolarHBondContact O-N 3.17Å; Q409-L411 VanDerWaalsContact C-N 3.32Å; Q409-L411 PolarHBondContact O-N 3.34Å; Q409-A412 PolarHBondContact O-N 3.33Å; Q409-K413 WeakPolarHBondContact O-CB 3.44Å; Q409-K413 WeakPolarHBondContact O-CG 3.06Å; Q409-K413 PolarHBondContact O-N 3.37Å; Q409-L470 HydrophobicContact CG-CD1 4.25Å; Q409-L470 HydrophobicContact CG-CD2 4.29Å
410A92.6Very high92.3Very high60 Ų6065.5 Ų65.550%0.49633%0.325SS..Hα-helixtrans-62.1-41.5177.100000111.4Q406 R414Q406-A410 VanDerWaalsContact O-CB 3.28Å; Q406-A410 WeakPolarHBondContact O-CB 3.46Å; Q406-A410 PolarHBondContact O-N 2.81Å; A410-R414 WeakPolarHBondContact O-CB 3.45Å; A410-R414 PolarHBondContact O-N 2.06Å
411L91.1Very high92.7Very high55 Ų5568.3 Ų68.329%0.28834%0.335SS..Hα-helixtrans-64.1-45.7175.2-179.361000111.8E407 S408 Q409 R414 S415 R509E407-L411 WeakPolarHBondContact O-CB 3.33Å; E407-L411 PolarHBondContact O-N 2.71Å; S408-L411 PolarHBondContact O-N 3.07Å; Q409-L411 VanDerWaalsContact C-N 3.32Å; Q409-L411 PolarHBondContact O-N 3.34Å; L411-R414 PolarHBondContact O-N 2.79Å; L411-S415 WeakPolarHBondContact O-CB 3.07Å; L411-S415 PolarHBondContact O-N 3.48Å; L411-S415 PolarHBondContact O-OG 3.18Å; L411-S415 VanDerWaalsContact O-OG 3.06Å; L411-R509 VanDerWaalsContact CD2-NH1 3.35Å
412A91.7Very high92.9Very high19 Ų1970.7 Ų70.716%0.15735%0.348CS..Hα-helixtrans-60.2-47.2177.400000111.6S408 Q409 R414 S415 C416 L469 L470S408-A412 PolarHBondContact O-N 2.69Å; Q409-A412 PolarHBondContact O-N 3.33Å; A412-R414 PolarHBondContact O-N 2.9Å; A412-S415 PolarHBondContact O-N 2.92Å; A412-C416 WeakPolarHBondContact O-CB 3.27Å; A412-C416 PolarHBondContact O-N 3.48Å; A412-L469 HydrophobicContact CB-CD2 4.18Å; A412-L469 HydrophobicContact CB-CG 4.24Å; A412-L470 HydrophobicContact CB-CD1 4.19Å
413K92.1Very high93.1Very high123 Ų12369.7 Ų69.754%0.53535%0.351SS..Hα-helixtrans-59-45.6176.4-74.6179.4179-175.80112Q409 G417Q409-K413 WeakPolarHBondContact O-CB 3.44Å; Q409-K413 WeakPolarHBondContact O-CG 3.06Å; Q409-K413 PolarHBondContact O-N 3.37Å; K413-G417 PolarHBondContact O-N 2.84Å
414R91.3Very high93.2Very high182 Ų18269.9 Ų69.969%0.68735%0.353SS*.Hα-helixtrans-61.5-48.5176.9-177.9-178.7177.3-176.30.1111.6A410 L411 A412 G417 L418A410-R414 WeakPolarHBondContact O-CB 3.45Å; A410-R414 PolarHBondContact O-N 2.06Å; L411-R414 PolarHBondContact O-N 2.79Å; A412-R414 PolarHBondContact O-N 2.9Å; R414-G417 PolarHBondContact O-N 3.5Å; R414-L418 HydrophobicContact CG-CD1 4.39Å; R414-L418 WeakPolarHBondContact O-CG 3.44Å; R414-L418 PolarHBondContact O-N 3.23Å
415S91.5Very high93.2Very high34 Ų3470 Ų7024%0.23835%0.354CS..Hα-helixtrans-63.1-43.6-179-64.80000112L411 A412 L418 F419L411-S415 WeakPolarHBondContact O-CB 3.07Å; L411-S415 PolarHBondContact O-N 3.48Å; L411-S415 PolarHBondContact O-OG 3.18Å; L411-S415 VanDerWaalsContact O-OG 3.06Å; A412-S415 PolarHBondContact O-N 2.92Å; S415-L418 PolarHBondContact O-N 3.08Å; S415-F419 PolarHBondContact O-N 3.38Å
416C93.9Very high93.3Very high13 Ų1376.5 Ų76.59%0.08838%0.379CS..Hα-helixtrans-71.2-34.8177.1-68.30000113.1A412 L418 F419 Q420 C462 L469A412-C416 WeakPolarHBondContact O-CB 3.27Å; A412-C416 PolarHBondContact O-N 3.48Å; C416-L418 VanDerWaalsContact C-N 3.32Å; C416-L418 PolarHBondContact O-N 3.37Å; C416-F419 PolarHBondContact O-N 3.29Å; C416-Q420 WeakPolarHBondContact O-CB 3.46Å; C416-Q420 VanDerWaalsContact O-CG 3.31Å; C416-Q420 WeakPolarHBondContact O-CG 3.41Å; C416-Q420 PolarHBondContact O-N 2.87Å; C416-C462 WeakPolarHBondContact CA-SG 2.99Å; C416-C462 HydrophobicContact CB-CB 3.76Å; C416-C462 WeakPolarHBondContact CB-SG 3.48Å; C416-C462 VanDerWaalsContact SG-CA 3.54Å; C416-C462 WeakPolarHBondContact SG-CB 3Å; C416-C462 CovalentContact SG-SG 2.05Å; C416-C462 PolarHBondContact SG-SG 2.99Å; C416-L469 VanDerWaalsContact SG-CD1 3.51Å
417G94.7Very high93.4Very high34 Ų3470.9 Ų70.935%0.35135%0.353SS..Hα-helixtrans-61.7-40.4171.400000112.3K413 R414 K421K413-G417 PolarHBondContact O-N 2.84Å; R414-G417 PolarHBondContact O-N 3.5Å; G417-K421 WeakPolarHBondContact O-CB 3.42Å; G417-K421 PolarHBondContact O-N 2.78Å; G417-K421 VanDerWaalsContact O-N 3.13Å
418L93.1Very high93.5Very high64 Ų6466.8 Ų66.834%0.33533%0.333SS..Hα-helixtrans-65-44.4172.6-72.8171.4000111.8R414 S415 C416 Q420 K421 L422 L427R414-L418 HydrophobicContact CG-CD1 4.39Å; R414-L418 WeakPolarHBondContact O-CG 3.44Å; R414-L418 PolarHBondContact O-N 3.23Å; S415-L418 PolarHBondContact O-N 3.08Å; C416-L418 VanDerWaalsContact C-N 3.32Å; C416-L418 PolarHBondContact O-N 3.37Å; L418-Q420 PolarHBondContact O-N 3.06Å; L418-K421 PolarHBondContact O-N 3.03Å; L418-L422 HydrophobicContact CD2-CD1 4.39Å; L418-L422 VanDerWaalsContact O-CB 3.28Å; L418-L422 WeakPolarHBondContact O-CB 3.34Å; L418-L422 WeakPolarHBondContact O-CG 3.41Å; L418-L422 PolarHBondContact O-N 3.33Å; L418-L427 HydrophobicContact CB-CD1 4.02Å
419F95.4Very high93.7Very high25 Ų2568 Ų6811%0.1134%0.34CS..Hα-helixtrans-58.1-46.5176.1178-106.1000112.1S415 C416 K421 L422 G423 E424 L427 A458 A459 C462S415-F419 PolarHBondContact O-N 3.38Å; C416-F419 PolarHBondContact O-N 3.29Å; F419-K421 VanDerWaalsContact C-N 3.3Å; F419-K421 PolarHBondContact O-N 2.94Å; F419-L422 PolarHBondContact O-N 3.07Å; F419-G423 WeakPolarHBondContact O-CA 3.32Å; F419-G423 PolarHBondContact O-N 3.45Å; F419-E424 HydrophobicContact CE2-CB 4.02Å; F419-L427 HydrophobicContact CB-CD2 3.86Å; F419-L427 HydrophobicContact CD2-CD2 3.77Å; F419-L427 HydrophobicContact CG-CD2 4.28Å; F419-A458 HydrophobicContact CB-CB 4.15Å; F419-A458 HydrophobicContact CD2-CB 3.96Å; F419-A458 HydrophobicContact CG-CB 4.08Å; F419-A459 HydrophobicContact CE2-CB 3.77Å; F419-A459 VanDerWaalsContact CZ-CA 3.41Å; F419-A459 HydrophobicContact CZ-CB 3.66Å; F419-C462 HydrophobicContact CD1-CB 4.07Å
420Q95.4Very high93.8Very high152 Ų15265.9 Ų65.971%0.7134%0.337SS*.Hα-helixtrans-61.9-37.1178-73.9173.1-6.900112.4C416 L418C416-Q420 WeakPolarHBondContact O-CB 3.46Å; C416-Q420 VanDerWaalsContact O-CG 3.31Å; C416-Q420 WeakPolarHBondContact O-CG 3.41Å; C416-Q420 PolarHBondContact O-N 2.87Å; L418-Q420 PolarHBondContact O-N 3.06Å
421K95.6Very high94Very high177 Ų17765 Ų6577%0.7732%0.323SS*.Hα-helixtrans-75.1-40.7179.4-176.6-180176.7-173.20113G417 L418 F419G417-K421 WeakPolarHBondContact O-CB 3.42Å; G417-K421 PolarHBondContact O-N 2.78Å; G417-K421 VanDerWaalsContact O-N 3.13Å; L418-K421 PolarHBondContact O-N 3.03Å; F419-K421 VanDerWaalsContact C-N 3.3Å; F419-K421 PolarHBondContact O-N 2.94Å
422L94.1Very high94.2Very high61 Ų6162.4 Ų62.432%0.31931%0.309SS..Hα-helixtrans-102.8-25-166.9-63.6179.7000113.4L418 F419 Y426L418-L422 HydrophobicContact CD2-CD1 4.39Å; L418-L422 VanDerWaalsContact O-CB 3.28Å; L418-L422 WeakPolarHBondContact O-CB 3.34Å; L418-L422 WeakPolarHBondContact O-CG 3.41Å; L418-L422 PolarHBondContact O-N 3.33Å; F419-L422 PolarHBondContact O-N 3.07Å; L422-Y426 WeakPolarHBondContact O-CD2 3.07Å
423G94.6Very high94.4Very high30 Ų3062.8 Ų62.831%0.30931%0.309SS..Hα-helixtrans68.9177-164.200000112.6F419 L427F419-G423 WeakPolarHBondContact O-CA 3.32Å; F419-G423 PolarHBondContact O-N 3.45Å; G423-L427 VanDerWaalsContact O-CB 3.22Å; G423-L427 WeakPolarHBondContact O-CB 3.15Å; G423-L427 PolarHBondContact O-N 2.9Å; G423-L427 VanDerWaalsContact O-N 3.07Å
424E94.3Very high94.6Very high87 Ų8758.6 Ų58.641%0.40730%0.298SS..Hα-helixtrans-62.8-48.8-170.5-168.7176.9154.800113.5F419 Y426 L427 Q428 A455F419-E424 HydrophobicContact CE2-CB 4.02Å; E424-Y426 PolarHBondContact O-N 3.45Å; E424-L427 PolarHBondContact O-N 3.04Å; E424-Q428 PolarHBondContact O-N 3Å; E424-A455 HydrophobicContact CG-CB 3.9Å
425Y93.8Very high94.9Very high40 Ų4051.3 Ų51.316%0.15727%0.27CS..Hα-helixtrans-62.2-48.1-175.2174.9-109000112.6Q428 N429 Q546 K549 Q550Y425-Q428 WeakPolarHBondContact O-CB 3.37Å; Y425-Q428 PolarHBondContact O-N 3.28Å; Y425-N429 WeakPolarHBondContact CE1-ND2 3.33Å; Y425-N429 PolarHBondContact O-N 2.84Å; Y425-N429 VanDerWaalsContact O-N 3.07Å; Y425-N429 PolarHBondContact O-OD1 2.83Å; Y425-Q546 HydrophobicContact CD2-CB 4.1Å; Y425-Q546 HydrophobicContact CD2-CG 3.74Å; Y425-Q546 HydrophobicContact CE2-CB 3.5Å; Y425-Q546 VanDerWaalsContact CE2-CB 3.5Å; Y425-Q546 HydrophobicContact CE2-CG 3.42Å; Y425-Q546 VanDerWaalsContact CE2-CG 3.42Å; Y425-Q546 HydrophobicContact CG-CG 4.46Å; Y425-K549 WeakPolarHBondContact OH-CB 3.41Å; Y425-Q550 HydrophobicContact CE2-CG 4.12Å; Y425-Q550 VanDerWaalsContact CE2-NE2 3.31Å
426Y93.6Very high95.2Very high147 Ų14749.7 Ų49.758%0.57626%0.259SS*.Hα-helixtrans-75.2-29.1-178.9-66.3-74.5000112.2L422 E424 Q428 N429 A430L422-Y426 WeakPolarHBondContact O-CD2 3.07Å; E424-Y426 PolarHBondContact O-N 3.45Å; Y426-Q428 VanDerWaalsContact C-N 3.33Å; Y426-N429 WeakPolarHBondContact O-CB 3.31Å; Y426-N429 PolarHBondContact O-N 3.31Å; Y426-A430 PolarHBondContact O-N 3.25Å
427L95.2Very high95.3Very high1 Ų151.3 Ų51.31%0.00527%0.265CS..Hα-helixtrans-62.4-42.2167.818065.9000111.3L418 F419 G423 E424 N429 A430 F431 A458L418-L427 HydrophobicContact CB-CD1 4.02Å; F419-L427 HydrophobicContact CB-CD2 3.86Å; F419-L427 HydrophobicContact CD2-CD2 3.77Å; F419-L427 HydrophobicContact CG-CD2 4.28Å; G423-L427 VanDerWaalsContact O-CB 3.22Å; G423-L427 WeakPolarHBondContact O-CB 3.15Å; G423-L427 PolarHBondContact O-N 2.9Å; G423-L427 VanDerWaalsContact O-N 3.07Å; E424-L427 PolarHBondContact O-N 3.04Å; L427-N429 VanDerWaalsContact C-N 3.27Å; L427-N429 PolarHBondContact O-N 3.45Å; L427-A430 WeakPolarHBondContact O-CB 3.23Å; L427-A430 PolarHBondContact O-N 3.21Å; L427-F431 HydrophobicContact CD1-CD2 4.46Å; L427-F431 HydrophobicContact CD1-CE1 4.33Å; L427-F431 HydrophobicContact CD1-CE2 3.87Å; L427-F431 HydrophobicContact CD1-CZ 3.78Å; L427-F431 HydrophobicContact CD2-CE2 3.83Å; L427-F431 HydrophobicContact CD2-CZ 4.24Å; L427-F431 HydrophobicContact CG-CD2 4.06Å; L427-F431 HydrophobicContact CG-CE2 3.54Å; L427-F431 HydrophobicContact CG-CZ 3.99Å; L427-F431 WeakPolarHBondContact O-CD2 3.18Å; L427-F431 PolarHBondContact O-N 3.25Å; L427-A458 HydrophobicContact CD2-CB 3.5Å
428Q96.4Very high95.4Very high9 Ų951 Ų514%0.04225%0.254CS..Hα-helixtrans-57.9-42.7173.6-167-164.3-14.700110.9E424 Y425 Y426 A430 F431 L432 M448 A455 Q550E424-Q428 PolarHBondContact O-N 3Å; Y425-Q428 WeakPolarHBondContact O-CB 3.37Å; Y425-Q428 PolarHBondContact O-N 3.28Å; Y426-Q428 VanDerWaalsContact C-N 3.33Å; Q428-A430 VanDerWaalsContact C-N 3.34Å; Q428-A430 PolarHBondContact O-N 3.02Å; Q428-F431 CarbonylContact O-C 3.39Å; Q428-F431 PolarHBondContact O-N 3.44Å; Q428-L432 HydrophobicContact CG-CD1 4.5Å; Q428-L432 WeakPolarHBondContact O-CG 3.37Å; Q428-L432 PolarHBondContact O-N 3.32Å; Q428-M448 PolarHBondContact NE2-O 3.27Å; Q428-A455 HydrophobicContact CB-CB 3.79Å; Q428-A455 HydrophobicContact CG-CB 4.33Å; Q428-Q550 VanDerWaalsContact NE2-OE1 3.1Å
429N95.6Very high95.6Very high27 Ų2748.1 Ų48.114%0.14424%0.239CC..Hα-helixtrans-61.9-40.8177.5-65.7-6.3000112.1Y425 Y426 L427 F431 L432 V433 Q550 L553Y425-N429 WeakPolarHBondContact CE1-ND2 3.33Å; Y425-N429 PolarHBondContact O-N 2.84Å; Y425-N429 VanDerWaalsContact O-N 3.07Å; Y425-N429 PolarHBondContact O-OD1 2.83Å; Y426-N429 WeakPolarHBondContact O-CB 3.31Å; Y426-N429 PolarHBondContact O-N 3.31Å; L427-N429 VanDerWaalsContact C-N 3.27Å; L427-N429 PolarHBondContact O-N 3.45Å; N429-F431 VanDerWaalsContact C-N 3.35Å; N429-F431 PolarHBondContact O-N 2.79Å; N429-L432 WeakPolarHBondContact O-CB 3.23Å; N429-L432 PolarHBondContact O-N 2.66Å; N429-V433 WeakPolarHBondContact O-CG2 3.11Å; N429-V433 PolarHBondContact O-N 3.38Å; N429-Q550 VanDerWaalsContact OD1-CG 3.32Å; N429-Q550 WeakPolarHBondContact OD1-CG 3.29Å; N429-Q550 PolarHBondContact OD1-NE2 3.32Å; N429-L553 HydrophobicContact CB-CD2 3.81Å
430A94.4Very high95.7Very high44 Ų4447 Ų4736%0.36423%0.234SC..Hα-helixtrans-61.6-42.9174.100000111.7Y426 L427 Q428 A434Y426-A430 PolarHBondContact O-N 3.25Å; L427-A430 WeakPolarHBondContact O-CB 3.23Å; L427-A430 PolarHBondContact O-N 3.21Å; Q428-A430 VanDerWaalsContact C-N 3.34Å; Q428-A430 PolarHBondContact O-N 3.02Å; A430-A434 PolarHBondContact O-N 2.7Å; A430-A434 VanDerWaalsContact O-N 3.12Å
431F95.6Very high95.7Very high42 Ų4243 Ų4318%0.18422%0.215CC..Hα-helixtrans-65.6-37.5173.5-66.2-38.8000112.6L427 Q428 N429 A434 Y435 T451 M454L427-F431 HydrophobicContact CD1-CD2 4.46Å; L427-F431 HydrophobicContact CD1-CE1 4.33Å; L427-F431 HydrophobicContact CD1-CE2 3.87Å; L427-F431 HydrophobicContact CD1-CZ 3.78Å; L427-F431 HydrophobicContact CD2-CE2 3.83Å; L427-F431 HydrophobicContact CD2-CZ 4.24Å; L427-F431 HydrophobicContact CG-CD2 4.06Å; L427-F431 HydrophobicContact CG-CE2 3.54Å; L427-F431 HydrophobicContact CG-CZ 3.99Å; L427-F431 WeakPolarHBondContact O-CD2 3.18Å; L427-F431 PolarHBondContact O-N 3.25Å; Q428-F431 CarbonylContact O-C 3.39Å; Q428-F431 PolarHBondContact O-N 3.44Å; N429-F431 VanDerWaalsContact C-N 3.35Å; N429-F431 PolarHBondContact O-N 2.79Å; F431-A434 PolarHBondContact O-N 3.49Å; F431-Y435 WeakPolarHBondContact O-CB 3.2Å; F431-Y435 WeakPolarHBondContact O-CD2 3.4Å; F431-Y435 PolarHBondContact O-N 2.88Å; F431-T451 HydrophobicContact CB-CG2 3.77Å; F431-M454 HydrophobicContact CD2-CB 3.68Å; F431-M454 HydrophobicContact CE2-CB 3.74Å; F431-M454 HydrophobicContact CG-CB 4.4Å
432L96.9Very high95.7Very high0 Ų034.7 Ų34.70%018%0.179CC..Hα-helixtrans-59.2-48.5176.4-83171.8000111.8Q428 N429 A434 T436 L447 M448 T451 Q550 L553 I554Q428-L432 HydrophobicContact CG-CD1 4.5Å; Q428-L432 WeakPolarHBondContact O-CG 3.37Å; Q428-L432 PolarHBondContact O-N 3.32Å; N429-L432 WeakPolarHBondContact O-CB 3.23Å; N429-L432 PolarHBondContact O-N 2.66Å; L432-A434 PolarHBondContact O-N 3.27Å; L432-T436 WeakPolarHBondContact O-CB 3.27Å; L432-T436 PolarHBondContact O-N 2.88Å; L432-T436 PolarHBondContact O-OG1 3.01Å; L432-L447 HydrophobicContact CD2-CB 4.05Å; L432-M448 HydrophobicContact CD2-CG 4.15Å; L432-T451 HydrophobicContact CD2-CG2 4Å; L432-T451 VanDerWaalsContact CD2-OG1 3.23Å; L432-T451 WeakPolarHBondContact CD2-OG1 3.06Å; L432-T451 HydrophobicContact CG-CG2 4.19Å; L432-T451 WeakPolarHBondContact CG-OG1 3.27Å; L432-Q550 HydrophobicContact CD1-CB 3.65Å; L432-Q550 HydrophobicContact CD1-CG 3.48Å; L432-Q550 VanDerWaalsContact CD1-CG 3.48Å; L432-L553 HydrophobicContact CB-CD2 4.3Å; L432-I554 HydrophobicContact CD2-CD1 3.8Å; L432-I554 HydrophobicContact CD2-CG1 3.99Å
433V96.1Very high95.8Very high27 Ų2735 Ų3516%0.16418%0.183CC..Hα-helixtrans-58.8-50.4175.5175.80000110.2N429 Y435 T436 K437 L553 V557 L568N429-V433 WeakPolarHBondContact O-CG2 3.11Å; N429-V433 PolarHBondContact O-N 3.38Å; V433-Y435 PolarHBondContact O-N 3.47Å; V433-T436 PolarHBondContact O-N 2.94Å; V433-K437 HydrophobicContact CG1-CD 4.39Å; V433-K437 WeakPolarHBondContact O-CG 3.42Å; V433-K437 PolarHBondContact O-N 3.48Å; V433-K437 VanDerWaalsContact O-N 3.07Å; V433-L553 HydrophobicContact CG2-CD1 3.69Å; V433-L553 HydrophobicContact CG2-CD2 4.1Å; V433-L553 HydrophobicContact CG2-CG 4.1Å; V433-V557 HydrophobicContact CG1-CG2 4.22Å; V433-V557 HydrophobicContact CG2-CG2 4.22Å; V433-L568 HydrophobicContact CG1-CD2 4.37Å; V433-L568 HydrophobicContact CG2-CD2 3.65Å
434A95.4Very high95.8Very high35 Ų3534.4 Ų34.429%0.28918%0.175SC..Hα-helixtrans-61.7-46.6-17800000112.7A430 F431 L432 K437 K438A430-A434 PolarHBondContact O-N 2.7Å; A430-A434 VanDerWaalsContact O-N 3.12Å; F431-A434 PolarHBondContact O-N 3.49Å; L432-A434 PolarHBondContact O-N 3.27Å; A434-K437 PolarHBondContact O-N 3.29Å; A434-K438 WeakPolarHBondContact O-CD 3.22Å; A434-K438 WeakPolarHBondContact O-CG 3.23Å; A434-K438 PolarHBondContact O-N 2.98Å; A434-K438 VanDerWaalsContact O-N 3.08Å
435Y97.1Very high95.8Very high28 Ų2834 Ų3411%0.1118%0.182CC..Hα-helixtrans-75.4-29.3-178.2-86.8-95.2000113F431 V433 K437 K438 A439 T451 M454F431-Y435 WeakPolarHBondContact O-CB 3.2Å; F431-Y435 WeakPolarHBondContact O-CD2 3.4Å; F431-Y435 PolarHBondContact O-N 2.88Å; V433-Y435 PolarHBondContact O-N 3.47Å; Y435-K437 VanDerWaalsContact C-N 3.32Å; Y435-K438 PolarHBondContact O-N 3.28Å; Y435-A439 PolarHBondContact O-N 3.09Å; Y435-T451 HydrophobicContact CD2-CG2 4.33Å; Y435-T451 HydrophobicContact CG-CG2 4.36Å; Y435-M454 HydrophobicContact CD1-CE 4.47Å; Y435-M454 HydrophobicContact CD2-CE 4.46Å; Y435-M454 HydrophobicContact CD2-SD 4.04Å; Y435-M454 HydrophobicContact CE1-CE 3.67Å; Y435-M454 HydrophobicContact CE1-SD 4.47Å; Y435-M454 HydrophobicContact CE2-CE 3.66Å; Y435-M454 HydrophobicContact CE2-SD 3.41Å; Y435-M454 WeakPolarHBondContact CE2-SD 3.15Å; Y435-M454 WeakPolarHBondContact OH-CE 3.42Å
