A0A067ZXG6_HUMAN Loading...

Nuclear pore complex-interacting protein

AlphaFold DB , UniProt , Accession A0A067ZXG6, Species HUMAN (Homo sapiens, Human), Gene NPIP, Length 236 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
1L31.9Very low34.8Very low226 Ų226156.6 Ų156.6100%1.18383%0.825SS**  0113.40-93.5140.9000107.4
2F31.3Very low34.6Very low184 Ų184149.5 Ų149.581%0.80782%0.817SS**  trans11.3126.3167.3-84.2-97.1000120.2
3C30.1Very low35.1Very low119 Ų119144.6 Ų144.680%0.80482%0.823SS**  -159.4107.7108.2-119.60000111.5
4C41Very low35.1Very low106 Ų106142 Ų14272%0.71682%0.816SS**  trans-72.5126.4155.9-58.80000107.9
5L36.9Very low35.8Very low146 Ų146145.7 Ų145.776%0.76482%0.819SS**  trans-137.2100.8154.5-83.1171.5000107.4Y7L5-Y7 HydrophobicContact CD2-CE2 4.47Å
6G39.8Very low36.2Very low70 Ų70142.7 Ų142.772%0.72281%0.805SS**  trans-76.9141.2159.900000109.3
7Y30.8Very low36.4Very low183 Ų183147.5 Ų147.572%0.71881%0.808SS**  trans-146.4102.7161.4-97.4-86.5000105.4L5L5-Y7 HydrophobicContact CD2-CE2 4.47Å
8E33.8Very low36.7Very low159 Ų159147.7 Ų147.774%0.74380%0.802SS**  86.5105.296.7-83.7-168.9161.400111.8L10E8-L10 PolarHBondContact O-N 3.48Å
9W40Very low37.2Very low254 Ų254144.2 Ų144.296%0.96279%0.789SS**  trans-62.1121.9154.6-85.171.6000108.7
10L34.2Very low37.7Very low156 Ų156139.7 Ų139.782%0.81777%0.772SS**  trans-160.5124.4148.9-106.2165000111.2E8E8-L10 PolarHBondContact O-N 3.48Å
11S33.1Very low37.7Very low120 Ų120141.8 Ų141.884%0.83977%0.768SS**  trans88.1124.9143.8-149.50000120
12G32.7Very low38.4Very low71 Ų71135.6 Ų135.673%0.73274%0.74SS**  trans100.399.113300000115.3
13G40.3Very low39.2Very low86 Ų86132.4 Ų132.489%0.88773%0.73SS**  trans-61.6138.2177.500000114.3
14C35.2Very low39.8Very low108 Ų108131.9 Ų131.973%0.7372%0.719SS**  trans-150.1101.9134.7-155.30000107.4T16C14-T16 VanDerWaalsContact C-N 3.26Å; C14-T16 PolarHBondContact O-N 3.06Å
15K46Very low39.9Very low198 Ų198129.5 Ų129.586%0.86170%0.701SS**  trans-68.787169.2-76.6174.5176.7170.70107.7W17K15-W17 PolarHBondContact O-N 3.32Å
16T41.8Very low40.1Very low97 Ų97128.5 Ų128.560%0.59570%0.696SS**  trans-82.6111.516851.80000108.3C14 H18C14-T16 VanDerWaalsContact C-N 3.26Å; C14-T16 PolarHBondContact O-N 3.06Å; T16-H18 PolarHBondContact O-N 3.32Å
17W40.8Very low40.3Very low224 Ų224128.2 Ų128.285%0.84869%0.687SS**THydrogen-bonded Turntrans-50.11-175.5-72.374.1000117.6K15K15-W17 PolarHBondContact O-N 3.32Å
18H41.8Very low40.9Very low152 Ų152125.8 Ų125.870%0.70469%0.686SS**Hα-helixtrans-81.1-29.9-174.2-106.1-83.5000114.5T16T16-H18 PolarHBondContact O-N 3.32Å
19S45.5Very low41.4Very low80 Ų80125.1 Ų125.156%0.55968%0.683SS**Hα-helixtrans-80.4-25.9-178.947.70000113.5I23S19-I23 WeakPolarHBondContact O-CD1 3.35Å; S19-I23 VanDerWaalsContact O-CG1 3.3Å; S19-I23 WeakPolarHBondContact O-CG1 3.25Å; S19-I23 PolarHBondContact O-N 3.34Å
20A46.7Very low41.5Very low54 Ų54120.7 Ų120.745%0.44667%0.672SS.*Hα-helixtrans-71.7-31.4173.200000112.2N24A20-N24 WeakPolarHBondContact O-CB 3.45Å; A20-N24 PolarHBondContact O-N 3.23Å; A20-N24 PolarHBondContact O-ND2 3.37Å