436T97.6Very high95.8Very high1 Ų134.1 Ų34.11%0.00618%0.184CC..Hα-helixtrans-67.9-36172.4-55.60000110.6L432 V433 P440 L447 I554 V557 K558L432-T436 WeakPolarHBondContact O-CB 3.27Å; L432-T436 PolarHBondContact O-N 2.88Å; L432-T436 PolarHBondContact O-OG1 3.01Å; V433-T436 PolarHBondContact O-N 2.94Å; T436-P440 WeakPolarHBondContact O-CA 3.48Å; T436-P440 VanDerWaalsContact O-CB 3.23Å; T436-P440 WeakPolarHBondContact O-CB 3.44Å; T436-P440 VanDerWaalsContact O-CD 3.24Å; T436-P440 WeakPolarHBondContact O-CD 3.37Å; T436-P440 VanDerWaalsContact O-N 3.11Å; T436-L447 HydrophobicContact CG2-CD1 4.3Å; T436-I554 HydrophobicContact CG2-CG2 4.28Å; T436-V557 HydrophobicContact CG2-CB 3.79Å; T436-V557 HydrophobicContact CG2-CG1 3.66Å; T436-K558 HydrophobicContact CG2-CG 3.64Å
437K96.6Very high96Very high47 Ų4727.1 Ų27.120%0.20416%0.156CC..Hα-helixtrans-65.3-43.3171.6-72.1-177.7-178.3-166.30112.5V433 A434 Y435 V517 D518 V557 P561 I563V433-K437 HydrophobicContact CG1-CD 4.39Å; V433-K437 WeakPolarHBondContact O-CG 3.42Å; V433-K437 PolarHBondContact O-N 3.48Å; V433-K437 VanDerWaalsContact O-N 3.07Å; A434-K437 PolarHBondContact O-N 3.29Å; Y435-K437 VanDerWaalsContact C-N 3.32Å; K437-V517 HydrophobicContact CB-CG2 4.07Å; K437-V517 HydrophobicContact CD-CG2 4.11Å; K437-V517 HydrophobicContact CG-CG2 4.23Å; K437-V517 WeakPolarHBondContact O-CA 3.45Å; K437-D518 PolarHBondContact O-N 3.23Å; K437-V557 HydrophobicContact CG-CG1 3.67Å; K437-P561 WeakPolarHBondContact CE-O 3.15Å; K437-P561 WeakPolarHBondContact CG-O 3.46Å; K437-I563 PolarHBondContact NZ-O 3.12Å
438K96.8Very high96.1Very high28 Ų2827.9 Ų27.912%0.12216%0.16CC..Hα-helixtrans-72.1-33.7-178.2-67.1165.3-173.6-78.60113.8A434 Y435 N494 F512 S513 L515 V516A434-K438 WeakPolarHBondContact O-CD 3.22Å; A434-K438 WeakPolarHBondContact O-CG 3.23Å; A434-K438 PolarHBondContact O-N 2.98Å; A434-K438 VanDerWaalsContact O-N 3.08Å; Y435-K438 PolarHBondContact O-N 3.28Å; K438-N494 PolarHBondContact O-ND2 3.47Å; K438-F512 PolarHBondContact NZ-O 3.33Å; K438-S513 PolarHBondContact NZ-O 2.9Å; K438-L515 HydrophobicContact CB-CB 4.2Å; K438-L515 HydrophobicContact CD-CB 4.13Å; K438-L515 HydrophobicContact CG-CB 3.77Å; K438-L515 PolarHBondContact NZ-O 2.61Å; K438-V516 WeakPolarHBondContact CA-O 3.24Å
439A97.2Very high96Very high2 Ų229.5 Ų29.52%0.01718%0.175CC..  trans-146.560.8-171.400000112Y435 Q441 L442 V493 V497Y435-A439 PolarHBondContact O-N 3.09Å; A439-Q441 PolarHBondContact O-N 3.45Å; A439-Q441 VanDerWaalsContact O-N 3.11Å; A439-L442 HydrophobicContact CB-CD1 3.83Å; A439-L442 HydrophobicContact CB-CG 4.13Å; A439-L442 PolarHBondContact O-N 2.89Å; A439-L442 VanDerWaalsContact O-N 3.17Å; A439-V493 HydrophobicContact CB-CG1 3.84Å; A439-V497 HydrophobicContact CB-CG2 4.21Å
440P96.6Very high96Very high2 Ų229.5 Ų29.51%0.01318%0.175CC..THydrogen-bonded Turntrans-64.6-15.1-176.126.2-35000114.2T436 L442 D518 Y521 K558T436-P440 WeakPolarHBondContact O-CA 3.48Å; T436-P440 VanDerWaalsContact O-CB 3.23Å; T436-P440 WeakPolarHBondContact O-CB 3.44Å; T436-P440 VanDerWaalsContact O-CD 3.24Å; T436-P440 WeakPolarHBondContact O-CD 3.37Å; T436-P440 VanDerWaalsContact O-N 3.11Å; P440-L442 VanDerWaalsContact C-N 3.29Å; P440-L442 PolarHBondContact O-N 3.19Å; P440-D518 HydrophobicContact CG-CB 4.2Å; P440-Y521 HydrophobicContact CB-CD1 3.85Å; P440-Y521 HydrophobicContact CB-CD2 3.66Å; P440-Y521 HydrophobicContact CB-CE1 3.9Å; P440-Y521 HydrophobicContact CB-CE2 3.74Å; P440-Y521 HydrophobicContact CB-CG 3.71Å; P440-Y521 VanDerWaalsContact CG-CB 3.45Å; P440-Y521 HydrophobicContact CG-CD1 3.74Å; P440-Y521 HydrophobicContact CG-CD2 3.44Å; P440-Y521 VanDerWaalsContact CG-CD2 3.44Å; P440-Y521 HydrophobicContact CG-CE1 4.31Å; P440-Y521 HydrophobicContact CG-CE2 4.07Å; P440-Y521 HydrophobicContact CG-CG 3.23Å; P440-K558 WeakPolarHBondContact O-CE 3.46Å; P440-K558 PolarHBondContact O-NZ 3.19Å
441Q96Very high96.1Very high69 Ų6927.4 Ų27.432%0.32216%0.157SC..THydrogen-bonded Turntrans-71.6-20.4176.5-59.881.4200113.3A439 V493 N494 D518 Y521A439-Q441 PolarHBondContact O-N 3.45Å; A439-Q441 VanDerWaalsContact O-N 3.11Å; Q441-V493 HydrophobicContact CB-CG1 4.21Å; Q441-V493 VanDerWaalsContact CG-O 3.28Å; Q441-V493 WeakPolarHBondContact CG-O 3.38Å; Q441-N494 PolarHBondContact OE1-ND2 3.43Å; Q441-D518 PolarHBondContact NE2-OD2 3.14Å; Q441-D518 PolarHBondContact OE1-OD2 3.44Å; Q441-Y521 HydrophobicContact CG-CD2 4.44Å
442L96.3Very high96.1Very high1 Ų130.1 Ų30.11%0.00517%0.166CC..SBendtrans-64.8145.7174.3-68175.3000110.8A439 P440 E446 L447 I450 L484 V493 K558A439-L442 HydrophobicContact CB-CD1 3.83Å; A439-L442 HydrophobicContact CB-CG 4.13Å; A439-L442 PolarHBondContact O-N 2.89Å; A439-L442 VanDerWaalsContact O-N 3.17Å; P440-L442 VanDerWaalsContact C-N 3.29Å; P440-L442 PolarHBondContact O-N 3.19Å; L442-E446 HydrophobicContact CB-CB 4.34Å; L442-L447 HydrophobicContact CB-CD1 4.3Å; L442-L447 HydrophobicContact CB-CD2 4.11Å; L442-L447 HydrophobicContact CB-CG 3.8Å; L442-L447 HydrophobicContact CD1-CD2 3.98Å; L442-L447 HydrophobicContact CD1-CG 4.43Å; L442-I450 HydrophobicContact CD1-CD1 4.2Å; L442-L484 HydrophobicContact CD1-CD1 3.92Å; L442-L484 HydrophobicContact CD2-CD1 4.08Å; L442-V493 HydrophobicContact CD2-CG1 4.18Å; L442-V493 HydrophobicContact CD2-CG2 3.76Å; L442-V493 HydrophobicContact CG-CG1 4.02Å; L442-V493 HydrophobicContact CG-CG2 4.49Å; L442-K558 PolarHBondContact O-NZ 2.81Å
443T94.9Very high96Very high67 Ų6734.8 Ų34.841%0.41119%0.187SC..  trans-66.2159.4173.362.60000111.3S445 E446 L447T443-S445 VanDerWaalsContact C-N 3.26Å; T443-S445 PolarHBondContact O-N 3.13Å; T443-S445 PolarHBondContact OG1-OG 3.48Å; T443-E446 WeakPolarHBondContact CB-OE2 3.4Å; T443-E446 WeakPolarHBondContact CG2-OE2 3.49Å; T443-E446 PolarHBondContact N-OE2 2.69Å; T443-E446 PolarHBondContact O-N 2.9Å; T443-E446 WeakPolarHBondContact OG1-CB 3.42Å; T443-E446 WeakPolarHBondContact OG1-CG 3.15Å; T443-E446 PolarHBondContact OG1-N 3.17Å; T443-E446 PolarHBondContact OG1-OE2 2.82Å; T443-L447 PolarHBondContact O-N 3.17Å
444S94.6Very high96Very high18 Ų1834.6 Ų34.613%0.12618%0.184CC..Hα-helixtrans-60.6-38.3178.9-56.20000111.8L447 M448S444-L447 PolarHBondContact O-N 3.07Å; S444-M448 WeakPolarHBondContact O-CB 3.23Å; S444-M448 WeakPolarHBondContact O-CE 3.42Å; S444-M448 VanDerWaalsContact O-CG 3.3Å; S444-M448 WeakPolarHBondContact O-CG 3.35Å; S444-M448 PolarHBondContact O-N 3.29Å
445S94.1Very high96Very high80 Ų8033 Ų3356%0.55917%0.171SC*.Hα-helixtrans-65-41.1176.655.80000112.5T443 M448 A449T443-S445 VanDerWaalsContact C-N 3.26Å; T443-S445 PolarHBondContact O-N 3.13Å; T443-S445 PolarHBondContact OG1-OG 3.48Å; S445-M448 PolarHBondContact O-N 3.22Å; S445-A449 VanDerWaalsContact O-CB 3.27Å; S445-A449 WeakPolarHBondContact O-CB 3.26Å; S445-A449 PolarHBondContact O-N 3.07Å
446E95.3Very high95.9Very high41 Ų4133.3 Ų33.319%0.19218%0.179CC..Hα-helixtrans-64.2-46.7175.5-73.8165.4141.700111.7L442 T443 M448 A449 I450 R487L442-E446 HydrophobicContact CB-CB 4.34Å; T443-E446 WeakPolarHBondContact CB-OE2 3.4Å; T443-E446 WeakPolarHBondContact CG2-OE2 3.49Å; T443-E446 PolarHBondContact N-OE2 2.69Å; T443-E446 PolarHBondContact O-N 2.9Å; T443-E446 WeakPolarHBondContact OG1-CB 3.42Å; T443-E446 WeakPolarHBondContact OG1-CG 3.15Å; T443-E446 PolarHBondContact OG1-N 3.17Å; T443-E446 PolarHBondContact OG1-OE2 2.82Å; E446-M448 PolarHBondContact O-N 3.39Å; E446-A449 PolarHBondContact O-N 3.39Å; E446-I450 VanDerWaalsContact O-CG1 3.32Å; E446-I450 WeakPolarHBondContact O-CG1 3.32Å; E446-I450 PolarHBondContact O-N 2.86Å; E446-R487 IonicContact OE1-CZ 3.87Å; E446-R487 IonicContact OE1-NE 2.74Å; E446-R487 PolarHBondContact OE1-NE 3.11Å; E446-R487 IonicContact OE1-NH2 3.95Å; E446-R487 PolarHBondContact OE1-NH2 3.35Å; E446-R487 IonicContact OE2-NH2 2.83Å
447L97.6Very high95.8Very high1 Ų134.6 Ų34.61%0.00519%0.187CC..Hα-helixtrans-59.3-46.7176.4-74.9162.9000111.4L432 T436 L442 T443 S444 T451 I554L432-L447 HydrophobicContact CD2-CB 4.05Å; T436-L447 HydrophobicContact CG2-CD1 4.3Å; L442-L447 HydrophobicContact CB-CD1 4.3Å; L442-L447 HydrophobicContact CB-CD2 4.11Å; L442-L447 HydrophobicContact CB-CG 3.8Å; L442-L447 HydrophobicContact CD1-CD2 3.98Å; L442-L447 HydrophobicContact CD1-CG 4.43Å; T443-L447 PolarHBondContact O-N 3.17Å; S444-L447 PolarHBondContact O-N 3.07Å; L447-T451 WeakPolarHBondContact O-CB 3.31Å; L447-T451 VanDerWaalsContact O-CG2 3.23Å; L447-T451 WeakPolarHBondContact O-CG2 3.5Å; L447-T451 PolarHBondContact O-N 3.44Å; L447-T451 PolarHBondContact O-OG1 3.34Å; L447-I554 HydrophobicContact CB-CD1 4.21Å; L447-I554 HydrophobicContact CD1-CG2 3.9Å
448M96.4Very high95.7Very high16 Ų1632.9 Ų32.98%0.07918%0.182CC..Hα-helixtrans-62.5-43.9175.9-73.5-172.4-73.700112.1Q428 L432 S444 S445 E446 T451 R452 T547 Q550 I554Q428-M448 PolarHBondContact NE2-O 3.27Å; L432-M448 HydrophobicContact CD2-CG 4.15Å; S444-M448 WeakPolarHBondContact O-CB 3.23Å; S444-M448 WeakPolarHBondContact O-CE 3.42Å; S444-M448 VanDerWaalsContact O-CG 3.3Å; S444-M448 WeakPolarHBondContact O-CG 3.35Å; S444-M448 PolarHBondContact O-N 3.29Å; S445-M448 PolarHBondContact O-N 3.22Å; E446-M448 PolarHBondContact O-N 3.39Å; M448-T451 PolarHBondContact O-OG1 2.88Å; M448-R452 WeakPolarHBondContact O-CB 3.31Å; M448-R452 PolarHBondContact O-N 3.46Å; M448-T547 HydrophobicContact CE-CG2 4.02Å; M448-T547 HydrophobicContact SD-CG2 3.89Å; M448-Q550 HydrophobicContact CG-CB 4.28Å; M448-Q550 HydrophobicContact SD-CB 3.88Å; M448-I554 HydrophobicContact CG-CD1 3.75Å; M448-I554 HydrophobicContact SD-CD1 4.49Å
449A94.1Very high95.5Very high43 Ų4332.8 Ų32.836%0.35519%0.186SC..Hα-helixtrans-63.5-45.1-179.400000112.3S445 E446 K453S445-A449 VanDerWaalsContact O-CB 3.27Å; S445-A449 WeakPolarHBondContact O-CB 3.26Å; S445-A449 PolarHBondContact O-N 3.07Å; E446-A449 PolarHBondContact O-N 3.39Å; A449-K453 WeakPolarHBondContact O-CG 3.28Å; A449-K453 PolarHBondContact O-N 2.96Å
450I96Very high95.3Very high27 Ų2737.1 Ų37.114%0.13821%0.213CC..Hα-helixtrans-66.7-47.9-179.7-68.1165.8000110.6L442 E446 K453 M454 I480 L484L442-I450 HydrophobicContact CD1-CD1 4.2Å; E446-I450 VanDerWaalsContact O-CG1 3.32Å; E446-I450 WeakPolarHBondContact O-CG1 3.32Å; E446-I450 PolarHBondContact O-N 2.86Å; I450-K453 WeakPolarHBondContact O-CB 3.08Å; I450-K453 PolarHBondContact O-N 3.29Å; I450-M454 HydrophobicContact CG2-CE 3.44Å; I450-M454 VanDerWaalsContact CG2-CE 3.44Å; I450-M454 HydrophobicContact CG2-SD 4.29Å; I450-M454 WeakPolarHBondContact O-CG 3.48Å; I450-M454 PolarHBondContact O-N 3Å; I450-M454 VanDerWaalsContact O-N 3.13Å; I450-I480 HydrophobicContact CG2-CG2 3.91Å; I450-L484 HydrophobicContact CD1-CB 4.48Å; I450-L484 HydrophobicContact CD1-CD1 3.94Å
451T96.9Very high95.3Very high0 Ų037.2 Ų37.20%021%0.213CC..Hα-helixtrans-70.9-32.7-177.156.40000112.6F431 L432 Y435 L447 M448 K453 M454 A455F431-T451 HydrophobicContact CB-CG2 3.77Å; L432-T451 HydrophobicContact CD2-CG2 4Å; L432-T451 VanDerWaalsContact CD2-OG1 3.23Å; L432-T451 WeakPolarHBondContact CD2-OG1 3.06Å; L432-T451 HydrophobicContact CG-CG2 4.19Å; L432-T451 WeakPolarHBondContact CG-OG1 3.27Å; Y435-T451 HydrophobicContact CD2-CG2 4.33Å; Y435-T451 HydrophobicContact CG-CG2 4.36Å; L447-T451 WeakPolarHBondContact O-CB 3.31Å; L447-T451 VanDerWaalsContact O-CG2 3.23Å; L447-T451 WeakPolarHBondContact O-CG2 3.5Å; L447-T451 PolarHBondContact O-N 3.44Å; L447-T451 PolarHBondContact O-OG1 3.34Å; M448-T451 PolarHBondContact O-OG1 2.88Å; T451-K453 VanDerWaalsContact C-N 3.35Å; T451-M454 WeakPolarHBondContact O-CB 3.45Å; T451-M454 PolarHBondContact O-N 3.38Å; T451-A455 PolarHBondContact O-N 2.8Å
452R95.9Very high95.2Very high99 Ų9934.9 Ų34.937%0.37420%0.204SC..Hα-helixtrans-61.2-43.5171.2-173.1178.7-64.8138-0.3111.2M448 M454 A455 A456M448-R452 WeakPolarHBondContact O-CB 3.31Å; M448-R452 PolarHBondContact O-N 3.46Å; R452-M454 VanDerWaalsContact C-N 3.3Å; R452-M454 PolarHBondContact O-N 3.48Å; R452-A455 PolarHBondContact O-N 2.8Å; R452-A456 WeakPolarHBondContact O-CB 3.41Å; R452-A456 PolarHBondContact O-N 2.71Å
453K95.1Very high95Very high98 Ų9841.8 Ų41.843%0.42624%0.237SC..Hα-helixtrans-60.5-39.7174.3-71.2175.5179.6-176.20111.7A449 I450 T451 T457 I480A449-K453 WeakPolarHBondContact O-CG 3.28Å; A449-K453 PolarHBondContact O-N 2.96Å; I450-K453 WeakPolarHBondContact O-CB 3.08Å; I450-K453 PolarHBondContact O-N 3.29Å; T451-K453 VanDerWaalsContact C-N 3.35Å; K453-T457 WeakPolarHBondContact O-CB 3.47Å; K453-T457 PolarHBondContact O-N 3.02Å; K453-T457 PolarHBondContact O-OG1 2.79Å; K453-I480 HydrophobicContact CB-CD1 3.88Å; K453-I480 HydrophobicContact CB-CG1 4.11Å
454M95.6Very high94.8Very high24 Ų2442.2 Ų42.212%0.11824%0.236CC..Hα-helixtrans-65.9-43.7176.7-66.2170.2-17900112.4F431 Y435 I450 T451 R452 T457 A458 I480F431-M454 HydrophobicContact CD2-CB 3.68Å; F431-M454 HydrophobicContact CE2-CB 3.74Å; F431-M454 HydrophobicContact CG-CB 4.4Å; Y435-M454 HydrophobicContact CD1-CE 4.47Å; Y435-M454 HydrophobicContact CD2-CE 4.46Å; Y435-M454 HydrophobicContact CD2-SD 4.04Å; Y435-M454 HydrophobicContact CE1-CE 3.67Å; Y435-M454 HydrophobicContact CE1-SD 4.47Å; Y435-M454 HydrophobicContact CE2-CE 3.66Å; Y435-M454 HydrophobicContact CE2-SD 3.41Å; Y435-M454 WeakPolarHBondContact CE2-SD 3.15Å; Y435-M454 WeakPolarHBondContact OH-CE 3.42Å; I450-M454 HydrophobicContact CG2-CE 3.44Å; I450-M454 VanDerWaalsContact CG2-CE 3.44Å; I450-M454 HydrophobicContact CG2-SD 4.29Å; I450-M454 WeakPolarHBondContact O-CG 3.48Å; I450-M454 PolarHBondContact O-N 3Å; I450-M454 VanDerWaalsContact O-N 3.13Å; T451-M454 WeakPolarHBondContact O-CB 3.45Å; T451-M454 PolarHBondContact O-N 3.38Å; R452-M454 VanDerWaalsContact C-N 3.3Å; R452-M454 PolarHBondContact O-N 3.48Å; M454-T457 WeakPolarHBondContact O-CB 3.38Å; M454-T457 PolarHBondContact O-N 3Å; M454-A458 PolarHBondContact O-N 3.37Å; M454-A458 VanDerWaalsContact O-N 3.11Å; M454-I480 HydrophobicContact CE-CG2 3.65Å; M454-I480 HydrophobicContact CG-CD1 4.15Å; M454-I480 HydrophobicContact CG-CG2 4.23Å
455A95.8Very high94.5Very high0 Ų044.3 Ų44.30%025%0.251CS..Hα-helixtrans-66.3-44.2177.700000112.1E424 Q428 T451 R452 T457 A458 A459E424-A455 HydrophobicContact CG-CB 3.9Å; Q428-A455 HydrophobicContact CB-CB 3.79Å; Q428-A455 HydrophobicContact CG-CB 4.33Å; T451-A455 PolarHBondContact O-N 2.8Å; R452-A455 PolarHBondContact O-N 2.8Å; A455-T457 VanDerWaalsContact C-N 3.27Å; A455-T457 PolarHBondContact O-N 3.3Å; A455-A458 WeakPolarHBondContact O-CB 3.06Å; A455-A458 PolarHBondContact O-N 3.41Å; A455-A458 VanDerWaalsContact O-N 3.08Å; A455-A459 PolarHBondContact O-N 2.95Å
456A94.9Very high93.8Very high35 Ų3547.5 Ų47.529%0.28926%0.257SS..Hα-helixtrans-62.7-33.8174.700000112.5R452 A459 T460R452-A456 WeakPolarHBondContact O-CB 3.41Å; R452-A456 PolarHBondContact O-N 2.71Å; A456-A459 PolarHBondContact O-N 3.23Å; A456-T460 PolarHBondContact O-N 3.19Å; A456-T460 PolarHBondContact O-OG1 2.86Å
457T94.7Very high92.9Very high29 Ų2950.6 Ų50.618%0.17827%0.274CS..Hα-helixtrans-62-44.2172-62.80000110.7K453 M454 A455 A459 T460 C461 A476K453-T457 WeakPolarHBondContact O-CB 3.47Å; K453-T457 PolarHBondContact O-N 3.02Å; K453-T457 PolarHBondContact O-OG1 2.79Å; M454-T457 WeakPolarHBondContact O-CB 3.38Å; M454-T457 PolarHBondContact O-N 3Å; A455-T457 VanDerWaalsContact C-N 3.27Å; A455-T457 PolarHBondContact O-N 3.3Å; T457-A459 VanDerWaalsContact C-N 3.34Å; T457-A459 PolarHBondContact O-N 2.91Å; T457-T460 PolarHBondContact O-N 3.45Å; T457-C461 WeakPolarHBondContact O-CB 3.42Å; T457-C461 PolarHBondContact O-N 3.15Å; T457-C461 PolarHBondContact O-SG 2.99Å; T457-C461 VanDerWaalsContact O-SG 3.33Å; T457-A476 HydrophobicContact CG2-CB 3.34Å
458A94.4Very high92.3Very high10 Ų1055.6 Ų55.68%0.08330%0.296CS..Hα-helixtrans-61.8-43.2175.100000111.4F419 L427 M454 A455 T460 C461 C462F419-A458 HydrophobicContact CB-CB 4.15Å; F419-A458 HydrophobicContact CD2-CB 3.96Å; F419-A458 HydrophobicContact CG-CB 4.08Å; L427-A458 HydrophobicContact CD2-CB 3.5Å; M454-A458 PolarHBondContact O-N 3.37Å; M454-A458 VanDerWaalsContact O-N 3.11Å; A455-A458 WeakPolarHBondContact O-CB 3.06Å; A455-A458 PolarHBondContact O-N 3.41Å; A455-A458 VanDerWaalsContact O-N 3.08Å; A458-T460 PolarHBondContact O-N 3.22Å; A458-C461 PolarHBondContact O-N 2.9Å; A458-C462 WeakPolarHBondContact O-CB 3.33Å; A458-C462 PolarHBondContact O-N 3.41Å; A458-C462 PolarHBondContact O-SG 2.97Å
459A93.4Very high92Very high26 Ų2656.1 Ų56.122%0.21530%0.299CS..Hα-helixtrans-59-35176.200000113.2F419 A455 A456 T457 Q463F419-A459 HydrophobicContact CE2-CB 3.77Å; F419-A459 VanDerWaalsContact CZ-CA 3.41Å; F419-A459 HydrophobicContact CZ-CB 3.66Å; A455-A459 PolarHBondContact O-N 2.95Å; A456-A459 PolarHBondContact O-N 3.23Å; T457-A459 VanDerWaalsContact C-N 3.34Å; T457-A459 PolarHBondContact O-N 2.91Å; A459-Q463 WeakPolarHBondContact O-CG 3.49Å
460T93.3Very high91.7Very high94 Ų9454.5 Ų54.558%0.57729%0.285SS*.Hα-helixtrans-80.5-50.3178.8-540000112.1A456 T457 A458A456-T460 PolarHBondContact O-N 3.19Å; A456-T460 PolarHBondContact O-OG1 2.86Å; T457-T460 PolarHBondContact O-N 3.45Å; A458-T460 PolarHBondContact O-N 3.22Å
461C95.3Very high91.5Very high4 Ų455 Ų553%0.02729%0.293CS..Hα-helixtrans-81.1-32.7-170.1-60.50000113.4T457 A458 Q463 L464 L469 C472T457-C461 WeakPolarHBondContact O-CB 3.42Å; T457-C461 PolarHBondContact O-N 3.15Å; T457-C461 PolarHBondContact O-SG 2.99Å; T457-C461 VanDerWaalsContact O-SG 3.33Å; A458-C461 PolarHBondContact O-N 2.9Å; C461-Q463 PolarHBondContact O-N 3.42Å; C461-L464 VanDerWaalsContact O-CB 3.32Å; C461-L464 WeakPolarHBondContact O-CB 3.43Å; C461-L464 WeakPolarHBondContact O-CG 3.48Å; C461-L464 PolarHBondContact O-N 3.04Å; C461-L464 VanDerWaalsContact O-N 3.07Å; C461-L469 HydrophobicContact CB-CD1 4.14Å; C461-L469 WeakPolarHBondContact O-CD1 3.49Å; C461-C472 WeakPolarHBondContact CA-SG 3.31Å; C461-C472 HydrophobicContact CB-CB 3.69Å; C461-C472 WeakPolarHBondContact CB-SG 3.31Å; C461-C472 WeakPolarHBondContact SG-CB 3.43Å; C461-C472 CovalentContact SG-SG 2.04Å; C461-C472 PolarHBondContact SG-SG 3.47Å
462C94.3Very high91.3Very high19 Ų1956.7 Ų56.713%0.12830%0.304CS..THydrogen-bonded Turntrans-72.1-7.9-176-63.80000114.2C416 F419 A458C416-C462 WeakPolarHBondContact CA-SG 2.99Å; C416-C462 HydrophobicContact CB-CB 3.76Å; C416-C462 WeakPolarHBondContact CB-SG 3.48Å; C416-C462 VanDerWaalsContact SG-CA 3.54Å; C416-C462 WeakPolarHBondContact SG-CB 3Å; C416-C462 CovalentContact SG-SG 2.05Å; C416-C462 PolarHBondContact SG-SG 2.99Å; F419-C462 HydrophobicContact CD1-CB 4.07Å; A458-C462 WeakPolarHBondContact O-CB 3.33Å; A458-C462 PolarHBondContact O-N 3.41Å; A458-C462 PolarHBondContact O-SG 2.97Å
463Q92.3Very high91.2Very high147 Ų14753.2 Ų53.269%0.68730%0.299SS*.THydrogen-bonded Turntrans-91.2-5.5172.9-54.3-59.8-16.300112.7A459 C461A459-Q463 WeakPolarHBondContact O-CG 3.49Å; C461-Q463 PolarHBondContact O-N 3.42Å
464L91.4Very high91.2Very high75 Ų7549 Ų4939%0.39328%0.281SS..SBendtrans-84.4164.3-179.9-56.4178.9000111.3C461 K468 C472C461-L464 VanDerWaalsContact O-CB 3.32Å; C461-L464 WeakPolarHBondContact O-CB 3.43Å; C461-L464 WeakPolarHBondContact O-CG 3.48Å; C461-L464 PolarHBondContact O-N 3.04Å; C461-L464 VanDerWaalsContact O-N 3.07Å; L464-K468 HydrophobicContact CB-CB 3.98Å; L464-K468 HydrophobicContact CD1-CB 4.17Å; L464-C472 HydrophobicContact CD1-CB 3.72Å
465S87.6Confident91.1Very high63 Ų6349.6 Ų49.644%0.44129%0.293SS..  trans-60.4156.5170.962.90000111.4D467 K468 L469S465-D467 PolarHBondContact O-N 3.26Å; S465-D467 VanDerWaalsContact O-N 3.13Å; S465-K468 PolarHBondContact O-N 2.92Å; S465-L469 WeakPolarHBondContact O-CB 3.31Å; S465-L469 PolarHBondContact O-N 3.42Å
466E78.8Confident91Very high146 Ų14650.8 Ų50.868%0.68230%0.303SS*.Hα-helixtrans-53.2-37.4179.1-69.1-16315000112.3
467D76.3Confident91Very high106 Ų10650.3 Ų50.357%0.56730%0.299SS*.Hα-helixtrans-66.2-36.2178.1-61.9-38.9000113Q364 S465Q364-D467 HydrophobicContact CB-CB 4.08Å; Q364-D467 WeakPolarHBondContact CB-O 3.35Å; S465-D467 PolarHBondContact O-N 3.26Å; S465-D467 VanDerWaalsContact O-N 3.13Å
468K86.2Confident91.1Very high107 Ų10749.7 Ų49.747%0.46529%0.294SS..Hα-helixtrans-88.7-24.7-179.8-68.8-171.3178.1-166.90112.5E318 L464 S465 L470 C472E318-K468 IonicContact OE1-NZ 3.19Å; E318-K468 PolarHBondContact OE1-NZ 3.04Å; L464-K468 HydrophobicContact CB-CB 3.98Å; L464-K468 HydrophobicContact CD1-CB 4.17Å; S465-K468 PolarHBondContact O-N 2.92Å; K468-L470 VanDerWaalsContact C-N 3.35Å; K468-L470 PolarHBondContact O-N 3.14Å; K468-C472 VanDerWaalsContact O-CB 3.29Å; K468-C472 WeakPolarHBondContact O-CB 3.3Å; K468-C472 PolarHBondContact O-N 2.78Å
469L89.6Confident91.2Very high26 Ų2650.8 Ų50.814%0.13630%0.298CS..Hα-helixtrans-56.5-47.2-179169.961.5000111.9A412 C416 C461 S465 C472 G473A412-L469 HydrophobicContact CB-CD2 4.18Å; A412-L469 HydrophobicContact CB-CG 4.24Å; C416-L469 VanDerWaalsContact SG-CD1 3.51Å; C461-L469 HydrophobicContact CB-CD1 4.14Å; C461-L469 WeakPolarHBondContact O-CD1 3.49Å; S465-L469 WeakPolarHBondContact O-CB 3.31Å; S465-L469 PolarHBondContact O-N 3.42Å; L469-C472 PolarHBondContact O-N 3.35Å; L469-G473 PolarHBondContact O-N 3.38Å
470L88.4Confident91.3Very high10 Ų1050.3 Ų50.35%0.05229%0.292CS..Hα-helixtrans-64.8-50-174.3-162.469.3000111.8L365 S408 Q409 A412 K468 C472 G473 E474L365-L470 HydrophobicContact CD2-CD2 3.53Å; S408-L470 WeakPolarHBondContact OG-CD1 3.39Å; Q409-L470 HydrophobicContact CG-CD1 4.25Å; Q409-L470 HydrophobicContact CG-CD2 4.29Å; A412-L470 HydrophobicContact CB-CD1 4.19Å; K468-L470 VanDerWaalsContact C-N 3.35Å; K468-L470 PolarHBondContact O-N 3.14Å; L470-C472 VanDerWaalsContact C-N 3.34Å; L470-C472 PolarHBondContact O-N 3.15Å; L470-G473 PolarHBondContact O-N 3.01Å; L470-E474 WeakPolarHBondContact O-CB 3.13Å; L470-E474 PolarHBondContact O-N 3.13Å
471A90.6Very high91.5Very high37 Ų3746.1 Ų46.131%0.30627%0.266SS..Hα-helixtrans-60.2-43177.200000111.9G475A471-G475 WeakPolarHBondContact O-CA 3.41Å; A471-G475 PolarHBondContact O-N 3.23Å
472C94.1Very high91.6Very high36 Ų3646 Ų4624%0.24327%0.265CS..Hα-helixtrans-62.4-53.1178.3-174.10000111.9C461 L464 K468 L469 L470 A476C461-C472 WeakPolarHBondContact CA-SG 3.31Å; C461-C472 HydrophobicContact CB-CB 3.69Å; C461-C472 WeakPolarHBondContact CB-SG 3.31Å; C461-C472 WeakPolarHBondContact SG-CB 3.43Å; C461-C472 CovalentContact SG-SG 2.04Å; C461-C472 PolarHBondContact SG-SG 3.47Å; L464-C472 HydrophobicContact CD1-CB 3.72Å; K468-C472 VanDerWaalsContact O-CB 3.29Å; K468-C472 WeakPolarHBondContact O-CB 3.3Å; K468-C472 PolarHBondContact O-N 2.78Å; L469-C472 PolarHBondContact O-N 3.35Å; L470-C472 VanDerWaalsContact C-N 3.34Å; L470-C472 PolarHBondContact O-N 3.15Å; C472-A476 VanDerWaalsContact O-CB 3.29Å; C472-A476 WeakPolarHBondContact O-CB 2.96Å; C472-A476 PolarHBondContact O-N 2.04Å
473G93.7Very high91.7Very high26 Ų2646.6 Ų46.627%0.26827%0.266SS..Hα-helixtrans-66.4-48.5-175.600000113.3L469 L470 A477L469-G473 PolarHBondContact O-N 3.38Å; L470-G473 PolarHBondContact O-N 3.01Å; G473-A477 VanDerWaalsContact O-CB 3.27Å; G473-A477 WeakPolarHBondContact O-CB 3.48Å; G473-A477 PolarHBondContact O-N 2.05Å
474E93.9Very high91.9Very high10 Ų1039.8 Ų39.85%0.04724%0.235CC..Hα-helixtrans-68.1-39178.3-72.8-81.5-163.900112A366 V369 R372 S408 L470 A477 D478 R509A366-E474 HydrophobicContact CB-CB 3.34Å; A366-E474 HydrophobicContact CB-CG 3.97Å; V369-E474 HydrophobicContact CG2-CG 4.19Å; R372-E474 IonicContact NH2-OE1 3.2Å; S408-E474 WeakPolarHBondContact CB-OE1 3.18Å; S408-E474 WeakPolarHBondContact OG-CG 3.45Å; S408-E474 PolarHBondContact OG-OE1 2.96Å; L470-E474 WeakPolarHBondContact O-CB 3.13Å; L470-E474 PolarHBondContact O-N 3.13Å; E474-A477 PolarHBondContact O-N 3.22Å; E474-D478 WeakPolarHBondContact O-CB 3.27Å; E474-D478 PolarHBondContact O-N 3.17Å; E474-R509 IonicContact OE1-CZ 2.7Å; E474-R509 IonicContact OE1-NE 3.93Å; E474-R509 PolarHBondContact OE1-NE 3.01Å; E474-R509 VanDerWaalsContact OE1-NE 3.14Å; E474-R509 IonicContact OE1-NH2 2.91Å; E474-R509 PolarHBondContact OE1-NH2 3.03Å; E474-R509 IonicContact OE2-CZ 3.9Å; E474-R509 IonicContact OE2-NE 2.66Å; E474-R509 PolarHBondContact OE2-NE 3.39Å; E474-R509 IonicContact OE2-NH2 3.29Å
475G93.8Very high92.2Very high35 Ų3536.4 Ų36.436%0.36122%0.217SC..Hα-helixtrans-62.9-46.617700000111.9A471 D478 I479A471-G475 WeakPolarHBondContact O-CA 3.41Å; A471-G475 PolarHBondContact O-N 3.23Å; G475-D478 WeakPolarHBondContact O-CB 3.46Å; G475-D478 PolarHBondContact O-N 3.31Å; G475-I479 WeakPolarHBondContact O-CG1 3.23Å; G475-I479 PolarHBondContact O-N 3.47Å
476A94.7Very high92.6Very high26 Ų2634 Ų3422%0.21520%0.199CC..Hα-helixtrans-65.2-41.3175.500000112.2T457 C472 D478 I479 I480T457-A476 HydrophobicContact CG2-CB 3.34Å; C472-A476 VanDerWaalsContact O-CB 3.29Å; C472-A476 WeakPolarHBondContact O-CB 2.96Å; C472-A476 PolarHBondContact O-N 2.04Å; A476-D478 VanDerWaalsContact C-N 3.31Å; A476-D478 PolarHBondContact O-N 3.3Å; A476-I479 PolarHBondContact O-N 2.95Å; A476-I480 VanDerWaalsContact O-CG1 3.27Å; A476-I480 WeakPolarHBondContact O-CG1 3.49Å; A476-I480 PolarHBondContact O-N 2.92Å
477A94.9Very high93.2Very high25 Ų2530.7 Ų30.721%0.20718%0.181CC..Hα-helixtrans-61.4-38.8175.400000112.1G473 E474 I479 I480 I481 R509G473-A477 VanDerWaalsContact O-CB 3.27Å; G473-A477 WeakPolarHBondContact O-CB 3.48Å; G473-A477 PolarHBondContact O-N 2.05Å; E474-A477 PolarHBondContact O-N 3.22Å; A477-I479 PolarHBondContact O-N 2.96Å; A477-I480 PolarHBondContact O-N 3.49Å; A477-I481 VanDerWaalsContact O-CB 3.29Å; A477-I481 WeakPolarHBondContact O-CB 3.49Å; A477-I481 VanDerWaalsContact O-CG1 3.3Å; A477-I481 WeakPolarHBondContact O-CG1 2.94Å; A477-I481 PolarHBondContact O-N 2.75Å; A477-R509 HydrophobicContact CB-CG 4.01Å
478D96.1Very high94.2Very high15 Ų1527 Ų278%0.0816%0.16CC..Hα-helixtrans-59.9-45.3176-170.647.5000111.6H222 E474 G475 A476 G482 Y505 R508H222-D478 IonicContact CD2-OD2 2.79Å; H222-D478 IonicContact CE1-OD2 2.69Å; H222-D478 PolarHBondContact CE1-OD2 3.1Å; H222-D478 IonicContact NE2-OD2 3.43Å; H222-D478 PolarHBondContact NE2-OD2 2.9Å; E474-D478 WeakPolarHBondContact O-CB 3.27Å; E474-D478 PolarHBondContact O-N 3.17Å; G475-D478 WeakPolarHBondContact O-CB 3.46Å; G475-D478 PolarHBondContact O-N 3.31Å; A476-D478 VanDerWaalsContact C-N 3.31Å; A476-D478 PolarHBondContact O-N 3.3Å; D478-G482 WeakPolarHBondContact O-CA 3.3Å; D478-G482 PolarHBondContact O-N 3.3Å; D478-Y505 WeakPolarHBondContact OD1-CE2 3.39Å; D478-Y505 PolarHBondContact OD2-OH 3.4Å; D478-R508 PolarHBondContact O-NH2 3.36Å; D478-R508 IonicContact OD1-CZ 3.66Å; D478-R508 IonicContact OD1-NE 3.1Å; D478-R508 IonicContact OD1-NH2 3.72Å; D478-R508 PolarHBondContact OD1-NH2 3.35Å; D478-R508 IonicContact OD2-NH2 3.2Å
479I96.5Very high94.4Very high33 Ų3325.7 Ų25.717%0.16916%0.155CC..Hα-helixtrans-65.6-50176.6-58.9-68.5000110.7L218 L219 H222 G475 A476 A477 I481 G482 H483L218-I479 HydrophobicContact CB-CG2 4.05Å; L219-I479 HydrophobicContact CD1-CD1 4Å; H222-I479 HydrophobicContact CB-CD1 3.93Å; H222-I479 WeakPolarHBondContact CD2-CD1 3.35Å; G475-I479 WeakPolarHBondContact O-CG1 3.23Å; G475-I479 PolarHBondContact O-N 3.47Å; A476-I479 PolarHBondContact O-N 2.95Å; A477-I479 PolarHBondContact O-N 2.96Å; I479-I481 PolarHBondContact O-N 3.06Å; I479-G482 PolarHBondContact O-N 3.15Å; I479-H483 PolarHBondContact O-CD2 3.18Å; I479-H483 PolarHBondContact O-N 3.28Å
480I96.7Very high94.5Very high16 Ų1628.9 Ų28.98%0.08218%0.176CC..Hα-helixtrans-61-46.7-176.2-66163.9000111.2I450 K453 M454 A476 A477 H483 L484I450-I480 HydrophobicContact CG2-CG2 3.91Å; K453-I480 HydrophobicContact CB-CD1 3.88Å; K453-I480 HydrophobicContact CB-CG1 4.11Å; M454-I480 HydrophobicContact CE-CG2 3.65Å; M454-I480 HydrophobicContact CG-CD1 4.15Å; M454-I480 HydrophobicContact CG-CG2 4.23Å; A476-I480 VanDerWaalsContact O-CG1 3.27Å; A476-I480 WeakPolarHBondContact O-CG1 3.49Å; A476-I480 PolarHBondContact O-N 2.92Å; A477-I480 PolarHBondContact O-N 3.49Å; I480-H483 PolarHBondContact O-N 2.83Å; I480-L484 PolarHBondContact O-N 3.48Å
481I97.4Very high94.7Very high6 Ų632 Ų323%0.03120%0.196CC..Hα-helixtrans-69.3-36.9178.3-66.7170.5000110.7A477 I479 H483 L484 C485 R508 R509 F512A477-I481 VanDerWaalsContact O-CB 3.29Å; A477-I481 WeakPolarHBondContact O-CB 3.49Å; A477-I481 VanDerWaalsContact O-CG1 3.3Å; A477-I481 WeakPolarHBondContact O-CG1 2.94Å; A477-I481 PolarHBondContact O-N 2.75Å; I479-I481 PolarHBondContact O-N 3.06Å; I481-H483 VanDerWaalsContact C-N 3.31Å; I481-H483 PolarHBondContact O-N 3.29Å; I481-L484 WeakPolarHBondContact O-CB 3.46Å; I481-L484 PolarHBondContact O-N 3.46Å; I481-C485 PolarHBondContact O-N 3.42Å; I481-C485 PolarHBondContact O-SG 3.48Å; I481-C485 VanDerWaalsContact O-SG 3.37Å; I481-R508 HydrophobicContact CG2-CG 3.75Å; I481-R509 HydrophobicContact CD1-CB 4.08Å; I481-R509 HydrophobicContact CD1-CG 4.01Å; I481-F512 HydrophobicContact CD1-CB 4.04Å; I481-F512 HydrophobicContact CD1-CD2 4.48Å; I481-F512 HydrophobicContact CD1-CG 4.3Å; I481-F512 HydrophobicContact CG2-CD1 4.39Å; I481-F512 HydrophobicContact CG2-CD2 3.29Å; I481-F512 HydrophobicContact CG2-CE1 4.37Å; I481-F512 HydrophobicContact CG2-CE2 3.26Å; I481-F512 HydrophobicContact CG2-CG 3.88Å; I481-F512 HydrophobicContact CG2-CZ 3.83Å
482G96.9Very high94.9Very high1 Ų135.1 Ų35.11%0.0121%0.213CC..Hα-helixtrans-59.4-40.9174.700000113.1D478 I479 C485 I486 R508D478-G482 WeakPolarHBondContact O-CA 3.3Å; D478-G482 PolarHBondContact O-N 3.3Å; I479-G482 PolarHBondContact O-N 3.15Å; G482-C485 WeakPolarHBondContact O-CB 3.39Å; G482-C485 PolarHBondContact O-N 3.24Å; G482-C485 VanDerWaalsContact O-N 3.12Å; G482-I486 WeakPolarHBondContact O-CG1 3.24Å; G482-I486 PolarHBondContact O-N 2.02Å; G482-R508 VanDerWaalsContact CA-NH1 3.26Å
483H96Very high95Very high32 Ų3234 Ų3415%0.14821%0.205CC..Hα-helixtrans-67.8-34.7174.8-84.4-98.7000113.2L218 Q221 I479 I480 I481 C485 I486 R487L218-H483 WeakPolarHBondContact CA-NE2 3.49Å; L218-H483 WeakPolarHBondContact CD2-CE1 3.37Å; L218-H483 WeakPolarHBondContact CD2-ND1 3.47Å; L218-H483 PolarHBondContact O-NE2 3.09Å; Q221-H483 PolarHBondContact OE1-CE1 3.49Å; I479-H483 PolarHBondContact O-CD2 3.18Å; I479-H483 PolarHBondContact O-N 3.28Å; I480-H483 PolarHBondContact O-N 2.83Å; I481-H483 VanDerWaalsContact C-N 3.31Å; I481-H483 PolarHBondContact O-N 3.29Å; H483-C485 VanDerWaalsContact C-N 3.28Å; H483-C485 PolarHBondContact O-N 2.99Å; H483-I486 PolarHBondContact O-N 2.88Å; H483-R487 WeakPolarHBondContact O-CB 3.39Å; H483-R487 PolarHBondContact O-N 3.41Å
484L96.4Very high95.1Very high5 Ų533.4 Ų33.43%0.02620%0.195CC..Hα-helixtrans-62.5-37.6169.4175.658.2000111.4L442 I450 I480 I481 R487 H488 F512L442-L484 HydrophobicContact CD1-CD1 3.92Å; L442-L484 HydrophobicContact CD2-CD1 4.08Å; I450-L484 HydrophobicContact CD1-CB 4.48Å; I450-L484 HydrophobicContact CD1-CD1 3.94Å; I480-L484 PolarHBondContact O-N 3.48Å; I481-L484 WeakPolarHBondContact O-CB 3.46Å; I481-L484 PolarHBondContact O-N 3.46Å; L484-R487 PolarHBondContact O-N 3.41Å; L484-H488 WeakPolarHBondContact O-CB 3.45Å; L484-H488 PolarHBondContact O-N 2.93Å; L484-F512 HydrophobicContact CD2-CD1 4.37Å; L484-F512 HydrophobicContact CD2-CE1 3.57Å; L484-F512 HydrophobicContact CD2-CZ 4.2Å; L484-F512 HydrophobicContact CG-CE1 4.43Å
485C97.5Very high95.3Very high4 Ų437.4 Ų37.43%0.02722%0.222CC..Hα-helixtrans-68.6-42.2175.7-65.90000113.2I481 G482 H483 R487 H488 E489 C501I481-C485 PolarHBondContact O-N 3.42Å; I481-C485 PolarHBondContact O-SG 3.48Å; I481-C485 VanDerWaalsContact O-SG 3.37Å; G482-C485 WeakPolarHBondContact O-CB 3.39Å; G482-C485 PolarHBondContact O-N 3.24Å; G482-C485 VanDerWaalsContact O-N 3.12Å; H483-C485 VanDerWaalsContact C-N 3.28Å; H483-C485 PolarHBondContact O-N 2.99Å; C485-R487 VanDerWaalsContact C-N 3.28Å; C485-R487 PolarHBondContact O-N 3.4Å; C485-H488 WeakPolarHBondContact O-CB 3.38Å; C485-H488 PolarHBondContact O-N 2.93Å; C485-H488 VanDerWaalsContact O-N 3.09Å; C485-E489 PolarHBondContact O-N 3.19Å; C485-C501 WeakPolarHBondContact CA-SG 3.21Å; C485-C501 HydrophobicContact CB-CB 3.65Å; C485-C501 WeakPolarHBondContact CB-SG 3.4Å; C485-C501 WeakPolarHBondContact SG-CA 3.27Å; C485-C501 WeakPolarHBondContact SG-CB 3.45Å; C485-C501 CovalentContact SG-SG 2.04Å; C485-C501 PolarHBondContact SG-SG 3.31Å
486I95.3Very high95.4Very high12 Ų1236.8 Ų36.86%0.06222%0.216CC..Hα-helixtrans-57.9-45.8172.7-68.8155.7000110.1P131 Q221 A225 G482 H483 H488 E489P131-I486 HydrophobicContact CB-CG2 3.74Å; P131-I486 HydrophobicContact CG-CG2 3.77Å; Q221-I486 HydrophobicContact CG-CD1 3.9Å; A225-I486 HydrophobicContact CB-CD1 3.74Å; A225-I486 HydrophobicContact CB-CG1 3.51Å; G482-I486 WeakPolarHBondContact O-CG1 3.24Å; G482-I486 PolarHBondContact O-N 2.02Å; H483-I486 PolarHBondContact O-N 2.88Å; I486-H488 VanDerWaalsContact C-N 3.31Å; I486-H488 PolarHBondContact O-N 2.95Å; I486-E489 PolarHBondContact O-N 3.02Å
487R93.2Very high95.5Very high77 Ų7735.6 Ų35.629%0.29121%0.206SC..Hα-helixtrans-62.7-37.2175.6172.555.3-171.267.65.9112.1E446 H483 L484 C485 T490 T491E446-R487 IonicContact OE1-CZ 3.87Å; E446-R487 IonicContact OE1-NE 2.74Å; E446-R487 PolarHBondContact OE1-NE 3.11Å; E446-R487 IonicContact OE1-NH2 3.95Å; E446-R487 PolarHBondContact OE1-NH2 3.35Å; E446-R487 IonicContact OE2-NH2 2.83Å; H483-R487 WeakPolarHBondContact O-CB 3.39Å; H483-R487 PolarHBondContact O-N 3.41Å; L484-R487 PolarHBondContact O-N 3.41Å; C485-R487 VanDerWaalsContact C-N 3.28Å; C485-R487 PolarHBondContact O-N 3.4Å; R487-T490 PolarHBondContact O-N 3Å; R487-T491 VanDerWaalsContact NH1-CB 3.29Å; R487-T491 PolarHBondContact NH1-O 2.87Å; R487-T491 PolarHBondContact O-N 3.29Å; R487-T491 VanDerWaalsContact O-N 3.15Å
488H95.4Very high95.6Very high29 Ų2935 Ų3513%0.13420%0.202CC..Hα-helixtrans-65.1-37.9176.6176.794000112.5L484 C485 I486 T490 T491 P492 V493 N494 V497 G498L484-H488 WeakPolarHBondContact O-CB 3.45Å; L484-H488 PolarHBondContact O-N 2.93Å; C485-H488 WeakPolarHBondContact O-CB 3.38Å; C485-H488 PolarHBondContact O-N 2.93Å; C485-H488 VanDerWaalsContact O-N 3.09Å; I486-H488 VanDerWaalsContact C-N 3.31Å; I486-H488 PolarHBondContact O-N 2.95Å; H488-T490 VanDerWaalsContact C-N 3.27Å; H488-T490 PolarHBondContact O-N 3.5Å; H488-T491 CarbonylContact O-C 3.59Å; H488-T491 PolarHBondContact O-N 2.9Å; H488-P492 VanDerWaalsContact O-CA 3.31Å; H488-P492 WeakPolarHBondContact O-CA 3.29Å; H488-P492 VanDerWaalsContact O-N 3.15Å; H488-V493 HydrophobicContact CB-CG2 4.18Å; H488-V493 PolarHBondContact CE1-N 2.92Å; H488-V493 PolarHBondContact ND1-N 3.23Å; H488-N494 PolarHBondContact CE1-O 3.01Å; H488-V497 HydrophobicContact CB-CG1 4.2Å; H488-V497 WeakPolarHBondContact ND1-CG1 3.47Å; H488-G498 VanDerWaalsContact NE2-CA 3.35Å; H488-G498 WeakPolarHBondContact NE2-CA 3.41Å
489E92.4Very high95.7Very high79 Ų7940.2 Ų40.237%0.36923%0.226SC..Hα-helixtrans-59.6-37.9175.8-74.7172-132.400112.4K228 N229 C485 I486K228-E489 IonicContact NZ-OE2 2.71Å; K228-E489 PolarHBondContact NZ-OE2 3.41Å; N229-E489 PolarHBondContact ND2-OE1 3.45Å; C485-E489 PolarHBondContact O-N 3.19Å; I486-E489 PolarHBondContact O-N 3.02Å
490T89.8Confident95.8Very high93 Ų9338.7 Ų38.757%0.57122%0.218SC*.Hα-helixtrans-77.2-39.1179.6-50.70000112.6R487 H488R487-T490 PolarHBondContact O-N 3Å; H488-T490 VanDerWaalsContact C-N 3.27Å; H488-T490 PolarHBondContact O-N 3.5Å
491T92.5Very high95.8Very high76 Ų7638.3 Ų38.347%0.46622%0.217SC..SBendtrans-144101.4176.9-520000108.5R487 H488 V493R487-T491 VanDerWaalsContact NH1-CB 3.29Å; R487-T491 PolarHBondContact NH1-O 2.87Å; R487-T491 PolarHBondContact O-N 3.29Å; R487-T491 VanDerWaalsContact O-N 3.15Å; H488-T491 CarbonylContact O-C 3.59Å; H488-T491 PolarHBondContact O-N 2.9Å; T491-V493 PolarHBondContact O-N 3.44Å
492P95.3Very high95.7Very high102 Ų10242.5 Ų42.566%0.66224%0.243SC*.  trans-52.8135.4-174.9-30.236.2000112.7H488H488-P492 VanDerWaalsContact O-CA 3.31Å; H488-P492 WeakPolarHBondContact O-CA 3.29Å; H488-P492 VanDerWaalsContact O-N 3.15Å
493V96.8Very high95.6Very high12 Ų1246.1 Ų46.17%0.07327%0.268CS..  trans-90.3-69.2-177.6-177.60000110.3A439 Q441 L442 H488 T491 V497A439-V493 HydrophobicContact CB-CG1 3.84Å; Q441-V493 HydrophobicContact CB-CG1 4.21Å; Q441-V493 VanDerWaalsContact CG-O 3.28Å; Q441-V493 WeakPolarHBondContact CG-O 3.38Å; L442-V493 HydrophobicContact CD2-CG1 4.18Å; L442-V493 HydrophobicContact CD2-CG2 3.76Å; L442-V493 HydrophobicContact CG-CG1 4.02Å; L442-V493 HydrophobicContact CG-CG2 4.49Å; H488-V493 HydrophobicContact CB-CG2 4.18Å; H488-V493 PolarHBondContact CE1-N 2.92Å; H488-V493 PolarHBondContact ND1-N 3.23Å; T491-V493 PolarHBondContact O-N 3.44Å; V493-V497 HydrophobicContact CB-CB 4.34Å; V493-V497 HydrophobicContact CB-CG1 4.27Å; V493-V497 HydrophobicContact CB-CG2 4.45Å; V493-V497 HydrophobicContact CG1-CG2 4.21Å
494N96.6Very high95.6Very high13 Ų1345.6 Ų45.67%0.0727%0.268CS..  trans-159.3168.4172.864.938.8000110.4K438 Q441 H488 G496 V497 G498 D518K438-N494 PolarHBondContact O-ND2 3.47Å; Q441-N494 PolarHBondContact OE1-ND2 3.43Å; H488-N494 PolarHBondContact CE1-O 3.01Å; N494-G496 VanDerWaalsContact C-N 3.34Å; N494-G496 PolarHBondContact O-N 3.17Å; N494-G496 PolarHBondContact OD1-N 3.35Å; N494-V497 PolarHBondContact O-N 3.04Å; N494-V497 WeakPolarHBondContact OD1-CB 3.38Å; N494-V497 VanDerWaalsContact OD1-CG2 3.32Å; N494-V497 WeakPolarHBondContact OD1-CG2 3.26Å; N494-V497 PolarHBondContact OD1-N 3.45Å; N494-G498 PolarHBondContact O-N 2.93Å; N494-D518 WeakPolarHBondContact CB-OD2 3.47Å; N494-D518 PolarHBondContact ND2-OD2 2.76Å
495P96.1Very high95.6Very high95 Ų9546 Ų4662%0.61727%0.269SS*.Hα-helixtrans-61.3-35.3-178.3-2635.9000114.5G498 Q499P495-G498 PolarHBondContact O-N 3.46Å; P495-Q499 WeakPolarHBondContact O-CB 3.3Å; P495-Q499 PolarHBondContact O-N 3.17Å
496G96.9Very high95.5Very high22 Ų2246.2 Ų46.223%0.22727%0.271CS..Hα-helixtrans-65.1-44179.200000112.7N494 Q499 C500N494-G496 VanDerWaalsContact C-N 3.34Å; N494-G496 PolarHBondContact O-N 3.17Å; N494-G496 PolarHBondContact OD1-N 3.35Å; G496-Q499 PolarHBondContact O-N 2.89Å; G496-C500 PolarHBondContact O-N 3.18Å; G496-C500 PolarHBondContact O-SG 2.81Å
497V97.5Very high95.5Very high0 Ų047.9 Ų47.90%028%0.281CS..Hα-helixtrans-61.3-46.1171.8171.70000110.3A439 H488 V493 N494 Q499 C500 C501 F512 L515A439-V497 HydrophobicContact CB-CG2 4.21Å; H488-V497 HydrophobicContact CB-CG1 4.2Å; H488-V497 WeakPolarHBondContact ND1-CG1 3.47Å; V493-V497 HydrophobicContact CB-CB 4.34Å; V493-V497 HydrophobicContact CB-CG1 4.27Å; V493-V497 HydrophobicContact CB-CG2 4.45Å; V493-V497 HydrophobicContact CG1-CG2 4.21Å; N494-V497 PolarHBondContact O-N 3.04Å; N494-V497 WeakPolarHBondContact OD1-CB 3.38Å; N494-V497 VanDerWaalsContact OD1-CG2 3.32Å; N494-V497 WeakPolarHBondContact OD1-CG2 3.26Å; N494-V497 PolarHBondContact OD1-N 3.45Å; V497-Q499 PolarHBondContact O-N 3.32Å; V497-C500 PolarHBondContact O-N 2.86Å; V497-C501 WeakPolarHBondContact O-CB 3.42Å; V497-C501 PolarHBondContact O-N 3.46Å; V497-C501 PolarHBondContact O-SG 3.19Å; V497-F512 HydrophobicContact CG1-CE1 4.21Å; V497-F512 HydrophobicContact CG1-CZ 4.02Å; V497-F512 HydrophobicContact CG2-CE1 4.21Å; V497-L515 HydrophobicContact CG2-CD1 4.37Å
498G96.9Very high95.7Very high12 Ų1244.6 Ų44.612%0.12427%0.268CS..Hα-helixtrans-59-44.6178.600000112.9H488 N494 P495 C501 T502H488-G498 VanDerWaalsContact NE2-CA 3.35Å; H488-G498 WeakPolarHBondContact NE2-CA 3.41Å; N494-G498 PolarHBondContact O-N 2.93Å; P495-G498 PolarHBondContact O-N 3.46Å; G498-C501 PolarHBondContact O-N 3.23Å; G498-T502 PolarHBondContact O-N 3.28Å; G498-T502 PolarHBondContact O-OG1 3.21Å
499Q97.1Very high95.7Very high125 Ų12544.3 Ų44.358%0.58427%0.266SS*.Hα-helixtrans-60.3-49.3175.1-176179.3500111.2P495 G496 V497 C501 T502 S503P495-Q499 WeakPolarHBondContact O-CB 3.3Å; P495-Q499 PolarHBondContact O-N 3.17Å; G496-Q499 PolarHBondContact O-N 2.89Å; V497-Q499 PolarHBondContact O-N 3.32Å; Q499-C501 VanDerWaalsContact C-N 3.28Å; Q499-C501 PolarHBondContact O-N 3.43Å; Q499-T502 PolarHBondContact O-N 2.97Å; Q499-T502 PolarHBondContact O-OG1 3.16Å; Q499-S503 WeakPolarHBondContact CG-OG 3.12Å; Q499-S503 VanDerWaalsContact O-CB 3.25Å; Q499-S503 WeakPolarHBondContact O-CB 3.4Å; Q499-S503 PolarHBondContact O-N 3.43Å; Q499-S503 PolarHBondContact O-OG 3.49Å
500C98Very high95.9Very high1 Ų141.7 Ų41.71%0.00726%0.255CS..Hα-helixtrans-64.4-32.7179.2-69.90000113.2G496 V497 T502 R508 C511 F512G496-C500 PolarHBondContact O-N 3.18Å; G496-C500 PolarHBondContact O-SG 2.81Å; V497-C500 PolarHBondContact O-N 2.86Å; C500-T502 VanDerWaalsContact C-N 3.34Å; C500-R508 WeakPolarHBondContact O-CG 3.39Å; C500-C511 WeakPolarHBondContact CA-SG 3.15Å; C500-C511 HydrophobicContact CB-CB 3.72Å; C500-C511 WeakPolarHBondContact CB-SG 3.45Å; C500-C511 WeakPolarHBondContact SG-CB 3.33Å; C500-C511 CovalentContact SG-SG 2.04Å; C500-C511 PolarHBondContact SG-SG 2.94Å; C500-F512 HydrophobicContact CB-CD2 3.54Å; C500-F512 HydrophobicContact CB-CE2 3.41Å; C500-F512 VanDerWaalsContact CB-CE2 3.41Å; C500-F512 HydrophobicContact CB-CG 4.31Å; C500-F512 HydrophobicContact CB-CZ 4.09Å
501C97.9Very high96.3Very high8 Ų839.1 Ų39.15%0.05424%0.241CC..Hα-helixtrans-71.3-25.4178.8-73.40000114.1F230 C485 V497 G498 Q499F230-C501 WeakPolarHBondContact CZ-O 3.26Å; C485-C501 WeakPolarHBondContact CA-SG 3.21Å; C485-C501 HydrophobicContact CB-CB 3.65Å; C485-C501 WeakPolarHBondContact CB-SG 3.4Å; C485-C501 WeakPolarHBondContact SG-CA 3.27Å; C485-C501 WeakPolarHBondContact SG-CB 3.45Å; C485-C501 CovalentContact SG-SG 2.04Å; C485-C501 PolarHBondContact SG-SG 3.31Å; V497-C501 WeakPolarHBondContact O-CB 3.42Å; V497-C501 PolarHBondContact O-N 3.46Å; V497-C501 PolarHBondContact O-SG 3.19Å; G498-C501 PolarHBondContact O-N 3.23Å; Q499-C501 VanDerWaalsContact C-N 3.28Å; Q499-C501 PolarHBondContact O-N 3.43Å
502T96Very high96.5Very high95 Ų9535.6 Ų35.658%0.58322%0.219SC*.Hα-helixtrans-113.8-25.7-171.153.70000114.1G498 Q499 C500 S504G498-T502 PolarHBondContact O-N 3.28Å; G498-T502 PolarHBondContact O-OG1 3.21Å; Q499-T502 PolarHBondContact O-N 2.97Å; Q499-T502 PolarHBondContact O-OG1 3.16Å; C500-T502 VanDerWaalsContact C-N 3.34Å; T502-S504 PolarHBondContact O-N 2.98Å
503S94.8Very high96.4Very high77 Ų7733.4 Ų33.454%0.53821%0.206SC..SBendtrans-68.2-40.3-169.4-61.70000114.6Q499Q499-S503 WeakPolarHBondContact CG-OG 3.12Å; Q499-S503 VanDerWaalsContact O-CB 3.25Å; Q499-S503 WeakPolarHBondContact O-CB 3.4Å; Q499-S503 PolarHBondContact O-N 3.43Å; Q499-S503 PolarHBondContact O-OG 3.49Å
504S95.5Very high96.4Very high20 Ų2037.3 Ų37.314%0.1423%0.234CC..  trans-168.3123.6-176.8176.70000111.2T502 N507 R508T502-S504 PolarHBondContact O-N 2.98Å; S504-N507 PolarHBondContact O-N 2.98Å; S504-N507 PolarHBondContact OG-N 3.43Å; S504-N507 PolarHBondContact OG-ND2 3.42Å; S504-R508 WeakPolarHBondContact O-CB 3.41Å; S504-R508 PolarHBondContact O-N 2.92Å
505Y96.1Very high96.4Very high13 Ų1338.3 Ų38.35%0.05124%0.239CC..THydrogen-bonded Turntrans-55.3-55.2174.5173.2-104.4000111.9V226 F230 T234 I238 L371 D478 N507 R508V226-Y505 HydrophobicContact CG1-CD2 4.24Å; V226-Y505 HydrophobicContact CG1-CE2 4.35Å; V226-Y505 HydrophobicContact CG2-CD2 3.89Å; V226-Y505 HydrophobicContact CG2-CE2 3.67Å; F230-Y505 HydrophobicContact CD2-CD2 4.09Å; F230-Y505 HydrophobicContact CD2-CG 4.37Å; F230-Y505 AromaticContact CE2-CD2 3.94Å; F230-Y505 HydrophobicContact CE2-CD2 3.94Å; F230-Y505 HydrophobicContact CE2-CG 4.45Å; T234-Y505 HydrophobicContact CG2-CD1 3.93Å; T234-Y505 HydrophobicContact CG2-CG 3.91Å; I238-Y505 HydrophobicContact CD1-CD1 3.86Å; I238-Y505 HydrophobicContact CD1-CE1 3.34Å; I238-Y505 HydrophobicContact CD1-CE2 4.08Å; I238-Y505 HydrophobicContact CD1-CG 4.43Å; I238-Y505 VanDerWaalsContact CD1-CZ 3.48Å; I238-Y505 HydrophobicContact CG1-CD1 4.17Å; I238-Y505 HydrophobicContact CG1-CE1 3.52Å; L371-Y505 HydrophobicContact CD1-CD1 3.86Å; L371-Y505 HydrophobicContact CD1-CE1 3.72Å; D478-Y505 WeakPolarHBondContact OD1-CE2 3.39Å; D478-Y505 PolarHBondContact OD2-OH 3.4Å; Y505-N507 VanDerWaalsContact C-N 3.29Å; Y505-N507 PolarHBondContact O-N 3.17Å; Y505-R508 VanDerWaalsContact O-CB 3.26Å; Y505-R508 WeakPolarHBondContact O-CB 3.4Å; Y505-R508 PolarHBondContact O-N 2.86Å; Y505-R508 VanDerWaalsContact O-N 3.15Å
506A95.1Very high96.2Very high9 Ų939.2 Ų39.27%0.07424%0.243CC..THydrogen-bonded Turntrans-62.6-33.2-176.100000113.2L371 R372L371-A506 HydrophobicContact CB-CB 3.75Å; R372-A506 VanDerWaalsContact CD-O 3.28Å; R372-A506 WeakPolarHBondContact CD-O 3.23Å; R372-A506 HydrophobicContact CG-CB 3.82Å; R372-A506 VanDerWaalsContact CG-O 3.27Å; R372-A506 WeakPolarHBondContact CG-O 3.41Å
507N95.9Very high96.1Very high48 Ų4839.1 Ų39.126%0.25724%0.238SC..THydrogen-bonded Turntrans-95.65.8179.6-66.8-56.3000114.2R372 S504 Y505 R509 P510 C511R372-N507 WeakPolarHBondContact CD-OD1 3.32Å; R372-N507 WeakPolarHBondContact CG-OD1 3.38Å; S504-N507 PolarHBondContact O-N 2.98Å; S504-N507 PolarHBondContact OG-N 3.43Å; S504-N507 PolarHBondContact OG-ND2 3.42Å; Y505-N507 VanDerWaalsContact C-N 3.29Å; Y505-N507 PolarHBondContact O-N 3.17Å; N507-R509 PolarHBondContact O-N 3.27Å; N507-P510 WeakPolarHBondContact O-CD 3.5Å; N507-C511 WeakPolarHBondContact O-CB 3.46Å; N507-C511 PolarHBondContact O-N 2.96Å
508R96.8Very high96Very high7 Ų740.1 Ų40.13%0.02624%0.243CC..Hα-helixtrans-59.2-51-177-174.7169.363.816712.2111.9H222 D478 I481 G482 C500 S504 Y505 C511 F512H222-R508 PolarHBondContact CE1-NH2 3.27Å; D478-R508 PolarHBondContact O-NH2 3.36Å; D478-R508 IonicContact OD1-CZ 3.66Å; D478-R508 IonicContact OD1-NE 3.1Å; D478-R508 IonicContact OD1-NH2 3.72Å; D478-R508 PolarHBondContact OD1-NH2 3.35Å; D478-R508 IonicContact OD2-NH2 3.2Å; I481-R508 HydrophobicContact CG2-CG 3.75Å; G482-R508 VanDerWaalsContact CA-NH1 3.26Å; C500-R508 WeakPolarHBondContact O-CG 3.39Å; S504-R508 WeakPolarHBondContact O-CB 3.41Å; S504-R508 PolarHBondContact O-N 2.92Å; Y505-R508 VanDerWaalsContact O-CB 3.26Å; Y505-R508 WeakPolarHBondContact O-CB 3.4Å; Y505-R508 PolarHBondContact O-N 2.86Å; Y505-R508 VanDerWaalsContact O-N 3.15Å; R508-C511 WeakPolarHBondContact O-CB 3.49Å; R508-C511 PolarHBondContact O-N 3.29Å; R508-F512 HydrophobicContact CG-CD2 4.03Å; R508-F512 HydrophobicContact CG-CE2 3.98Å; R508-F512 WeakPolarHBondContact O-CD2 3.43Å; R508-F512 PolarHBondContact O-N 3.47Å
509R95.7Very high95.8Very high24 Ų2446.4 Ų46.49%0.09127%0.269CS..Hα-helixtrans-60.1-50.1178.3-176.1-75-59155.7-1.3112.6L411 E474 A477 I481 N507 C511 F512 S513L411-R509 VanDerWaalsContact CD2-NH1 3.35Å; E474-R509 IonicContact OE1-CZ 2.7Å; E474-R509 IonicContact OE1-NE 3.93Å; E474-R509 PolarHBondContact OE1-NE 3.01Å; E474-R509 VanDerWaalsContact OE1-NE 3.14Å; E474-R509 IonicContact OE1-NH2 2.91Å; E474-R509 PolarHBondContact OE1-NH2 3.03Å; E474-R509 IonicContact OE2-CZ 3.9Å; E474-R509 IonicContact OE2-NE 2.66Å; E474-R509 PolarHBondContact OE2-NE 3.39Å; E474-R509 IonicContact OE2-NH2 3.29Å; A477-R509 HydrophobicContact CB-CG 4.01Å; I481-R509 HydrophobicContact CD1-CB 4.08Å; I481-R509 HydrophobicContact CD1-CG 4.01Å; N507-R509 PolarHBondContact O-N 3.27Å; R509-C511 VanDerWaalsContact C-N 3.32Å; R509-C511 PolarHBondContact O-N 3.4Å; R509-F512 PolarHBondContact O-N 2.96Å; R509-S513 PolarHBondContact O-N 3.09Å; R509-S513 PolarHBondContact O-OG 3.46Å
510P96.1Very high95.6Very high23 Ų2344.8 Ų44.815%0.14927%0.268CS..Hα-helixtrans-54.1-43.5170.9-2731.4000113.9N507 F512 S513 S514N507-P510 WeakPolarHBondContact O-CD 3.5Å; P510-F512 PolarHBondContact O-N 3.5Å; P510-S513 VanDerWaalsContact O-CB 3.31Å; P510-S513 WeakPolarHBondContact O-CB 3.46Å; P510-S513 PolarHBondContact O-N 3.35Å; P510-S513 VanDerWaalsContact O-N 3.11Å; P510-S514 PolarHBondContact O-N 2.68Å; P510-S514 PolarHBondContact O-OG 3.15Å
511C97.7Very high95.5Very high39 Ų3946.6 Ų46.626%0.26428%0.275SS..Hα-helixtrans-58.3-49.9178.5-1720000111.8C500 N507 R508 R509 S513 S514 L515C500-C511 WeakPolarHBondContact CA-SG 3.15Å; C500-C511 HydrophobicContact CB-CB 3.72Å; C500-C511 WeakPolarHBondContact CB-SG 3.45Å; C500-C511 WeakPolarHBondContact SG-CB 3.33Å; C500-C511 CovalentContact SG-SG 2.04Å; C500-C511 PolarHBondContact SG-SG 2.94Å; N507-C511 WeakPolarHBondContact O-CB 3.46Å; N507-C511 PolarHBondContact O-N 2.96Å; R508-C511 WeakPolarHBondContact O-CB 3.49Å; R508-C511 PolarHBondContact O-N 3.29Å; R509-C511 VanDerWaalsContact C-N 3.32Å; R509-C511 PolarHBondContact O-N 3.4Å; C511-S513 VanDerWaalsContact C-N 3.27Å; C511-S513 PolarHBondContact O-N 2.61Å; C511-S514 PolarHBondContact O-N 3.31Å; C511-S514 VanDerWaalsContact O-N 3.1Å; C511-L515 PolarHBondContact O-N 3.06Å; C511-L515 VanDerWaalsContact O-N 3.12Å
512F97.3Very high95.3Very high3 Ų352 Ų521%0.01331%0.307CS..Hα-helixtrans-61.7-34.8175.4-87.4-89.8000113K438 I481 L484 V497 C500 R508 R509 P510 S514 L515K438-F512 PolarHBondContact NZ-O 3.33Å; I481-F512 HydrophobicContact CD1-CB 4.04Å; I481-F512 HydrophobicContact CD1-CD2 4.48Å; I481-F512 HydrophobicContact CD1-CG 4.3Å; I481-F512 HydrophobicContact CG2-CD1 4.39Å; I481-F512 HydrophobicContact CG2-CD2 3.29Å; I481-F512 HydrophobicContact CG2-CE1 4.37Å; I481-F512 HydrophobicContact CG2-CE2 3.26Å; I481-F512 HydrophobicContact CG2-CG 3.88Å; I481-F512 HydrophobicContact CG2-CZ 3.83Å; L484-F512 HydrophobicContact CD2-CD1 4.37Å; L484-F512 HydrophobicContact CD2-CE1 3.57Å; L484-F512 HydrophobicContact CD2-CZ 4.2Å; L484-F512 HydrophobicContact CG-CE1 4.43Å; V497-F512 HydrophobicContact CG1-CE1 4.21Å; V497-F512 HydrophobicContact CG1-CZ 4.02Å; V497-F512 HydrophobicContact CG2-CE1 4.21Å; C500-F512 HydrophobicContact CB-CD2 3.54Å; C500-F512 HydrophobicContact CB-CE2 3.41Å; C500-F512 VanDerWaalsContact CB-CE2 3.41Å; C500-F512 HydrophobicContact CB-CG 4.31Å; C500-F512 HydrophobicContact CB-CZ 4.09Å; R508-F512 HydrophobicContact CG-CD2 4.03Å; R508-F512 HydrophobicContact CG-CE2 3.98Å; R508-F512 WeakPolarHBondContact O-CD2 3.43Å; R508-F512 PolarHBondContact O-N 3.47Å; R509-F512 PolarHBondContact O-N 2.96Å; P510-F512 PolarHBondContact O-N 3.5Å; F512-S514 VanDerWaalsContact C-N 3.27Å; F512-S514 PolarHBondContact O-N 3.24Å; F512-L515 HydrophobicContact CD1-CD1 3.77Å; F512-L515 HydrophobicContact CE1-CD1 4.18Å; F512-L515 HydrophobicContact CG-CD1 4.29Å; F512-L515 PolarHBondContact O-N 3.14Å
513S94.1Very high95.2Very high56 Ų5649.8 Ų49.839%0.39230%0.295SS..Hα-helixtrans-62.3-38.9175.9-54.40000111K438 R509 P510 C511K438-S513 PolarHBondContact NZ-O 2.9Å; R509-S513 PolarHBondContact O-N 3.09Å; R509-S513 PolarHBondContact O-OG 3.46Å; P510-S513 VanDerWaalsContact O-CB 3.31Å; P510-S513 WeakPolarHBondContact O-CB 3.46Å; P510-S513 PolarHBondContact O-N 3.35Å; P510-S513 VanDerWaalsContact O-N 3.11Å; C511-S513 VanDerWaalsContact C-N 3.27Å; C511-S513 PolarHBondContact O-N 2.61Å
514S95.7Very high94.8Very high94 Ų9448.7 Ų48.766%0.65729%0.285SS*.Hα-helixtrans-82.6-10.8-179.1-58.20000115.2P510 C511 F512 V516P510-S514 PolarHBondContact O-N 2.68Å; P510-S514 PolarHBondContact O-OG 3.15Å; C511-S514 PolarHBondContact O-N 3.31Å; C511-S514 VanDerWaalsContact O-N 3.1Å; F512-S514 VanDerWaalsContact C-N 3.27Å; F512-S514 PolarHBondContact O-N 3.24Å; S514-V516 PolarHBondContact O-N 3.3Å
515L96.2Very high94.6Very high34 Ų3452 Ų5218%0.17831%0.314CS..  trans-56.5135.5173.6-70.9176000110.5K438 V497 C511 F512K438-L515 HydrophobicContact CB-CB 4.2Å; K438-L515 HydrophobicContact CD-CB 4.13Å; K438-L515 HydrophobicContact CG-CB 3.77Å; K438-L515 PolarHBondContact NZ-O 2.61Å; V497-L515 HydrophobicContact CG2-CD1 4.37Å; C511-L515 PolarHBondContact O-N 3.06Å; C511-L515 VanDerWaalsContact O-N 3.12Å; F512-L515 HydrophobicContact CD1-CD1 3.77Å; F512-L515 HydrophobicContact CE1-CD1 4.18Å; F512-L515 HydrophobicContact CG-CD1 4.29Å; F512-L515 PolarHBondContact O-N 3.14Å
516V93.2Very high94.2Very high113 Ų11353.3 Ų53.369%0.68532%0.32SS*.  trans-106.2-158.9175.6-64.30000109.6K438 S514K438-V516 WeakPolarHBondContact CA-O 3.24Å; S514-V516 PolarHBondContact O-N 3.3Å
517V95.3Very high93.8Very high21 Ų2154.6 Ų54.613%0.12733%0.329CS..  trans-60.3136.5172.5-179.40000109.5K437 E519 P561K437-V517 HydrophobicContact CB-CG2 4.07Å; K437-V517 HydrophobicContact CD-CG2 4.11Å; K437-V517 HydrophobicContact CG-CG2 4.23Å; K437-V517 WeakPolarHBondContact O-CA 3.45Å; V517-E519 PolarHBondContact O-N 2.77Å; V517-P561 HydrophobicContact CG1-CB 3.63Å
518D95.3Very high93.3Very high20 Ų2055 Ų5511%0.10733%0.331CS..  trans-75.3100171.7-176.51.1000110.8K437 P440 Q441 N494 T520 Y521K437-D518 PolarHBondContact O-N 3.23Å; P440-D518 HydrophobicContact CG-CB 4.2Å; Q441-D518 PolarHBondContact NE2-OD2 3.14Å; Q441-D518 PolarHBondContact OE1-OD2 3.44Å; N494-D518 WeakPolarHBondContact CB-OD2 3.47Å; N494-D518 PolarHBondContact ND2-OD2 2.76Å; D518-T520 PolarHBondContact O-N 3.12Å; D518-T520 WeakPolarHBondContact OD1-CB 3.29Å; D518-T520 PolarHBondContact OD1-N 3.18Å; D518-T520 PolarHBondContact OD1-OG1 2.84Å; D518-T520 PolarHBondContact OD2-OG1 2.77Å; D518-Y521 WeakPolarHBondContact O-CB 3.33Å; D518-Y521 PolarHBondContact O-N 2.68Å; D518-Y521 VanDerWaalsContact O-N 3.16Å
519E91.9Very high92.7Very high144 Ų14460.5 Ų60.567%0.67336%0.361SS*.THydrogen-bonded Turntrans-67.2-12.4179-58.1-61.1158.300113.4V517 Y521 Q562V517-E519 PolarHBondContact O-N 2.77Å; E519-Y521 VanDerWaalsContact C-N 3.33Å; E519-Q562 PolarHBondContact OE1-NE2 3.44Å
520T93.3Very high92Very high91 Ų9163.7 Ų63.756%0.55838%0.375SS*.THydrogen-bonded Turntrans-84.6-11.1175.872.30000112.8D518D518-T520 PolarHBondContact O-N 3.12Å; D518-T520 WeakPolarHBondContact OD1-CB 3.29Å; D518-T520 PolarHBondContact OD1-N 3.18Å; D518-T520 PolarHBondContact OD1-OG1 2.84Å; D518-T520 PolarHBondContact OD2-OG1 2.77Å
521Y95.8Very high91.3Very high40 Ų4062.7 Ų62.716%0.15737%0.369CS..  trans-77.2128-179.5177.9-103.2000111.6P440 Q441 D518 E519 P523 P524 K558 P561P440-Y521 HydrophobicContact CB-CD1 3.85Å; P440-Y521 HydrophobicContact CB-CD2 3.66Å; P440-Y521 HydrophobicContact CB-CE1 3.9Å; P440-Y521 HydrophobicContact CB-CE2 3.74Å; P440-Y521 HydrophobicContact CB-CG 3.71Å; P440-Y521 VanDerWaalsContact CG-CB 3.45Å; P440-Y521 HydrophobicContact CG-CD1 3.74Å; P440-Y521 HydrophobicContact CG-CD2 3.44Å; P440-Y521 VanDerWaalsContact CG-CD2 3.44Å; P440-Y521 HydrophobicContact CG-CE1 4.31Å; P440-Y521 HydrophobicContact CG-CE2 4.07Å; P440-Y521 HydrophobicContact CG-CG 3.23Å; Q441-Y521 HydrophobicContact CG-CD2 4.44Å; D518-Y521 WeakPolarHBondContact O-CB 3.33Å; D518-Y521 PolarHBondContact O-N 2.68Å; D518-Y521 VanDerWaalsContact O-N 3.16Å; E519-Y521 VanDerWaalsContact C-N 3.33Å; Y521-P523 HydrophobicContact CD1-CG 4.27Å; Y521-P523 HydrophobicContact CE1-CB 4.25Å; Y521-P523 HydrophobicContact CE1-CG 4.02Å; Y521-P524 VanDerWaalsContact OH-CD 3.3Å; Y521-P524 WeakPolarHBondContact OH-CD 3.13Å; Y521-K558 VanDerWaalsContact CE1-O 3.29Å; Y521-K558 WeakPolarHBondContact CE1-O 3.17Å; Y521-P561 HydrophobicContact CD1-CG 3.68Å; Y521-P561 HydrophobicContact CE1-CG 3.97Å
522V94.4Very high90.6Very high121 Ų12164 Ų6473%0.73337%0.372SS*.  trans-103.5114.3173.3-177.50000108.4
523P92.9Very high89.9Confident49 Ų4964.9 Ų64.932%0.31838%0.376SS..PPolyproline II helixtrans-56.7138.8174.8-26.535.8000111.3Y521 K558 Q559 P561Y521-P523 HydrophobicContact CD1-CG 4.27Å; Y521-P523 HydrophobicContact CE1-CB 4.25Å; Y521-P523 HydrophobicContact CE1-CG 4.02Å; P523-K558 WeakPolarHBondContact CB-O 3.4Å; P523-Q559 WeakPolarHBondContact CB-O 3.41Å; P523-P561 HydrophobicContact CG-CG 4.22Å
524P87.5Confident89.6Confident53 Ų5366.6 Ų66.634%0.34438%0.378SS..PPolyproline II helixtrans-64.3164.1172.829.4-35.5000110.9Y521 F526 Q559Y521-P524 VanDerWaalsContact OH-CD 3.3Å; Y521-P524 WeakPolarHBondContact OH-CD 3.13Å; P524-F526 PolarHBondContact O-N 2.57Å; P524-Q559 PolarHBondContact O-NE2 2.91Å
525A89.3Confident89.1Confident90 Ų9067 Ų6774%0.74437%0.368SS*.PPolyproline II helixtrans-54.4140.5169.200000110.4S527A525-S527 PolarHBondContact O-N 3.06Å
526F88.5Confident88.5Confident40 Ų4068.7 Ų68.718%0.17538%0.377CS..PPolyproline II helixtrans-58.7131.7176.7-169.3-92.5000109.6P524 D528 F531 Q559 I600 R604 L607 V609P524-F526 PolarHBondContact O-N 2.57Å; F526-D528 VanDerWaalsContact CD1-OD1 3.31Å; F526-D528 WeakPolarHBondContact CD1-OD1 3.45Å; F526-D528 WeakPolarHBondContact CE1-OD1 3.38Å; F526-F531 HydrophobicContact CD2-CE2 4.02Å; F526-F531 HydrophobicContact CE1-CD2 4.01Å; F526-F531 HydrophobicContact CE1-CE2 4.3Å; F526-F531 AromaticContact CE2-CD2 3.7Å; F526-F531 HydrophobicContact CE2-CD2 3.7Å; F526-F531 AromaticContact CE2-CE2 3.24Å; F526-F531 HydrophobicContact CE2-CE2 3.24Å; F526-F531 AromaticContact CE2-CZ 3.99Å; F526-F531 HydrophobicContact CE2-CZ 3.99Å; F526-F531 AromaticContact CZ-CD2 3.32Å; F526-F531 HydrophobicContact CZ-CD2 3.32Å; F526-F531 AromaticContact CZ-CE2 3.42Å; F526-F531 HydrophobicContact CZ-CE2 3.42Å; F526-F531 VanDerWaalsContact CZ-CE2 3.42Å; F526-F531 HydrophobicContact CZ-CG 4.25Å; F526-F531 HydrophobicContact CZ-CZ 4.41Å; F526-Q559 HydrophobicContact CD2-CG 3.78Å; F526-Q559 HydrophobicContact CE2-CG 4.31Å; F526-I600 HydrophobicContact CE1-CG2 4.01Å; F526-I600 HydrophobicContact CZ-CG2 4.3Å; F526-R604 HydrophobicContact CD1-CG 3.99Å; F526-R604 HydrophobicContact CD2-CG 4.41Å; F526-R604 HydrophobicContact CE1-CG 3.49Å; F526-R604 VanDerWaalsContact CE1-CG 3.49Å; F526-R604 HydrophobicContact CE2-CG 3.98Å; F526-R604 HydrophobicContact CG-CG 4.42Å; F526-R604 HydrophobicContact CZ-CG 3.49Å; F526-R604 VanDerWaalsContact CZ-CG 3.49Å; F526-L607 HydrophobicContact CD2-CD1 4.28Å; F526-L607 HydrophobicContact CE2-CD1 3.69Å; F526-V609 HydrophobicContact CB-CG2 4.16Å; F526-V609 HydrophobicContact CD2-CG2 3.57Å; F526-V609 HydrophobicContact CE2-CG2 4.2Å; F526-V609 HydrophobicContact CG-CG2 3.99Å
527S87.4Confident88Confident36 Ų3663.8 Ų63.825%0.25235%0.347SS..  trans-125.8112.7178.3165.60000107.7A525 D529 K530 F531A525-S527 PolarHBondContact O-N 3.06Å; S527-D529 PolarHBondContact O-N 2.8Å; S527-K530 PolarHBondContact O-N 3.41Å; S527-K530 VanDerWaalsContact O-N 3.15Å; S527-F531 WeakPolarHBondContact O-CD2 3.42Å
528D84.9Confident87.5Confident57 Ų5764.3 Ų64.331%0.30535%0.351SS..G310 helixtrans-54.2-37177.3-67.80.8000110.5F526 K530 F531 I532 I600F526-D528 VanDerWaalsContact CD1-OD1 3.31Å; F526-D528 WeakPolarHBondContact CD1-OD1 3.45Å; F526-D528 WeakPolarHBondContact CE1-OD1 3.38Å; D528-K530 PolarHBondContact O-N 3.44Å; D528-F531 CarbonylContact O-C 3.38Å; D528-F531 WeakPolarHBondContact O-CA 3.34Å; D528-F531 WeakPolarHBondContact O-CB 3.46Å; D528-F531 PolarHBondContact O-N 3.24Å; D528-I532 WeakPolarHBondContact O-CG1 3.3Å; D528-I532 PolarHBondContact O-N 3.05Å; D528-I532 VanDerWaalsContact O-N 3.11Å; D528-I600 HydrophobicContact CB-CD1 4.32Å
529D84.3Confident86.9Confident123 Ų12370 Ų7066%0.65838%0.377SS*.G310 helixtrans-54-30179.7-57.5-32.2000114S527 F531S527-D529 PolarHBondContact O-N 2.8Å; D529-F531 PolarHBondContact O-N 2.99Å
530K81.8Confident86.4Confident91 Ų9163.8 Ų63.840%0.39635%0.35SS..G310 helixtrans-73.6-7.1176.7-66.4-173.7178.4178.50113.8S527 D528S527-K530 PolarHBondContact O-N 3.41Å; S527-K530 VanDerWaalsContact O-N 3.15Å; D528-K530 PolarHBondContact O-N 3.44Å
531F80.4Confident85.8Confident2 Ų267 Ų671%0.00936%0.359CS..G310 helixtrans-131.18.4-174.2-56.2-68.9000112F526 S527 D528 D529 F533 F552 N555 L556 I600 T603F526-F531 HydrophobicContact CD2-CE2 4.02Å; F526-F531 HydrophobicContact CE1-CD2 4.01Å; F526-F531 HydrophobicContact CE1-CE2 4.3Å; F526-F531 AromaticContact CE2-CD2 3.7Å; F526-F531 HydrophobicContact CE2-CD2 3.7Å; F526-F531 AromaticContact CE2-CE2 3.24Å; F526-F531 HydrophobicContact CE2-CE2 3.24Å; F526-F531 AromaticContact CE2-CZ 3.99Å; F526-F531 HydrophobicContact CE2-CZ 3.99Å; F526-F531 AromaticContact CZ-CD2 3.32Å; F526-F531 HydrophobicContact CZ-CD2 3.32Å; F526-F531 AromaticContact CZ-CE2 3.42Å; F526-F531 HydrophobicContact CZ-CE2 3.42Å; F526-F531 VanDerWaalsContact CZ-CE2 3.42Å; F526-F531 HydrophobicContact CZ-CG 4.25Å; F526-F531 HydrophobicContact CZ-CZ 4.41Å; S527-F531 WeakPolarHBondContact O-CD2 3.42Å; D528-F531 CarbonylContact O-C 3.38Å; D528-F531 WeakPolarHBondContact O-CA 3.34Å; D528-F531 WeakPolarHBondContact O-CB 3.46Å; D528-F531 PolarHBondContact O-N 3.24Å; D529-F531 PolarHBondContact O-N 2.99Å; F531-F533 VanDerWaalsContact O-CD2 3.25Å; F531-F533 WeakPolarHBondContact O-CD2 3.19Å; F531-F533 WeakPolarHBondContact O-CE2 3.42Å; F531-F552 AromaticContact CD1-CD2 3.67Å; F531-F552 HydrophobicContact CD1-CD2 3.67Å; F531-F552 AromaticContact CD1-CE2 3.49Å; F531-F552 HydrophobicContact CD1-CE2 3.49Å; F531-F552 VanDerWaalsContact CD1-CE2 3.49Å; F531-F552 AromaticContact CE1-CD2 3.93Å; F531-F552 HydrophobicContact CE1-CD2 3.93Å; F531-F552 AromaticContact CE1-CE2 3.84Å; F531-F552 HydrophobicContact CE1-CE2 3.84Å; F531-N555 HydrophobicContact CE1-CB 4.14Å; F531-N555 HydrophobicContact CZ-CB 4.21Å; F531-L556 HydrophobicContact CE1-CD2 3.73Å; F531-L556 HydrophobicContact CE1-CG 4.26Å; F531-L556 HydrophobicContact CZ-CD2 4.28Å; F531-I600 HydrophobicContact CB-CD1 4.42Å; F531-I600 HydrophobicContact CB-CG1 3.83Å; F531-T603 HydrophobicContact CD1-CG2 4.39Å; F531-T603 HydrophobicContact CE1-CG2 4.23Å; F531-T603 HydrophobicContact CZ-CG2 4.48Å
532I82.9Confident85.3Confident66 Ų6667.5 Ų67.534%0.33838%0.377SS..  trans-83.2134.1168.2-65.3174.8000108.2D528 I600D528-I532 WeakPolarHBondContact O-CG1 3.3Å; D528-I532 PolarHBondContact O-N 3.05Å; D528-I532 VanDerWaalsContact O-N 3.11Å; I532-I600 HydrophobicContact CG1-CD1 4.07Å
533F83.4Confident84.9Confident21 Ų2166.5 Ų66.59%0.09237%0.37CS..  trans-125.4142.6-176.2-63.1-60.8000108.6F531 L537 F552 F575 L578 F592 L599F531-F533 VanDerWaalsContact O-CD2 3.25Å; F531-F533 WeakPolarHBondContact O-CD2 3.19Å; F531-F533 WeakPolarHBondContact O-CE2 3.42Å; F533-L537 HydrophobicContact CB-CD1 3.45Å; F533-L537 VanDerWaalsContact CB-CD1 3.45Å; F533-L537 HydrophobicContact CD1-CD1 3.44Å; F533-L537 VanDerWaalsContact CD1-CD1 3.44Å; F533-L537 HydrophobicContact CG-CD1 3.82Å; F533-F552 HydrophobicContact CE1-CD2 4.44Å; F533-F552 HydrophobicContact CE2-CE2 4.38Å; F533-F552 AromaticContact CZ-CD2 3.61Å; F533-F552 HydrophobicContact CZ-CD2 3.61Å; F533-F552 AromaticContact CZ-CE2 3.89Å; F533-F552 HydrophobicContact CZ-CE2 3.89Å; F533-F552 HydrophobicContact CZ-CG 4.15Å; F533-F575 AromaticContact CD1-CE2 3.83Å; F533-F575 HydrophobicContact CD1-CE2 3.83Å; F533-F575 HydrophobicContact CD2-CD2 4.2Å; F533-F575 AromaticContact CD2-CE2 3.91Å; F533-F575 HydrophobicContact CD2-CE2 3.91Å; F533-F575 HydrophobicContact CE1-CD2 4.26Å; F533-F575 AromaticContact CE1-CE2 3.48Å; F533-F575 HydrophobicContact CE1-CE2 3.48Å; F533-F575 VanDerWaalsContact CE1-CE2 3.48Å; F533-F575 HydrophobicContact CE1-CZ 4.2Å; F533-F575 AromaticContact CE2-CD2 3.65Å; F533-F575 HydrophobicContact CE2-CD2 3.65Å; F533-F575 AromaticContact CE2-CE2 3.6Å; F533-F575 HydrophobicContact CE2-CE2 3.6Å; F533-F575 HydrophobicContact CG-CE2 4.02Å; F533-F575 AromaticContact CZ-CD2 3.66Å; F533-F575 HydrophobicContact CZ-CD2 3.66Å; F533-F575 AromaticContact CZ-CE2 3.35Å; F533-F575 HydrophobicContact CZ-CE2 3.35Å; F533-F575 HydrophobicContact CZ-CZ 4.38Å; F533-L578 HydrophobicContact CD2-CD2 3.86Å; F533-F592 HydrophobicContact CB-CD1 3.82Å; F533-F592 HydrophobicContact CB-CE1 4.1Å; F533-F592 WeakPolarHBondContact O-CB 3.47Å; F533-L599 HydrophobicContact CD2-CD2 4.09Å; F533-L599 HydrophobicContact CE2-CD2 3.62Å
534H86.4Confident84.5Confident93 Ų9366.6 Ų66.643%0.43138%0.376SS..  trans-120.3172.9-179.6-62.2-76.3000111.1D536 L537 E589H534-D536 VanDerWaalsContact C-OD1 3.24Å; H534-D536 VanDerWaalsContact CB-OD1 3.23Å; H534-D536 WeakPolarHBondContact CB-OD1 3.49Å; H534-D536 PolarHBondContact O-N 2.83Å; H534-D536 VanDerWaalsContact O-OD1 3.12Å; H534-L537 PolarHBondContact O-N 3.17Å; H534-E589 IonicContact CE1-OE1 3.83Å; H534-E589 IonicContact CG-OE1 3.6Å; H534-E589 IonicContact ND1-OE1 2.76Å; H534-E589 PolarHBondContact ND1-OE1 2.98Å
535K85.1Confident84.4Confident102 Ų10266 Ų6644%0.44337%0.369SS..THydrogen-bonded Turntrans-60.5-16.7179.972-172.4177.3-175.90114.7L537 C538 Q588 E589K535-L537 PolarHBondContact O-N 3Å; K535-C538 WeakPolarHBondContact O-CB 3.17Å; K535-C538 PolarHBondContact O-N 3.23Å; K535-Q588 HydrophobicContact CB-CB 3.82Å; K535-E589 VanDerWaalsContact CB-OE2 3.28Å; K535-E589 WeakPolarHBondContact CB-OE2 3.43Å; K535-E589 WeakPolarHBondContact CD-OE2 3.5Å; K535-E589 WeakPolarHBondContact CG-OE2 3.17Å; K535-E589 PolarHBondContact N-OE2 2.9Å
536D84.4Confident84.4Confident70 Ų7065.2 Ų65.237%0.37435%0.35SS..Hα-helixtrans-61.1-28.4176.167.1-39.2000112.2H534 C538 Q539 A540H534-D536 VanDerWaalsContact C-OD1 3.24Å; H534-D536 VanDerWaalsContact CB-OD1 3.23Å; H534-D536 WeakPolarHBondContact CB-OD1 3.49Å; H534-D536 PolarHBondContact O-N 2.83Å; H534-D536 VanDerWaalsContact O-OD1 3.12Å; D536-C538 PolarHBondContact O-N 3.14Å; D536-Q539 CarbonylContact O-C 3.59Å; D536-Q539 PolarHBondContact O-N 3.33Å; D536-A540 PolarHBondContact O-N 2.96Å
537L82.7Confident84.5Confident10 Ų1065.2 Ų65.25%0.05235%0.353CS..Hα-helixtrans-60-28.7171.1-83.4138000113.7F533 H534 K535 Q539 L545 M548 F575 L579 F592F533-L537 HydrophobicContact CB-CD1 3.45Å; F533-L537 VanDerWaalsContact CB-CD1 3.45Å; F533-L537 HydrophobicContact CD1-CD1 3.44Å; F533-L537 VanDerWaalsContact CD1-CD1 3.44Å; F533-L537 HydrophobicContact CG-CD1 3.82Å; H534-L537 PolarHBondContact O-N 3.17Å; K535-L537 PolarHBondContact O-N 3Å; L537-Q539 VanDerWaalsContact C-N 3.34Å; L537-L545 HydrophobicContact CD2-CD1 4.14Å; L537-M548 HydrophobicContact CD2-CB 4.08Å; L537-M548 HydrophobicContact CD2-SD 3.75Å; L537-M548 HydrophobicContact CG-SD 3.93Å; L537-F575 HydrophobicContact CD2-CZ 4.25Å; L537-L579 HydrophobicContact CB-CD2 4.01Å; L537-L579 HydrophobicContact CD2-CD2 4.35Å; L537-F592 HydrophobicContact CB-CZ 4.49Å
538C84.5Confident84.5Confident31 Ų3166.5 Ų66.521%0.20936%0.356CS..Hα-helixtrans-78.7-21.6175.8-56.70000112.8K535 D536 C583 F592K535-C538 WeakPolarHBondContact O-CB 3.17Å; K535-C538 PolarHBondContact O-N 3.23Å; D536-C538 PolarHBondContact O-N 3.14Å; C538-C583 WeakPolarHBondContact CA-SG 3.28Å; C538-C583 HydrophobicContact CB-CB 3.65Å; C538-C583 WeakPolarHBondContact CB-SG 3.45Å; C538-C583 WeakPolarHBondContact SG-CA 3.39Å; C538-C583 WeakPolarHBondContact SG-CB 3.34Å; C538-C583 CovalentContact SG-SG 2.04Å; C538-C583 PolarHBondContact SG-SG 2.86Å; C538-F592 WeakPolarHBondContact SG-CE2 3.22Å
539Q83.1Confident84.7Confident139 Ų13966.9 Ų66.965%0.6536%0.355SS*.Hα-helixtrans-91.7-25.7177.7-59.2-178.2-200111.5D536 L537 Q541D536-Q539 CarbonylContact O-C 3.59Å; D536-Q539 PolarHBondContact O-N 3.33Å; L537-Q539 VanDerWaalsContact C-N 3.34Å; Q539-Q541 PolarHBondContact O-N 3.08Å
540A82.1Confident85.1Confident14 Ų1461.1 Ų61.112%0.11632%0.324CS..  trans-64130.6175.900000111D536 A544 L545 M548D536-A540 PolarHBondContact O-N 2.96Å; A540-A544 HydrophobicContact CB-CB 4.34Å; A540-L545 HydrophobicContact CB-CB 3.97Å; A540-L545 HydrophobicContact CB-CD1 4.43Å; A540-M548 HydrophobicContact CB-CE 4.46Å; A540-M548 HydrophobicContact CB-SD 4.07Å
541Q80Confident85.6Confident159 Ų15960.9 Ų60.974%0.74333%0.325SS*.  trans-131.7162.7175.8-64.1-173.64.900110.8Q539 V543 A544Q539-Q541 PolarHBondContact O-N 3.08Å; Q541-V543 PolarHBondContact O-N 2.74Å; Q541-A544 PolarHBondContact O-N 3.28Å
542G85.7Confident86.1Confident51 Ų5161.1 Ų61.153%0.52633%0.326SS..Hα-helixtrans52.8-124.5176.700000112.8A544 L545 Q546G542-A544 PolarHBondContact O-N 3.06Å; G542-L545 PolarHBondContact O-N 3.28Å; G542-Q546 WeakPolarHBondContact O-CB 3.44Å; G542-Q546 VanDerWaalsContact O-CG 3.3Å; G542-Q546 WeakPolarHBondContact O-CG 3.27Å; G542-Q546 PolarHBondContact O-N 3.1Å; G542-Q546 VanDerWaalsContact O-N 3.09Å
543V85.1Confident86.6Confident99 Ų9958.4 Ų58.460%0.631%0.312SS*.Hα-helixtrans-64.1-36.1-173.6179.10000113Q541 Q546 T547Q541-V543 PolarHBondContact O-N 2.74Å; V543-Q546 PolarHBondContact O-N 3.34Å; V543-T547 WeakPolarHBondContact O-CB 3.26Å; V543-T547 PolarHBondContact O-N 3.32Å; V543-T547 PolarHBondContact O-OG1 2.86Å
544A85.9Confident87.2Confident52 Ų5257.4 Ų57.443%0.4331%0.307SS..Hα-helixtrans-64.7-49.3-178.600000111A540 Q541 G542 Q546 T547 M548A540-A544 HydrophobicContact CB-CB 4.34Å; Q541-A544 PolarHBondContact O-N 3.28Å; G542-A544 PolarHBondContact O-N 3.06Å; A544-Q546 PolarHBondContact O-N 3.41Å; A544-T547 WeakPolarHBondContact O-CB 3Å; A544-T547 PolarHBondContact O-N 3.46Å; A544-M548 PolarHBondContact O-N 3.14Å; A544-M548 VanDerWaalsContact O-N 3.11Å
545L85.5Confident87.5Confident39 Ų3954 Ų5420%0.20429%0.292CS..Hα-helixtrans-63.4-41.7176.7-179.960.8000111.9L537 A540 G542 T547 M548 K549L537-L545 HydrophobicContact CD2-CD1 4.14Å; A540-L545 HydrophobicContact CB-CB 3.97Å; A540-L545 HydrophobicContact CB-CD1 4.43Å; G542-L545 PolarHBondContact O-N 3.28Å; L545-T547 VanDerWaalsContact C-N 3.29Å; L545-T547 PolarHBondContact O-N 2.91Å; L545-M548 PolarHBondContact O-N 2.94Å; L545-K549 HydrophobicContact CG-CD 4.45Å; L545-K549 WeakPolarHBondContact O-CG 3.48Å; L545-K549 PolarHBondContact O-N 3.38Å
546Q89.1Confident87.9Confident75 Ų7549.1 Ų49.135%0.3527%0.271SS..Hα-helixtrans-59.4-40.6175.9-77.7-179.6-2.300112.2Y425 G542 V543 A544 K549 Q550Y425-Q546 HydrophobicContact CD2-CB 4.1Å; Y425-Q546 HydrophobicContact CD2-CG 3.74Å; Y425-Q546 HydrophobicContact CE2-CB 3.5Å; Y425-Q546 VanDerWaalsContact CE2-CB 3.5Å; Y425-Q546 HydrophobicContact CE2-CG 3.42Å; Y425-Q546 VanDerWaalsContact CE2-CG 3.42Å; Y425-Q546 HydrophobicContact CG-CG 4.46Å; G542-Q546 WeakPolarHBondContact O-CB 3.44Å; G542-Q546 VanDerWaalsContact O-CG 3.3Å; G542-Q546 WeakPolarHBondContact O-CG 3.27Å; G542-Q546 PolarHBondContact O-N 3.1Å; G542-Q546 VanDerWaalsContact O-N 3.09Å; V543-Q546 PolarHBondContact O-N 3.34Å; A544-Q546 PolarHBondContact O-N 3.41Å; Q546-K549 PolarHBondContact O-N 3.33Å; Q546-Q550 WeakPolarHBondContact O-CB 3.15Å; Q546-Q550 VanDerWaalsContact O-CG 3.27Å; Q546-Q550 WeakPolarHBondContact O-CG 3.49Å; Q546-Q550 PolarHBondContact O-N 2.96Å
547T89.4Confident88.4Confident40 Ų4045.9 Ų45.925%0.24525%0.254CS..Hα-helixtrans-64.7-47.4178.5-59.30000111M448 V543 A544 L545 K549 Q550 E551M448-T547 HydrophobicContact CE-CG2 4.02Å; M448-T547 HydrophobicContact SD-CG2 3.89Å; V543-T547 WeakPolarHBondContact O-CB 3.26Å; V543-T547 PolarHBondContact O-N 3.32Å; V543-T547 PolarHBondContact O-OG1 2.86Å; A544-T547 WeakPolarHBondContact O-CB 3Å; A544-T547 PolarHBondContact O-N 3.46Å; L545-T547 VanDerWaalsContact C-N 3.29Å; L545-T547 PolarHBondContact O-N 2.91Å; T547-K549 VanDerWaalsContact C-N 3.33Å; T547-K549 PolarHBondContact O-N 3.47Å; T547-Q550 PolarHBondContact O-N 3.23Å; T547-Q550 VanDerWaalsContact O-N 3.17Å; T547-E551 PolarHBondContact O-N 3.3Å
548M87.6Confident89Confident62 Ų6246.9 Ų46.931%0.30526%0.258SS..Hα-helixtrans-59.4-43176.9-67.6171.9172.700112L537 A540 A544 L545 Q550 E551 F552L537-M548 HydrophobicContact CD2-CB 4.08Å; L537-M548 HydrophobicContact CD2-SD 3.75Å; L537-M548 HydrophobicContact CG-SD 3.93Å; A540-M548 HydrophobicContact CB-CE 4.46Å; A540-M548 HydrophobicContact CB-SD 4.07Å; A544-M548 PolarHBondContact O-N 3.14Å; A544-M548 VanDerWaalsContact O-N 3.11Å; L545-M548 PolarHBondContact O-N 2.94Å; M548-Q550 VanDerWaalsContact C-N 3.35Å; M548-Q550 PolarHBondContact O-N 3Å; M548-E551 PolarHBondContact O-N 3.46Å; M548-F552 PolarHBondContact O-N 2.7Å
549K88.9Confident89.4Confident66 Ų6646.2 Ų46.229%0.28725%0.251SS..Hα-helixtrans-61.3-41.5175.4-74.5-178177.7-172.20112.7Y425 L545 Q546 T547 L553 F575Y425-K549 WeakPolarHBondContact OH-CB 3.41Å; L545-K549 HydrophobicContact CG-CD 4.45Å; L545-K549 WeakPolarHBondContact O-CG 3.48Å; L545-K549 PolarHBondContact O-N 3.38Å; Q546-K549 PolarHBondContact O-N 3.33Å; T547-K549 VanDerWaalsContact C-N 3.33Å; T547-K549 PolarHBondContact O-N 3.47Å; K549-L553 WeakPolarHBondContact O-CB 3.48Å; K549-L553 PolarHBondContact O-N 3.39Å; K549-F575 HydrophobicContact CG-CE1 3.92Å
550Q93.3Very high89.9Confident1 Ų141.8 Ų41.81%0.00523%0.23CC..Hα-helixtrans-69.7-35.5178.5-76177.3-17.600112Y425 Q428 N429 L432 M448 Q546 T547 M548 L553 I554Y425-Q550 HydrophobicContact CE2-CG 4.12Å; Y425-Q550 VanDerWaalsContact CE2-NE2 3.31Å; Q428-Q550 VanDerWaalsContact NE2-OE1 3.1Å; N429-Q550 VanDerWaalsContact OD1-CG 3.32Å; N429-Q550 WeakPolarHBondContact OD1-CG 3.29Å; N429-Q550 PolarHBondContact OD1-NE2 3.32Å; L432-Q550 HydrophobicContact CD1-CB 3.65Å; L432-Q550 HydrophobicContact CD1-CG 3.48Å; L432-Q550 VanDerWaalsContact CD1-CG 3.48Å; M448-Q550 HydrophobicContact CG-CB 4.28Å; M448-Q550 HydrophobicContact SD-CB 3.88Å; Q546-Q550 WeakPolarHBondContact O-CB 3.15Å; Q546-Q550 VanDerWaalsContact O-CG 3.27Å; Q546-Q550 WeakPolarHBondContact O-CG 3.49Å; Q546-Q550 PolarHBondContact O-N 2.96Å; T547-Q550 PolarHBondContact O-N 3.23Å; T547-Q550 VanDerWaalsContact O-N 3.17Å; M548-Q550 VanDerWaalsContact C-N 3.35Å; M548-Q550 PolarHBondContact O-N 3Å; Q550-L553 WeakPolarHBondContact O-CB 3.41Å; Q550-L553 PolarHBondContact O-N 3.11Å; Q550-I554 WeakPolarHBondContact O-CD1 3.47Å; Q550-I554 VanDerWaalsContact O-CG1 3.26Å; Q550-I554 WeakPolarHBondContact O-CG1 3.43Å; Q550-I554 PolarHBondContact O-N 3.22Å
551E92.3Very high90.4Very high87 Ų8741.9 Ų41.941%0.40723%0.229SC..Hα-helixtrans-66-43.5174.4-175.4159.9-153.300111.9T547 M548 L553 I554 N555T547-E551 PolarHBondContact O-N 3.3Å; M548-E551 PolarHBondContact O-N 3.46Å; E551-L553 VanDerWaalsContact C-N 3.34Å; E551-L553 PolarHBondContact O-N 2.79Å; E551-I554 PolarHBondContact O-N 3.3Å; E551-N555 WeakPolarHBondContact O-CB 3.49Å; E551-N555 VanDerWaalsContact O-CG 3.28Å; E551-N555 PolarHBondContact O-N 3.33Å; E551-N555 PolarHBondContact O-ND2 3.1Å
552F90.4Very high91Very high7 Ų739.2 Ų39.23%0.03122%0.217CC..Hα-helixtrans-56.6-47.4170.8173.3-115.8000111.7F531 F533 M548 I554 N555 L556 V571 F575F531-F552 AromaticContact CD1-CD2 3.67Å; F531-F552 HydrophobicContact CD1-CD2 3.67Å; F531-F552 AromaticContact CD1-CE2 3.49Å; F531-F552 HydrophobicContact CD1-CE2 3.49Å; F531-F552 VanDerWaalsContact CD1-CE2 3.49Å; F531-F552 AromaticContact CE1-CD2 3.93Å; F531-F552 HydrophobicContact CE1-CD2 3.93Å; F531-F552 AromaticContact CE1-CE2 3.84Å; F531-F552 HydrophobicContact CE1-CE2 3.84Å; F533-F552 HydrophobicContact CE1-CD2 4.44Å; F533-F552 HydrophobicContact CE2-CE2 4.38Å; F533-F552 AromaticContact CZ-CD2 3.61Å; F533-F552 HydrophobicContact CZ-CD2 3.61Å; F533-F552 AromaticContact CZ-CE2 3.89Å; F533-F552 HydrophobicContact CZ-CE2 3.89Å; F533-F552 HydrophobicContact CZ-CG 4.15Å; M548-F552 PolarHBondContact O-N 2.7Å; F552-I554 PolarHBondContact O-N 3.39Å; F552-N555 PolarHBondContact O-N 3.06Å; F552-N555 VanDerWaalsContact O-N 3.17Å; F552-L556 HydrophobicContact CD1-CD1 4.1Å; F552-L556 HydrophobicContact CD2-CG 4.42Å; F552-L556 HydrophobicContact CE1-CD1 3.65Å; F552-L556 HydrophobicContact CE1-CG 4.43Å; F552-L556 HydrophobicContact CE2-CD1 4.2Å; F552-L556 HydrophobicContact CE2-CD2 4.1Å; F552-L556 HydrophobicContact CE2-CG 4.14Å; F552-L556 HydrophobicContact CZ-CD1 3.73Å; F552-L556 HydrophobicContact CZ-CD2 4.19Å; F552-L556 HydrophobicContact CZ-CG 4.16Å; F552-L556 WeakPolarHBondContact O-CG 3.43Å; F552-L556 PolarHBondContact O-N 3.13Å; F552-V571 HydrophobicContact CE1-CG1 4.16Å; F552-V571 HydrophobicContact CZ-CG1 3.64Å; F552-F575 HydrophobicContact CD1-CB 4.5Å; F552-F575 HydrophobicContact CD1-CD1 4.33Å; F552-F575 HydrophobicContact CD1-CD2 4.42Å; F552-F575 HydrophobicContact CD1-CG 4.14Å; F552-F575 HydrophobicContact CE1-CB 3.7Å; F552-F575 HydrophobicContact CE1-CD1 4.33Å; F552-F575 HydrophobicContact CE1-CD2 4.2Å; F552-F575 AromaticContact CE1-CG 3.8Å; F552-F575 HydrophobicContact CE1-CG 3.8Å; F552-F575 HydrophobicContact CZ-CB 4.07Å; F552-F575 HydrophobicContact CZ-CD2 4.37Å; F552-F575 HydrophobicContact CZ-CG 4.3Å
553L94.3Very high91.3Very high9 Ų936.8 Ų36.85%0.04719%0.192CC..Hα-helixtrans-57-46.3176.3175.759.4000112.5N429 L432 V433 K549 Q550 E551 N555 L556 V557 L568 I572N429-L553 HydrophobicContact CB-CD2 3.81Å; L432-L553 HydrophobicContact CB-CD2 4.3Å; V433-L553 HydrophobicContact CG2-CD1 3.69Å; V433-L553 HydrophobicContact CG2-CD2 4.1Å; V433-L553 HydrophobicContact CG2-CG 4.1Å; K549-L553 WeakPolarHBondContact O-CB 3.48Å; K549-L553 PolarHBondContact O-N 3.39Å; Q550-L553 WeakPolarHBondContact O-CB 3.41Å; Q550-L553 PolarHBondContact O-N 3.11Å; E551-L553 VanDerWaalsContact C-N 3.34Å; E551-L553 PolarHBondContact O-N 2.79Å; L553-N555 VanDerWaalsContact C-N 3.34Å; L553-L556 PolarHBondContact O-N 2.97Å; L553-V557 HydrophobicContact CD1-CG2 4.49Å; L553-V557 WeakPolarHBondContact O-CG2 3.27Å; L553-V557 PolarHBondContact O-N 3.01Å; L553-L568 HydrophobicContact CD1-CD1 3.61Å; L553-L568 HydrophobicContact CD1-CD2 3.78Å; L553-L568 HydrophobicContact CD1-CG 4.12Å; L553-I572 HydrophobicContact CD1-CD1 4.22Å
554I95.1Very high91.6Very high0 Ų035 Ų350%018%0.181CC..Hα-helixtrans-61.3-44.8176.4-69.6158.1000110.5L432 T436 L447 M448 Q550 E551 F552 L556 V557 K558L432-I554 HydrophobicContact CD2-CD1 3.8Å; L432-I554 HydrophobicContact CD2-CG1 3.99Å; T436-I554 HydrophobicContact CG2-CG2 4.28Å; L447-I554 HydrophobicContact CB-CD1 4.21Å; L447-I554 HydrophobicContact CD1-CG2 3.9Å; M448-I554 HydrophobicContact CG-CD1 3.75Å; M448-I554 HydrophobicContact SD-CD1 4.49Å; Q550-I554 WeakPolarHBondContact O-CD1 3.47Å; Q550-I554 VanDerWaalsContact O-CG1 3.26Å; Q550-I554 WeakPolarHBondContact O-CG1 3.43Å; Q550-I554 PolarHBondContact O-N 3.22Å; E551-I554 PolarHBondContact O-N 3.3Å; F552-I554 PolarHBondContact O-N 3.39Å; I554-L556 VanDerWaalsContact C-N 3.34Å; I554-L556 PolarHBondContact O-N 3.03Å; I554-V557 PolarHBondContact O-N 2.94Å; I554-K558 HydrophobicContact CG2-CD 3.99Å; I554-K558 HydrophobicContact CG2-CG 4.24Å; I554-K558 WeakPolarHBondContact O-CB 3.45Å; I554-K558 WeakPolarHBondContact O-CG 3.42Å; I554-K558 PolarHBondContact O-N 2.9Å
555N93.1Very high91.7Very high21 Ų2139 Ų3911%0.11219%0.191CC..Hα-helixtrans-61.5-40.7-179.7-72.9-25.3000112F531 E551 F552 L553 K558 Q559F531-N555 HydrophobicContact CE1-CB 4.14Å; F531-N555 HydrophobicContact CZ-CB 4.21Å; E551-N555 WeakPolarHBondContact O-CB 3.49Å; E551-N555 VanDerWaalsContact O-CG 3.28Å; E551-N555 PolarHBondContact O-N 3.33Å; E551-N555 PolarHBondContact O-ND2 3.1Å; F552-N555 PolarHBondContact O-N 3.06Å; F552-N555 VanDerWaalsContact O-N 3.17Å; L553-N555 VanDerWaalsContact C-N 3.34Å; N555-K558 PolarHBondContact O-N 3.32Å; N555-Q559 WeakPolarHBondContact O-CB 3.33Å; N555-Q559 PolarHBondContact O-N 3.27Å
556L93.5Very high92Very high0 Ų043.5 Ų43.50%021%0.211CC..Hα-helixtrans-60.1-49.4174.6-68.5174.8000112F531 F552 L553 I554 K558 Q559 K560 L568 V571 T603 L607F531-L556 HydrophobicContact CE1-CD2 3.73Å; F531-L556 HydrophobicContact CE1-CG 4.26Å; F531-L556 HydrophobicContact CZ-CD2 4.28Å; F552-L556 HydrophobicContact CD1-CD1 4.1Å; F552-L556 HydrophobicContact CD2-CG 4.42Å; F552-L556 HydrophobicContact CE1-CD1 3.65Å; F552-L556 HydrophobicContact CE1-CG 4.43Å; F552-L556 HydrophobicContact CE2-CD1 4.2Å; F552-L556 HydrophobicContact CE2-CD2 4.1Å; F552-L556 HydrophobicContact CE2-CG 4.14Å; F552-L556 HydrophobicContact CZ-CD1 3.73Å; F552-L556 HydrophobicContact CZ-CD2 4.19Å; F552-L556 HydrophobicContact CZ-CG 4.16Å; F552-L556 WeakPolarHBondContact O-CG 3.43Å; F552-L556 PolarHBondContact O-N 3.13Å; L553-L556 PolarHBondContact O-N 2.97Å; I554-L556 VanDerWaalsContact C-N 3.34Å; I554-L556 PolarHBondContact O-N 3.03Å; L556-K558 VanDerWaalsContact C-N 3.35Å; L556-K558 PolarHBondContact O-N 3.3Å; L556-Q559 PolarHBondContact O-N 3.29Å; L556-K560 PolarHBondContact O-N 3.03Å; L556-L568 HydrophobicContact CB-CD1 4.32Å; L556-L568 HydrophobicContact CD1-CD1 3.8Å; L556-V571 HydrophobicContact CD1-CB 4.31Å; L556-V571 HydrophobicContact CD1-CG1 3.66Å; L556-V571 HydrophobicContact CD2-CG1 3.89Å; L556-V571 HydrophobicContact CG-CG1 4.44Å; L556-T603 HydrophobicContact CD2-CG2 3.46Å; L556-T603 VanDerWaalsContact CD2-CG2 3.46Å; L556-L607 HydrophobicContact CD2-CD1 4.2Å
557V95.4Very high92.2Very high1 Ų143 Ų431%0.00621%0.209CC..Hα-helixtrans-68.4-35.6-178.2-178.70000111.1V433 T436 K437 L553 I554 K560 P561 I563V433-V557 HydrophobicContact CG1-CG2 4.22Å; V433-V557 HydrophobicContact CG2-CG2 4.22Å; T436-V557 HydrophobicContact CG2-CB 3.79Å; T436-V557 HydrophobicContact CG2-CG1 3.66Å; K437-V557 HydrophobicContact CG-CG1 3.67Å; L553-V557 HydrophobicContact CD1-CG2 4.49Å; L553-V557 WeakPolarHBondContact O-CG2 3.27Å; L553-V557 PolarHBondContact O-N 3.01Å; I554-V557 PolarHBondContact O-N 2.94Å; V557-K560 CarbonylContact O-C 3.53Å; V557-K560 PolarHBondContact O-N 3.21Å; V557-P561 WeakPolarHBondContact O-CA 3.3Å; V557-I563 HydrophobicContact CG2-CG2 4.17Å
558K94.8Very high92.3Very high31 Ų3141.8 Ų41.814%0.13520%0.201CC..Hα-helixtrans-66.3-37.6171.9-74.8-172.7178.9-167.80112.3T436 P440 L442 Y521 P523 I554 N555 L556 K560T436-K558 HydrophobicContact CG2-CG 3.64Å; P440-K558 WeakPolarHBondContact O-CE 3.46Å; P440-K558 PolarHBondContact O-NZ 3.19Å; L442-K558 PolarHBondContact O-NZ 2.81Å; Y521-K558 VanDerWaalsContact CE1-O 3.29Å; Y521-K558 WeakPolarHBondContact CE1-O 3.17Å; P523-K558 WeakPolarHBondContact CB-O 3.4Å; I554-K558 HydrophobicContact CG2-CD 3.99Å; I554-K558 HydrophobicContact CG2-CG 4.24Å; I554-K558 WeakPolarHBondContact O-CB 3.45Å; I554-K558 WeakPolarHBondContact O-CG 3.42Å; I554-K558 PolarHBondContact O-N 2.9Å; N555-K558 PolarHBondContact O-N 3.32Å; L556-K558 VanDerWaalsContact C-N 3.35Å; L556-K558 PolarHBondContact O-N 3.3Å; K558-K560 VanDerWaalsContact C-N 3.33Å
559Q93.1Very high92.3Very high17 Ų1744.4 Ų44.48%0.07921%0.212CC..Hα-helixtrans-69.8-34.1178.9-167.160.457.900112P523 P524 F526 N555 L556 L607P523-Q559 WeakPolarHBondContact CB-O 3.41Å; P524-Q559 PolarHBondContact O-NE2 2.91Å; F526-Q559 HydrophobicContact CD2-CG 3.78Å; F526-Q559 HydrophobicContact CE2-CG 4.31Å; N555-Q559 WeakPolarHBondContact O-CB 3.33Å; N555-Q559 PolarHBondContact O-N 3.27Å; L556-Q559 PolarHBondContact O-N 3.29Å; Q559-L607 HydrophobicContact CB-CD1 4.08Å; Q559-L607 HydrophobicContact CB-CD2 4.26Å; Q559-L607 HydrophobicContact CG-CD1 3.75Å; Q559-L607 HydrophobicContact CG-CD2 4.47Å
560K93.2Very high92.5Very high46 Ų4643.7 Ų43.720%0.222%0.219CC..  trans-139.490.3174.2-172-177-169.5-177.50110.6L556 V557 K558 Q562 I563 A606 L607L556-K560 PolarHBondContact O-N 3.03Å; V557-K560 CarbonylContact O-C 3.53Å; V557-K560 PolarHBondContact O-N 3.21Å; K558-K560 VanDerWaalsContact C-N 3.33Å; K560-Q562 PolarHBondContact O-N 3.28Å; K560-Q562 VanDerWaalsContact O-N 3.13Å; K560-I563 HydrophobicContact CB-CB 4.19Å; K560-I563 HydrophobicContact CD-CB 4.08Å; K560-I563 HydrophobicContact CD-CG1 4.39Å; K560-I563 HydrophobicContact CG-CB 4.14Å; K560-I563 WeakPolarHBondContact O-CB 3.37Å; K560-I563 VanDerWaalsContact O-CG2 3.23Å; K560-I563 WeakPolarHBondContact O-CG2 3.46Å; K560-I563 PolarHBondContact O-N 3.02Å; K560-A606 PolarHBondContact NZ-O 3.06Å; K560-L607 HydrophobicContact CB-CD2 3.47Å; K560-L607 VanDerWaalsContact CB-CD2 3.47Å; K560-L607 HydrophobicContact CD-CD2 4.22Å; K560-L607 WeakPolarHBondContact CD-O 3.44Å
561P92.7Very high92.3Very high16 Ų1643.8 Ų43.810%0.10422%0.219CC..THydrogen-bonded Turntrans-58.4-29.7-179.8-26.734.2000113.7K437 V517 Y521 P523 V557 I563K437-P561 WeakPolarHBondContact CE-O 3.15Å; K437-P561 WeakPolarHBondContact CG-O 3.46Å; V517-P561 HydrophobicContact CG1-CB 3.63Å; Y521-P561 HydrophobicContact CD1-CG 3.68Å; Y521-P561 HydrophobicContact CE1-CG 3.97Å; P523-P561 HydrophobicContact CG-CG 4.22Å; V557-P561 WeakPolarHBondContact O-CA 3.3Å; P561-I563 VanDerWaalsContact C-N 3.29Å; P561-I563 PolarHBondContact O-N 2.76Å
562Q91.9Very high92.2Very high103 Ų10342.8 Ų42.848%0.48122%0.216SC..THydrogen-bonded Turntrans-8814.5177-57.9-65.6-4.900113.4E519 K560 T564E519-Q562 PolarHBondContact OE1-NE2 3.44Å; K560-Q562 PolarHBondContact O-N 3.28Å; K560-Q562 VanDerWaalsContact O-N 3.13Å; Q562-T564 PolarHBondContact O-N 3.35Å
563I92.4Very high92.1Very high1 Ų145.4 Ų45.41%0.00524%0.239CC..  trans-58.3130.4176.1-166.2170.2000109.8K437 V557 K560 P561 Q567 L568 L607K437-I563 PolarHBondContact NZ-O 3.12Å; V557-I563 HydrophobicContact CG2-CG2 4.17Å; K560-I563 HydrophobicContact CB-CB 4.19Å; K560-I563 HydrophobicContact CD-CB 4.08Å; K560-I563 HydrophobicContact CD-CG1 4.39Å; K560-I563 HydrophobicContact CG-CB 4.14Å; K560-I563 WeakPolarHBondContact O-CB 3.37Å; K560-I563 VanDerWaalsContact O-CG2 3.23Å; K560-I563 WeakPolarHBondContact O-CG2 3.46Å; K560-I563 PolarHBondContact O-N 3.02Å; P561-I563 VanDerWaalsContact C-N 3.29Å; P561-I563 PolarHBondContact O-N 2.76Å; I563-Q567 HydrophobicContact CD1-CB 4.26Å; I563-Q567 HydrophobicContact CG1-CB 3.68Å; I563-L568 HydrophobicContact CD1-CB 4.22Å; I563-L568 HydrophobicContact CD1-CD1 4.25Å; I563-L568 HydrophobicContact CG1-CB 4.38Å; I563-L607 HydrophobicContact CD1-CD2 4.07Å
564T91.8Very high92Very high61 Ų6147.6 Ų47.637%0.37425%0.251SS..  trans-78.2162.3178.472.30000110.7Q562 E566 Q567 L568Q562-T564 PolarHBondContact O-N 3.35Å; T564-E566 VanDerWaalsContact C-N 3.29Å; T564-E566 VanDerWaalsContact CB-OE2 3.23Å; T564-E566 WeakPolarHBondContact CB-OE2 3.45Å; T564-E566 PolarHBondContact O-N 3.13Å; T564-E566 PolarHBondContact OG1-OE2 2.92Å; T564-Q567 PolarHBondContact O-N 3.07Å; T564-Q567 WeakPolarHBondContact OG1-CG 3.28Å; T564-Q567 PolarHBondContact OG1-N 3.44Å; T564-L568 WeakPolarHBondContact O-CB 3.1Å; T564-L568 PolarHBondContact O-N 2.8Å
565E89.1Confident91.7Very high137 Ų13747.8 Ų47.864%0.6425%0.252SS*.Hα-helixtrans-60.7-41.9177.5-171.4167-168.500110.8Q567 L568 E569E565-Q567 PolarHBondContact O-N 3.11Å; E565-L568 PolarHBondContact O-N 2.83Å; E565-E569 WeakPolarHBondContact O-CB 3.4Å; E565-E569 WeakPolarHBondContact O-CG 3.46Å; E565-E569 PolarHBondContact O-N 2.92Å
566E91.1Very high91.4Very high132 Ų13248.8 Ų48.862%0.61726%0.26SS*.Hα-helixtrans-65.5-40.1179.5-54.579.4-173.200112.4T564 L568 A570T564-E566 VanDerWaalsContact C-N 3.29Å; T564-E566 VanDerWaalsContact CB-OE2 3.23Å; T564-E566 WeakPolarHBondContact CB-OE2 3.45Å; T564-E566 PolarHBondContact O-N 3.13Å; T564-E566 PolarHBondContact OG1-OE2 2.92Å; E566-L568 VanDerWaalsContact C-N 3.33Å; E566-A570 WeakPolarHBondContact O-CB 3.33Å; E566-A570 PolarHBondContact O-N 3Å
567Q92.3Very high91.2Very high64 Ų6450.3 Ų50.330%0.29928%0.276SS..Hα-helixtrans-65-41.5175.7-78.6173.7-13.700111I563 T564 E565 V571I563-Q567 HydrophobicContact CD1-CB 4.26Å; I563-Q567 HydrophobicContact CG1-CB 3.68Å; T564-Q567 PolarHBondContact O-N 3.07Å; T564-Q567 WeakPolarHBondContact OG1-CG 3.28Å; T564-Q567 PolarHBondContact OG1-N 3.44Å; E565-Q567 PolarHBondContact O-N 3.11Å; Q567-V571 WeakPolarHBondContact O-CG2 3.37Å; Q567-V571 PolarHBondContact O-N 3.47Å
568L91.3Very high91Very high15 Ų1550.7 Ų50.78%0.07928%0.278CS..Hα-helixtrans-67.5-45.5179.7-177.863.1000111.4V433 L553 L556 I563 T564 E565 E566 A570 V571 I572V433-L568 HydrophobicContact CG1-CD2 4.37Å; V433-L568 HydrophobicContact CG2-CD2 3.65Å; L553-L568 HydrophobicContact CD1-CD1 3.61Å; L553-L568 HydrophobicContact CD1-CD2 3.78Å; L553-L568 HydrophobicContact CD1-CG 4.12Å; L556-L568 HydrophobicContact CB-CD1 4.32Å; L556-L568 HydrophobicContact CD1-CD1 3.8Å; I563-L568 HydrophobicContact CD1-CB 4.22Å; I563-L568 HydrophobicContact CD1-CD1 4.25Å; I563-L568 HydrophobicContact CG1-CB 4.38Å; T564-L568 WeakPolarHBondContact O-CB 3.1Å; T564-L568 PolarHBondContact O-N 2.8Å; E565-L568 PolarHBondContact O-N 2.83Å; E566-L568 VanDerWaalsContact C-N 3.33Å; L568-A570 VanDerWaalsContact C-N 3.33Å; L568-A570 PolarHBondContact O-N 2.84Å; L568-V571 PolarHBondContact O-N 2.96Å; L568-I572 HydrophobicContact CD1-CD1 4.03Å; L568-I572 HydrophobicContact CD1-CG1 4.38Å; L568-I572 HydrophobicContact CD2-CD1 4.48Å; L568-I572 HydrophobicContact CG-CD1 3.79Å; L568-I572 WeakPolarHBondContact O-CB 3.18Å; L568-I572 VanDerWaalsContact O-CG1 3.24Å; L568-I572 WeakPolarHBondContact O-CG1 3Å; L568-I572 PolarHBondContact O-N 3.36Å
569E89.4Confident90.6Very high117 Ų11750.1 Ų50.155%0.54728%0.276SS..Hα-helixtrans-58.8-43.1175.4-75.8-176.8164.600111.9E565 V571 I572 A573E565-E569 WeakPolarHBondContact O-CB 3.4Å; E565-E569 WeakPolarHBondContact O-CG 3.46Å; E565-E569 PolarHBondContact O-N 2.92Å; E569-V571 PolarHBondContact O-N 3.2Å; E569-I572 PolarHBondContact O-N 2.91Å; E569-A573 WeakPolarHBondContact O-CB 3.14Å; E569-A573 PolarHBondContact O-N 3.09Å
570A91.3Very high90.4Very high51 Ų5155.5 Ų55.542%0.42130%0.301SS..Hα-helixtrans-59.9-47.6177.300000112E566 L568 A573 D574E566-A570 WeakPolarHBondContact O-CB 3.33Å; E566-A570 PolarHBondContact O-N 3Å; L568-A570 VanDerWaalsContact C-N 3.33Å; L568-A570 PolarHBondContact O-N 2.84Å; A570-A573 PolarHBondContact O-N 3.24Å; A570-D574 PolarHBondContact O-N 2.61Å
571V91Very high90.3Very high3 Ų358.6 Ų58.62%0.01832%0.315CS..Hα-helixtrans-67.1-38179176.20000111.7F552 L556 Q567 L568 E569 A573 D574 F575 T603 A606F552-V571 HydrophobicContact CE1-CG1 4.16Å; F552-V571 HydrophobicContact CZ-CG1 3.64Å; L556-V571 HydrophobicContact CD1-CB 4.31Å; L556-V571 HydrophobicContact CD1-CG1 3.66Å; L556-V571 HydrophobicContact CD2-CG1 3.89Å; L556-V571 HydrophobicContact CG-CG1 4.44Å; Q567-V571 WeakPolarHBondContact O-CG2 3.37Å; Q567-V571 PolarHBondContact O-N 3.47Å; L568-V571 PolarHBondContact O-N 2.96Å; E569-V571 PolarHBondContact O-N 3.2Å; V571-A573 VanDerWaalsContact C-N 3.34Å; V571-D574 PolarHBondContact O-N 3.46Å; V571-F575 WeakPolarHBondContact O-CB 3.27Å; V571-F575 PolarHBondContact O-N 3.35Å; V571-T603 HydrophobicContact CG1-CG2 4.37Å; V571-A606 HydrophobicContact CG2-CB 3.54Å
572I88.4Confident90.2Very high66 Ų6657.9 Ų57.934%0.33831%0.31SS..Hα-helixtrans-65.5-38.2175.4-70.5169.8000111.2L553 L568 E569 F575 S576L553-I572 HydrophobicContact CD1-CD1 4.22Å; L568-I572 HydrophobicContact CD1-CD1 4.03Å; L568-I572 HydrophobicContact CD1-CG1 4.38Å; L568-I572 HydrophobicContact CD2-CD1 4.48Å; L568-I572 HydrophobicContact CG-CD1 3.79Å; L568-I572 WeakPolarHBondContact O-CB 3.18Å; L568-I572 VanDerWaalsContact O-CG1 3.24Å; L568-I572 WeakPolarHBondContact O-CG1 3Å; L568-I572 PolarHBondContact O-N 3.36Å; E569-I572 PolarHBondContact O-N 2.91Å; I572-F575 PolarHBondContact O-N 3.29Å; I572-S576 WeakPolarHBondContact O-CB 3.3Å; I572-S576 PolarHBondContact O-N 2.99Å; I572-S576 PolarHBondContact O-OG 2.96Å
573A89.7Confident90.1Very high63 Ų6354.8 Ų54.852%0.52130%0.3SS..Hα-helixtrans-65.5-44.5175.800000111.3E569 A570 V571 F575 S576 G577E569-A573 WeakPolarHBondContact O-CB 3.14Å; E569-A573 PolarHBondContact O-N 3.09Å; A570-A573 PolarHBondContact O-N 3.24Å; V571-A573 VanDerWaalsContact C-N 3.34Å; A573-F575 PolarHBondContact O-N 2.78Å; A573-S576 PolarHBondContact O-N 3.05Å; A573-G577 PolarHBondContact O-N 3.21Å
574D90.8Very high89.8Confident54 Ų5462.8 Ų62.829%0.28934%0.337SS..Hα-helixtrans-61-42.4174.4-79.1-44.6000112A570 V571 G577 L578 L599 K602A570-D574 PolarHBondContact O-N 2.61Å; V571-D574 PolarHBondContact O-N 3.46Å; D574-G577 PolarHBondContact O-N 3.32Å; D574-L578 PolarHBondContact O-N 3.36Å; D574-L599 HydrophobicContact CB-CD1 3.59Å; D574-K602 HydrophobicContact CB-CD 4.47Å; D574-K602 IonicContact OD1-NZ 3.61Å; D574-K602 PolarHBondContact OD1-NZ 3.42Å; D574-K602 VanDerWaalsContact OD2-CD 3.27Å; D574-K602 WeakPolarHBondContact OD2-CD 3.33Å; D574-K602 IonicContact OD2-NZ 3.9Å
575F89.6Confident89.1Confident5 Ų561.4 Ų61.42%0.02234%0.335CS..Hα-helixtrans-64.1-39.6175175.5-99.9000112.3F533 L537 K549 F552 V571 I572 A573 L578 L579 L599F533-F575 AromaticContact CD1-CE2 3.83Å; F533-F575 HydrophobicContact CD1-CE2 3.83Å; F533-F575 HydrophobicContact CD2-CD2 4.2Å; F533-F575 AromaticContact CD2-CE2 3.91Å; F533-F575 HydrophobicContact CD2-CE2 3.91Å; F533-F575 HydrophobicContact CE1-CD2 4.26Å; F533-F575 AromaticContact CE1-CE2 3.48Å; F533-F575 HydrophobicContact CE1-CE2 3.48Å; F533-F575 VanDerWaalsContact CE1-CE2 3.48Å; F533-F575 HydrophobicContact CE1-CZ 4.2Å; F533-F575 AromaticContact CE2-CD2 3.65Å; F533-F575 HydrophobicContact CE2-CD2 3.65Å; F533-F575 AromaticContact CE2-CE2 3.6Å; F533-F575 HydrophobicContact CE2-CE2 3.6Å; F533-F575 HydrophobicContact CG-CE2 4.02Å; F533-F575 AromaticContact CZ-CD2 3.66Å; F533-F575 HydrophobicContact CZ-CD2 3.66Å; F533-F575 AromaticContact CZ-CE2 3.35Å; F533-F575 HydrophobicContact CZ-CE2 3.35Å; F533-F575 HydrophobicContact CZ-CZ 4.38Å; L537-F575 HydrophobicContact CD2-CZ 4.25Å; K549-F575 HydrophobicContact CG-CE1 3.92Å; F552-F575 HydrophobicContact CD1-CB 4.5Å; F552-F575 HydrophobicContact CD1-CD1 4.33Å; F552-F575 HydrophobicContact CD1-CD2 4.42Å; F552-F575 HydrophobicContact CD1-CG 4.14Å; F552-F575 HydrophobicContact CE1-CB 3.7Å; F552-F575 HydrophobicContact CE1-CD1 4.33Å; F552-F575 HydrophobicContact CE1-CD2 4.2Å; F552-F575 AromaticContact CE1-CG 3.8Å; F552-F575 HydrophobicContact CE1-CG 3.8Å; F552-F575 HydrophobicContact CZ-CB 4.07Å; F552-F575 HydrophobicContact CZ-CD2 4.37Å; F552-F575 HydrophobicContact CZ-CG 4.3Å; V571-F575 WeakPolarHBondContact O-CB 3.27Å; V571-F575 PolarHBondContact O-N 3.35Å; I572-F575 PolarHBondContact O-N 3.29Å; A573-F575 PolarHBondContact O-N 2.78Å; F575-L578 WeakPolarHBondContact O-CB 3.24Å; F575-L578 PolarHBondContact O-N 3.16Å; F575-L579 HydrophobicContact CD1-CD1 4.24Å; F575-L579 HydrophobicContact CE1-CD1 3.51Å; F575-L579 HydrophobicContact CE1-CG 4.12Å; F575-L579 HydrophobicContact CZ-CD1 3.79Å; F575-L579 HydrophobicContact CZ-CD2 4.24Å; F575-L579 HydrophobicContact CZ-CG 4.07Å; F575-L579 PolarHBondContact O-N 3.37Å; F575-L579 VanDerWaalsContact O-N 3.16Å; F575-L599 HydrophobicContact CB-CD1 4.45Å; F575-L599 HydrophobicContact CB-CD2 4.1Å; F575-L599 HydrophobicContact CD2-CD2 3.76Å; F575-L599 HydrophobicContact CG-CD2 4.44Å
576S87.3Confident88.4Confident42 Ų4264.6 Ų64.629%0.29435%0.35SS..Hα-helixtrans-65.6-41.6176.5-58.40000111.3I572 A573 L578 L579 E580I572-S576 WeakPolarHBondContact O-CB 3.3Å; I572-S576 PolarHBondContact O-N 2.99Å; I572-S576 PolarHBondContact O-OG 2.96Å; A573-S576 PolarHBondContact O-N 3.05Å; S576-L578 VanDerWaalsContact C-N 3.34Å; S576-L578 PolarHBondContact O-N 3.48Å; S576-L579 PolarHBondContact O-N 2.67Å; S576-E580 WeakPolarHBondContact O-CG 3.04Å; S576-E580 PolarHBondContact O-N 3.17Å
577G89.4Confident88.2Confident32 Ų3265 Ų6533%0.3335%0.352SS..Hα-helixtrans-63.2-35.5173.900000113.5A573 D574 E580 K581A573-G577 PolarHBondContact O-N 3.21Å; D574-G577 PolarHBondContact O-N 3.32Å; G577-E580 PolarHBondContact O-N 3.25Å; G577-K581 VanDerWaalsContact O-CB 3.3Å; G577-K581 WeakPolarHBondContact O-CB 3.39Å; G577-K581 PolarHBondContact O-N 2.87Å
578L89.7Confident88.1Confident9 Ų964.4 Ų64.45%0.04735%0.349CS..Hα-helixtrans-59.1-48.8171.5174.970.2000111.1F533 D574 F575 S576 K581 C582 F592 E595 L599F533-L578 HydrophobicContact CD2-CD2 3.86Å; D574-L578 PolarHBondContact O-N 3.36Å; F575-L578 WeakPolarHBondContact O-CB 3.24Å; F575-L578 PolarHBondContact O-N 3.16Å; S576-L578 VanDerWaalsContact C-N 3.34Å; S576-L578 PolarHBondContact O-N 3.48Å; L578-K581 PolarHBondContact O-N 3.44Å; L578-C582 WeakPolarHBondContact O-CB 3.41Å; L578-C582 PolarHBondContact O-N 2.99Å; L578-F592 HydrophobicContact CD1-CD1 4.34Å; L578-F592 HydrophobicContact CD2-CD1 4.13Å; L578-F592 HydrophobicContact CD2-CE1 4.14Å; L578-F592 HydrophobicContact CG-CD1 4.22Å; L578-F592 HydrophobicContact CG-CE1 4.04Å; L578-E595 HydrophobicContact CD1-CB 3.31Å; L578-L599 HydrophobicContact CD2-CB 4.48Å; L578-L599 HydrophobicContact CD2-CD2 3.59Å
579L88.3Confident87.9Confident19 Ų1967.1 Ų67.110%0.09936%0.361CS..Hα-helixtrans-62.6-44.9179.3-68.4178.8000111.7L537 F575 S576 K581 C583 F592L537-L579 HydrophobicContact CB-CD2 4.01Å; L537-L579 HydrophobicContact CD2-CD2 4.35Å; F575-L579 HydrophobicContact CD1-CD1 4.24Å; F575-L579 HydrophobicContact CE1-CD1 3.51Å; F575-L579 HydrophobicContact CE1-CG 4.12Å; F575-L579 HydrophobicContact CZ-CD1 3.79Å; F575-L579 HydrophobicContact CZ-CD2 4.24Å; F575-L579 HydrophobicContact CZ-CG 4.07Å; F575-L579 PolarHBondContact O-N 3.37Å; F575-L579 VanDerWaalsContact O-N 3.16Å; S576-L579 PolarHBondContact O-N 2.67Å; L579-K581 VanDerWaalsContact C-N 3.33Å; L579-K581 PolarHBondContact O-N 3.37Å; L579-C583 WeakPolarHBondContact O-CB 3.42Å; L579-C583 PolarHBondContact O-N 2.98Å; L579-C583 PolarHBondContact O-SG 2.69Å; L579-F592 HydrophobicContact CD2-CE1 4.2Å; L579-F592 HydrophobicContact CD2-CZ 4.15Å
580E88.4Confident88Confident129 Ų12964.8 Ų64.860%0.60336%0.355SS*.Hα-helixtrans-59-45.3177.3-73.9177.8-177.700111.7S576 G577 Q584S576-E580 WeakPolarHBondContact O-CG 3.04Å; S576-E580 PolarHBondContact O-N 3.17Å; G577-E580 PolarHBondContact O-N 3.25Å; E580-Q584 WeakPolarHBondContact O-CG 3.41Å
581K90.1Very high88Confident112 Ų11263.5 Ų63.549%0.48734%0.343SS..Hα-helixtrans-70.4-49.9-178.5-176.8173.6173.3-179.40112.6G577 L578 L579 E595G577-K581 VanDerWaalsContact O-CB 3.3Å; G577-K581 WeakPolarHBondContact O-CB 3.39Å; G577-K581 PolarHBondContact O-N 2.87Å; L578-K581 PolarHBondContact O-N 3.44Å; L579-K581 VanDerWaalsContact C-N 3.33Å; L579-K581 PolarHBondContact O-N 3.37Å; K581-E595 HydrophobicContact CD-CG 4.17Å; K581-E595 IonicContact NZ-OE1 2.77Å; K581-E595 PolarHBondContact NZ-OE1 3.11Å; K581-E595 IonicContact NZ-OE2 2.83Å; K581-E595 PolarHBondContact NZ-OE2 3.26Å
582C90.9Very high88Confident0 Ų063.6 Ų63.60%034%0.343CS..Hα-helixtrans-81.8-29.3-171.6-67.60000113.8L578 Q584 G585 C591 F592L578-C582 WeakPolarHBondContact O-CB 3.41Å; L578-C582 PolarHBondContact O-N 2.99Å; C582-Q584 VanDerWaalsContact C-N 3.32Å; C582-Q584 PolarHBondContact O-N 3.31Å; C582-G585 PolarHBondContact O-N 3.16Å; C582-C591 WeakPolarHBondContact CA-SG 3.47Å; C582-C591 HydrophobicContact CB-CB 3.7Å; C582-C591 WeakPolarHBondContact CB-SG 3.35Å; C582-C591 WeakPolarHBondContact SG-CB 3.25Å; C582-C591 PolarHBondContact SG-O 3.48Å; C582-C591 VanDerWaalsContact SG-O 3.42Å; C582-C591 CovalentContact SG-SG 2.06Å; C582-C591 PolarHBondContact SG-SG 2.83Å; C582-F592 HydrophobicContact CB-CD1 4.28Å; C582-F592 HydrophobicContact CB-CD2 3.93Å; C582-F592 HydrophobicContact CB-CE1 4.09Å; C582-F592 HydrophobicContact CB-CE2 3.69Å; C582-F592 HydrophobicContact CB-CG 4.19Å; C582-F592 HydrophobicContact CB-CZ 3.79Å
583C89.4Confident88Confident39 Ų3963.5 Ų63.526%0.26435%0.352SS..Hα-helixtrans-76.1-19.6178-62.60000113.9C538 L579 Q588C538-C583 WeakPolarHBondContact CA-SG 3.28Å; C538-C583 HydrophobicContact CB-CB 3.65Å; C538-C583 WeakPolarHBondContact CB-SG 3.45Å; C538-C583 WeakPolarHBondContact SG-CA 3.39Å; C538-C583 WeakPolarHBondContact SG-CB 3.34Å; C538-C583 CovalentContact SG-SG 2.04Å; C538-C583 PolarHBondContact SG-SG 2.86Å; L579-C583 WeakPolarHBondContact O-CB 3.42Å; L579-C583 PolarHBondContact O-N 2.98Å; L579-C583 PolarHBondContact O-SG 2.69Å; C583-Q588 PolarHBondContact O-NE2 2.99Å
584Q86.4Confident88Confident168 Ų16866.3 Ų66.379%0.78535%0.354SS*.THydrogen-bonded Turntrans-86.7-10.5176.2-66.2176.910.900113.7E580 C582E580-Q584 WeakPolarHBondContact O-CG 3.41Å; C582-Q584 VanDerWaalsContact C-N 3.32Å; C582-Q584 PolarHBondContact O-N 3.31Å
585G78.1Confident87.9Confident33 Ų3365.3 Ų65.334%0.3435%0.348SS..SBendtrans-86.6159.3-178.100000114.5C582 Q588C582-G585 PolarHBondContact O-N 3.16Å; G585-Q588 WeakPolarHBondContact O-CG 3.44Å
586Q73.3Confident87.9Confident204 Ų20465.3 Ų65.395%0.95335%0.349SS*.SBendtrans-76.2-33.7176.5-73.8-176.7-15.400113.1
587E86.9Confident87.9Confident141 Ų14167.8 Ų67.866%0.65936%0.356SS*.SBendtrans-105.363.4179-63.8-173.3178.700111E589 V590 C591E587-E589 VanDerWaalsContact C-N 3.3Å; E587-E589 PolarHBondContact O-N 2.04Å; E587-V590 HydrophobicContact CB-CB 4.14Å; E587-V590 HydrophobicContact CB-CG2 4.18Å; E587-V590 PolarHBondContact O-N 3.02Å; E587-V590 VanDerWaalsContact O-N 3.15Å; E587-C591 PolarHBondContact O-N 3.24Å
588Q89.6Confident88Confident50 Ų5071.4 Ų71.423%0.23436%0.363CS..Hα-helixtrans-52.4-45.6-172.3-61.5179-35.300112.7K535 C583 G585 V590 C591 F592K535-Q588 HydrophobicContact CB-CB 3.82Å; C583-Q588 PolarHBondContact O-NE2 2.99Å; G585-Q588 WeakPolarHBondContact O-CG 3.44Å; Q588-V590 PolarHBondContact O-N 3.25Å; Q588-C591 WeakPolarHBondContact O-CB 3.33Å; Q588-C591 PolarHBondContact O-N 2.87Å; Q588-F592 WeakPolarHBondContact O-CD2 3.35Å; Q588-F592 PolarHBondContact O-N 3Å
589E88.8Confident88Confident72 Ų7271.4 Ų71.434%0.33636%0.363SS..Hα-helixtrans-65.3-38.7-177.3-159.763.5-152.400112.8H534 K535 E587 F592 A593H534-E589 IonicContact CE1-OE1 3.83Å; H534-E589 IonicContact CG-OE1 3.6Å; H534-E589 IonicContact ND1-OE1 2.76Å; H534-E589 PolarHBondContact ND1-OE1 2.98Å; K535-E589 VanDerWaalsContact CB-OE2 3.28Å; K535-E589 WeakPolarHBondContact CB-OE2 3.43Å; K535-E589 WeakPolarHBondContact CD-OE2 3.5Å; K535-E589 WeakPolarHBondContact CG-OE2 3.17Å; K535-E589 PolarHBondContact N-OE2 2.9Å; E587-E589 VanDerWaalsContact C-N 3.3Å; E587-E589 PolarHBondContact O-N 2.04Å; E589-F592 PolarHBondContact O-N 2.99Å; E589-A593 WeakPolarHBondContact O-CB 3.31Å; E589-A593 PolarHBondContact O-N 2.92Å
590V90.1Very high88.1Confident68 Ų6870.7 Ų70.741%0.41236%0.359SS..Hα-helixtrans-66.7-42.9176.4-179.20000109.7E587 Q588 F592 A593 E594E587-V590 HydrophobicContact CB-CB 4.14Å; E587-V590 HydrophobicContact CB-CG2 4.18Å; E587-V590 PolarHBondContact O-N 3.02Å; E587-V590 VanDerWaalsContact O-N 3.15Å; Q588-V590 PolarHBondContact O-N 3.25Å; V590-F592 PolarHBondContact O-N 3.42Å; V590-A593 PolarHBondContact O-N 3.03Å; V590-E594 PolarHBondContact O-N 3.49Å
591C91.3Very high88.2Confident25 Ų2568.2 Ų68.217%0.16936%0.356CS..Hα-helixtrans-59.7-46.1175.4-1750000112.1C582 E587 Q588 A593 E594 E595C582-C591 WeakPolarHBondContact CA-SG 3.47Å; C582-C591 HydrophobicContact CB-CB 3.7Å; C582-C591 WeakPolarHBondContact CB-SG 3.35Å; C582-C591 WeakPolarHBondContact SG-CB 3.25Å; C582-C591 PolarHBondContact SG-O 3.48Å; C582-C591 VanDerWaalsContact SG-O 3.42Å; C582-C591 CovalentContact SG-SG 2.06Å; C582-C591 PolarHBondContact SG-SG 2.83Å; E587-C591 PolarHBondContact O-N 3.24Å; Q588-C591 WeakPolarHBondContact O-CB 3.33Å; Q588-C591 PolarHBondContact O-N 2.87Å; C591-A593 VanDerWaalsContact C-N 3.33Å; C591-A593 PolarHBondContact O-N 3.18Å; C591-E594 PolarHBondContact O-N 2.92Å; C591-E595 WeakPolarHBondContact O-CB 3.32Å; C591-E595 PolarHBondContact O-N 2.85Å
592F90.9Very high88.1Confident4 Ų468 Ų682%0.01836%0.355CS..Hα-helixtrans-64.2-37.2177.5-83.2-70.5000112.6F533 L537 C538 L578 L579 C582 Q588 E589 V590 E594 G596F533-F592 HydrophobicContact CB-CD1 3.82Å; F533-F592 HydrophobicContact CB-CE1 4.1Å; F533-F592 WeakPolarHBondContact O-CB 3.47Å; L537-F592 HydrophobicContact CB-CZ 4.49Å; C538-F592 WeakPolarHBondContact SG-CE2 3.22Å; L578-F592 HydrophobicContact CD1-CD1 4.34Å; L578-F592 HydrophobicContact CD2-CD1 4.13Å; L578-F592 HydrophobicContact CD2-CE1 4.14Å; L578-F592 HydrophobicContact CG-CD1 4.22Å; L578-F592 HydrophobicContact CG-CE1 4.04Å; L579-F592 HydrophobicContact CD2-CE1 4.2Å; L579-F592 HydrophobicContact CD2-CZ 4.15Å; C582-F592 HydrophobicContact CB-CD1 4.28Å; C582-F592 HydrophobicContact CB-CD2 3.93Å; C582-F592 HydrophobicContact CB-CE1 4.09Å; C582-F592 HydrophobicContact CB-CE2 3.69Å; C582-F592 HydrophobicContact CB-CG 4.19Å; C582-F592 HydrophobicContact CB-CZ 3.79Å; Q588-F592 WeakPolarHBondContact O-CD2 3.35Å; Q588-F592 PolarHBondContact O-N 3Å; E589-F592 PolarHBondContact O-N 2.99Å; V590-F592 PolarHBondContact O-N 3.42Å; F592-E594 VanDerWaalsContact C-N 3.35Å; F592-E594 PolarHBondContact O-N 3.32Å; F592-G596 WeakPolarHBondContact O-CA 3.09Å; F592-G596 PolarHBondContact O-N 3.23Å
593A88.2Confident88.1Confident64 Ų6468 Ų6853%0.52936%0.355SS..Hα-helixtrans-62.6-40.3175.200000112.2E589 V590 C591 Q597E589-A593 WeakPolarHBondContact O-CB 3.31Å; E589-A593 PolarHBondContact O-N 2.92Å; V590-A593 PolarHBondContact O-N 3.03Å; C591-A593 VanDerWaalsContact C-N 3.33Å; C591-A593 PolarHBondContact O-N 3.18Å; A593-Q597 VanDerWaalsContact O-CG 3.22Å; A593-Q597 WeakPolarHBondContact O-CG 3.27Å
594E90.3Very high88.1Confident122 Ų12270.6 Ų70.657%0.5736%0.359SS*.Hα-helixtrans-82.5-52-178.5-68-175.3172.200113.5V590 C591 F592V590-E594 PolarHBondContact O-N 3.49Å; C591-E594 PolarHBondContact O-N 2.92Å; F592-E594 VanDerWaalsContact C-N 3.35Å; F592-E594 PolarHBondContact O-N 3.32Å
595E90.1Very high88.2Confident34 Ų3466.4 Ų66.416%0.15935%0.353CS..Hα-helixtrans-77.8-28.3-176.3-62.2-68.3140.600111.7L578 K581 C591 Q597 K598 L599L578-E595 HydrophobicContact CD1-CB 3.31Å; K581-E595 HydrophobicContact CD-CG 4.17Å; K581-E595 IonicContact NZ-OE1 2.77Å; K581-E595 PolarHBondContact NZ-OE1 3.11Å; K581-E595 IonicContact NZ-OE2 2.83Å; K581-E595 PolarHBondContact NZ-OE2 3.26Å; C591-E595 WeakPolarHBondContact O-CB 3.32Å; C591-E595 PolarHBondContact O-N 2.85Å; E595-Q597 VanDerWaalsContact C-N 3.35Å; E595-K598 WeakPolarHBondContact O-CB 3.46Å; E595-K598 PolarHBondContact O-N 3.13Å; E595-K598 IonicContact OE1-NZ 2.72Å; E595-K598 PolarHBondContact OE1-NZ 2.82Å; E595-K598 IonicContact OE2-NZ 3.91Å; E595-L599 PolarHBondContact O-N 3.37Å
596G87.8Confident88.6Confident4 Ų466 Ų664%0.04135%0.346CS..Hα-helixtrans-61.9-40.917200000112.1F592 K598 L599 I600F592-G596 WeakPolarHBondContact O-CA 3.09Å; F592-G596 PolarHBondContact O-N 3.23Å; G596-K598 VanDerWaalsContact C-N 3.3Å; G596-K598 PolarHBondContact O-N 3.07Å; G596-L599 WeakPolarHBondContact O-CB 3.11Å; G596-L599 PolarHBondContact O-N 3.24Å; G596-L599 VanDerWaalsContact O-N 3.13Å; G596-I600 WeakPolarHBondContact O-CG1 3.07Å; G596-I600 PolarHBondContact O-N 2.72Å
597Q88.6Confident89.3Confident95 Ų9556.6 Ų56.644%0.44430%0.303SS..Hα-helixtrans-63.4-35.3175.3-71.9-63.7-31.200112.7A593 E595 I600 S601A593-Q597 VanDerWaalsContact O-CG 3.22Å; A593-Q597 WeakPolarHBondContact O-CG 3.27Å; E595-Q597 VanDerWaalsContact C-N 3.35Å; Q597-I600 PolarHBondContact O-N 3.15Å; Q597-S601 PolarHBondContact O-N 3.34Å; Q597-S601 PolarHBondContact O-OG 3.47Å
598K90.6Very high89.2Confident108 Ų10853 Ų5347%0.4730%0.304SS..Hα-helixtrans-66.1-43172.7-62.5174.9-170.2167.90111E595 G596 S601 K602E595-K598 WeakPolarHBondContact O-CB 3.46Å; E595-K598 PolarHBondContact O-N 3.13Å; E595-K598 IonicContact OE1-NZ 2.72Å; E595-K598 PolarHBondContact OE1-NZ 2.82Å; E595-K598 IonicContact OE2-NZ 3.91Å; G596-K598 VanDerWaalsContact C-N 3.3Å; G596-K598 PolarHBondContact O-N 3.07Å; K598-S601 PolarHBondContact O-N 3.47Å; K598-K602 WeakPolarHBondContact O-CG 3.28Å; K598-K602 PolarHBondContact O-N 2.06Å
599L89.7Confident88.8Confident8 Ų854.7 Ų54.74%0.04232%0.317CS..Hα-helixtrans-62.2-43.8175.7177.565.6000111.6F533 D574 F575 L578 E595 G596 S601 K602 T603F533-L599 HydrophobicContact CD2-CD2 4.09Å; F533-L599 HydrophobicContact CE2-CD2 3.62Å; D574-L599 HydrophobicContact CB-CD1 3.59Å; F575-L599 HydrophobicContact CB-CD1 4.45Å; F575-L599 HydrophobicContact CB-CD2 4.1Å; F575-L599 HydrophobicContact CD2-CD2 3.76Å; F575-L599 HydrophobicContact CG-CD2 4.44Å; L578-L599 HydrophobicContact CD2-CB 4.48Å; L578-L599 HydrophobicContact CD2-CD2 3.59Å; E595-L599 PolarHBondContact O-N 3.37Å; G596-L599 WeakPolarHBondContact O-CB 3.11Å; G596-L599 PolarHBondContact O-N 3.24Å; G596-L599 VanDerWaalsContact O-N 3.13Å; L599-S601 VanDerWaalsContact C-N 3.32Å; L599-S601 PolarHBondContact O-N 2.83Å; L599-K602 PolarHBondContact O-N 2.77Å; L599-T603 VanDerWaalsContact O-CB 3.27Å; L599-T603 WeakPolarHBondContact O-CB 3.15Å; L599-T603 PolarHBondContact O-N 3.32Å; L599-T603 PolarHBondContact O-OG1 2.82Å
600I89.9Confident88.7Confident4 Ų453.9 Ų53.92%0.02132%0.316CS..Hα-helixtrans-58-47.1175.6-68.9168.8000109.9F526 D528 F531 I532 G596 Q597 K602 T603 R604F526-I600 HydrophobicContact CE1-CG2 4.01Å; F526-I600 HydrophobicContact CZ-CG2 4.3Å; D528-I600 HydrophobicContact CB-CD1 4.32Å; F531-I600 HydrophobicContact CB-CD1 4.42Å; F531-I600 HydrophobicContact CB-CG1 3.83Å; I532-I600 HydrophobicContact CG1-CD1 4.07Å; G596-I600 WeakPolarHBondContact O-CG1 3.07Å; G596-I600 PolarHBondContact O-N 2.72Å; Q597-I600 PolarHBondContact O-N 3.15Å; I600-K602 PolarHBondContact O-N 3.25Å; I600-T603 WeakPolarHBondContact O-CB 3.16Å; I600-T603 PolarHBondContact O-N 2.89Å; I600-R604 HydrophobicContact CG2-CG 4.39Å; I600-R604 WeakPolarHBondContact O-CB 3.23Å; I600-R604 WeakPolarHBondContact O-CG 3.43Å; I600-R604 PolarHBondContact O-N 3.28Å
601S90.4Very high88.7Confident77 Ų7753.1 Ų53.154%0.53831%0.311SS..Hα-helixtrans-60-44178.5-600000112.5Q597 K598 L599 A605Q597-S601 PolarHBondContact O-N 3.34Å; Q597-S601 PolarHBondContact O-OG 3.47Å; K598-S601 PolarHBondContact O-N 3.47Å; L599-S601 VanDerWaalsContact C-N 3.32Å; L599-S601 PolarHBondContact O-N 2.83Å; S601-A605 PolarHBondContact O-N 3.26Å; S601-A605 VanDerWaalsContact O-N 3.07Å
602K89.4Confident88.5Confident107 Ų10754.7 Ų54.747%0.46532%0.319SS..Hα-helixtrans-65.6-41175-70.6-177178.5-178.90112.3D574 K598 L599 I600 A605 A606D574-K602 HydrophobicContact CB-CD 4.47Å; D574-K602 IonicContact OD1-NZ 3.61Å; D574-K602 PolarHBondContact OD1-NZ 3.42Å; D574-K602 VanDerWaalsContact OD2-CD 3.27Å; D574-K602 WeakPolarHBondContact OD2-CD 3.33Å; D574-K602 IonicContact OD2-NZ 3.9Å; K598-K602 WeakPolarHBondContact O-CG 3.28Å; K598-K602 PolarHBondContact O-N 2.06Å; L599-K602 PolarHBondContact O-N 2.77Å; I600-K602 PolarHBondContact O-N 3.25Å; K602-A605 PolarHBondContact O-N 3.45Å; K602-A606 PolarHBondContact O-N 2.94Å
603T89.3Confident88.4Confident0 Ų057.6 Ų57.60%034%0.337CS..Hα-helixtrans-61.8-46.8177.9-61.80000110.3F531 L556 V571 L599 I600 A605 A606 L607F531-T603 HydrophobicContact CD1-CG2 4.39Å; F531-T603 HydrophobicContact CE1-CG2 4.23Å; F531-T603 HydrophobicContact CZ-CG2 4.48Å; L556-T603 HydrophobicContact CD2-CG2 3.46Å; L556-T603 VanDerWaalsContact CD2-CG2 3.46Å; V571-T603 HydrophobicContact CG1-CG2 4.37Å; L599-T603 VanDerWaalsContact O-CB 3.27Å; L599-T603 WeakPolarHBondContact O-CB 3.15Å; L599-T603 PolarHBondContact O-N 3.32Å; L599-T603 PolarHBondContact O-OG1 2.82Å; I600-T603 WeakPolarHBondContact O-CB 3.16Å; I600-T603 PolarHBondContact O-N 2.89Å; T603-A605 PolarHBondContact O-N 3.48Å; T603-A606 PolarHBondContact O-N 3.46Å; T603-L607 HydrophobicContact CG2-CD1 3.51Å; T603-L607 HydrophobicContact CG2-CG 4.27Å; T603-L607 VanDerWaalsContact O-CB 3.3Å; T603-L607 WeakPolarHBondContact O-CB 3.38Å; T603-L607 WeakPolarHBondContact O-CD1 3.19Å; T603-L607 WeakPolarHBondContact O-CG 3.48Å; T603-L607 PolarHBondContact O-N 3.05Å
604R89.6Confident88.4Confident95 Ų9557.3 Ų57.336%0.35833%0.325SS..Hα-helixtrans-55.6-47.5172.8-77.9-173.371.5156.27112.6F526 I600 A606 L607 G608 V609F526-R604 HydrophobicContact CD1-CG 3.99Å; F526-R604 HydrophobicContact CD2-CG 4.41Å; F526-R604 HydrophobicContact CE1-CG 3.49Å; F526-R604 VanDerWaalsContact CE1-CG 3.49Å; F526-R604 HydrophobicContact CE2-CG 3.98Å; F526-R604 HydrophobicContact CG-CG 4.42Å; F526-R604 HydrophobicContact CZ-CG 3.49Å; F526-R604 VanDerWaalsContact CZ-CG 3.49Å; I600-R604 HydrophobicContact CG2-CG 4.39Å; I600-R604 WeakPolarHBondContact O-CB 3.23Å; I600-R604 WeakPolarHBondContact O-CG 3.43Å; I600-R604 PolarHBondContact O-N 3.28Å; R604-A606 PolarHBondContact O-N 3.06Å; R604-L607 CarbonylContact O-C 3.51Å; R604-L607 PolarHBondContact O-N 3.15Å; R604-G608 PolarHBondContact O-N 3.46Å; R604-V609 HydrophobicContact CB-CG2 4.46Å; R604-V609 WeakPolarHBondContact CB-O 3.22Å; R604-V609 HydrophobicContact CG-CG2 4.33Å; R604-V609 PolarHBondContact NE-O 3.07Å; R604-V609 PolarHBondContact NH2-OXT 2.76Å; R604-V609 PolarHBondContact O-N 2.99Å; R604-V609 VanDerWaalsContact O-N 3.11Å
605A89.4Confident88.3Confident80 Ų8052.9 Ų52.966%0.66131%0.308SS*.Hα-helixtrans-60.9-44.3176.400000112.6S601 K602 T603 L607 G608S601-A605 PolarHBondContact O-N 3.26Å; S601-A605 VanDerWaalsContact O-N 3.07Å; K602-A605 PolarHBondContact O-N 3.45Å; T603-A605 PolarHBondContact O-N 3.48Å; A605-L607 VanDerWaalsContact C-N 3.28Å; A605-L607 PolarHBondContact O-N 3.23Å; A605-G608 PolarHBondContact O-N 3.42Å
606A87.1Confident88.2Confident23 Ų2354.3 Ų54.319%0.1932%0.319CS..Hα-helixtrans-65.1-34.4176.400000112.2K560 V571 K602 T603 R604K560-A606 PolarHBondContact NZ-O 3.06Å; V571-A606 HydrophobicContact CG2-CB 3.54Å; K602-A606 PolarHBondContact O-N 2.94Å; T603-A606 PolarHBondContact O-N 3.46Å; R604-A606 PolarHBondContact O-N 3.06Å
607L86.8Confident88.2Confident8 Ų858.2 Ų58.24%0.04234%0.341CS..Hα-helixtrans-80.1-21.4178.9-66.4169.2000113F526 L556 Q559 K560 I563 T603 R604 A605 V609F526-L607 HydrophobicContact CD2-CD1 4.28Å; F526-L607 HydrophobicContact CE2-CD1 3.69Å; L556-L607 HydrophobicContact CD2-CD1 4.2Å; Q559-L607 HydrophobicContact CB-CD1 4.08Å; Q559-L607 HydrophobicContact CB-CD2 4.26Å; Q559-L607 HydrophobicContact CG-CD1 3.75Å; Q559-L607 HydrophobicContact CG-CD2 4.47Å; K560-L607 HydrophobicContact CB-CD2 3.47Å; K560-L607 VanDerWaalsContact CB-CD2 3.47Å; K560-L607 HydrophobicContact CD-CD2 4.22Å; K560-L607 WeakPolarHBondContact CD-O 3.44Å; I563-L607 HydrophobicContact CD1-CD2 4.07Å; T603-L607 HydrophobicContact CG2-CD1 3.51Å; T603-L607 HydrophobicContact CG2-CG 4.27Å; T603-L607 VanDerWaalsContact O-CB 3.3Å; T603-L607 WeakPolarHBondContact O-CB 3.38Å; T603-L607 WeakPolarHBondContact O-CD1 3.19Å; T603-L607 WeakPolarHBondContact O-CG 3.48Å; T603-L607 PolarHBondContact O-N 3.05Å; R604-L607 CarbonylContact O-C 3.51Å; R604-L607 PolarHBondContact O-N 3.15Å; A605-L607 VanDerWaalsContact C-N 3.28Å; A605-L607 PolarHBondContact O-N 3.23Å; L607-V609 HydrophobicContact CB-CG2 3.85Å
608G84.7Confident88.1Confident66 Ų6655.1 Ų55.168%0.6833%0.332SS*.THydrogen-bonded Turntrans77.133.7-177.400000113.8R604 A605R604-G608 PolarHBondContact O-N 3.46Å; A605-G608 PolarHBondContact O-N 3.42Å
609V80.8Confident87.9Confident85 Ų8550.3 Ų50.352%0.51532%0.319SS..  trans-131.40-174.6-62.90000114.4F526 R604 L607F526-V609 HydrophobicContact CB-CG2 4.16Å; F526-V609 HydrophobicContact CD2-CG2 3.57Å; F526-V609 HydrophobicContact CE2-CG2 4.2Å; F526-V609 HydrophobicContact CG-CG2 3.99Å; R604-V609 HydrophobicContact CB-CG2 4.46Å; R604-V609 WeakPolarHBondContact CB-O 3.22Å; R604-V609 HydrophobicContact CG-CG2 4.33Å; R604-V609 PolarHBondContact NE-O 3.07Å; R604-V609 PolarHBondContact NH2-OXT 2.76Å; R604-V609 PolarHBondContact O-N 2.99Å; R604-V609 VanDerWaalsContact O-N 3.11Å; L607-V609 HydrophobicContact CB-CG2 3.85Å

Retrieved 609 of 609 residues in 1946.4 ms (Link to these results)

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