21W37.6Very low42Very low184 Ų184121.5 Ų121.570%0.69767%0.672SS**Hα-helixtrans-70.1-43.3177.3-153.663.9000111.2I23 N24 T25W21-I23 PolarHBondContact O-N 3.28Å; W21-N24 PolarHBondContact O-N 3Å; W21-T25 WeakPolarHBondContact O-CB 3.42Å; W21-T25 PolarHBondContact O-N 3.33Å; W21-T25 PolarHBondContact O-OG1 2.97Å
22V46.7Very low42.8Very low97 Ų97127.7 Ų127.759%0.58868%0.677SS**Hα-helixtrans-66.5-37178.3177.60000112.2L26V22-L26 WeakPolarHBondContact O-CB 3.26Å; V22-L26 PolarHBondContact O-N 3.46Å; V22-L26 VanDerWaalsContact O-N 3.09Å
23I48.4Very low43Very low117 Ų117127.3 Ų127.360%0.667%0.673SS**Hα-helixtrans-71.9-39.4176.7-63.3168.8000111.2S19 W21 L26 A27S19-I23 WeakPolarHBondContact O-CD1 3.35Å; S19-I23 VanDerWaalsContact O-CG1 3.3Å; S19-I23 WeakPolarHBondContact O-CG1 3.25Å; S19-I23 PolarHBondContact O-N 3.34Å; W21-I23 PolarHBondContact O-N 3.28Å; I23-L26 PolarHBondContact O-N 3.45Å; I23-A27 WeakPolarHBondContact O-CB 3.49Å; I23-A27 PolarHBondContact O-N 3.48Å
24N43.4Very low43.5Very low108 Ų108129.4 Ų129.458%0.57867%0.669SS**Hα-helixtrans-71.2-33.2175.4-82-27.6000112.7A20 W21 L26 A27 D28A20-N24 WeakPolarHBondContact O-CB 3.45Å; A20-N24 PolarHBondContact O-N 3.23Å; A20-N24 PolarHBondContact O-ND2 3.37Å; W21-N24 PolarHBondContact O-N 3Å; N24-L26 VanDerWaalsContact C-N 3.31Å; N24-L26 PolarHBondContact O-N 3.08Å; N24-A27 PolarHBondContact O-N 3.03Å; N24-D28 WeakPolarHBondContact O-CB 3.36Å; N24-D28 PolarHBondContact O-N 3.38Å
25T42.8Very low43.9Very low55 Ų55131.6 Ų131.634%0.33767%0.673SS.*Hα-helixtrans-71.2-30.4176.5-38.60000111.1W21 H29W21-T25 WeakPolarHBondContact O-CB 3.42Å; W21-T25 PolarHBondContact O-N 3.33Å; W21-T25 PolarHBondContact O-OG1 2.97Å; T25-H29 PolarHBondContact O-N 3.05Å; T25-H29 PolarHBondContact O-ND1 3.23Å
26L40.8Very low43.7Very low126 Ų126132.8 Ų132.866%0.6668%0.679SS**Hα-helixtrans-75.1-35.3173-165.473.3000112.5V22 I23 N24V22-L26 WeakPolarHBondContact O-CB 3.26Å; V22-L26 PolarHBondContact O-N 3.46Å; V22-L26 VanDerWaalsContact O-N 3.09Å; I23-L26 PolarHBondContact O-N 3.45Å; N24-L26 VanDerWaalsContact C-N 3.31Å; N24-L26 PolarHBondContact O-N 3.08Å
27A44.3Very low44Very low63 Ų63130.3 Ų130.352%0.52167%0.673SS.*Hα-helixtrans-72.3-32.7175.300000112.7I23 N24 H29I23-A27 WeakPolarHBondContact O-CB 3.49Å; I23-A27 PolarHBondContact O-N 3.48Å; N24-A27 PolarHBondContact O-N 3.03Å; A27-H29 VanDerWaalsContact C-N 3.33Å
28D43.3Very low44Very low132 Ų132122 Ų12271%0.70666%0.656SS**Hα-helixtrans-79.6-16.1-178.4-15449.4000112.9N24N24-D28 WeakPolarHBondContact O-CB 3.36Å; N24-D28 PolarHBondContact O-N 3.38Å
29H43.2Very low44.7Very low146 Ų146118.8 Ų118.868%0.67665%0.651SS**G310 helixtrans-92.2-1.3177.3-77.625.2000114.6T25 A27T25-H29 PolarHBondContact O-N 3.05Å; T25-H29 PolarHBondContact O-ND1 3.23Å; A27-H29 VanDerWaalsContact C-N 3.33Å
30H43.2Very low45.2Very low160 Ų160119.5 Ų119.574%0.74165%0.654SS**G310 helixtrans-89.67.7176-100.1-71.6000114.9
31H44.8Very low45.6Very low174 Ų174125.6 Ų125.681%0.80667%0.665SS**G310 helixtrans-115.722.1-177.2-107.7-51.3000116.7
32R48.9Very low46.6Very low250 Ų250121.4 Ų121.494%0.94366%0.656SS**  trans-137.471.1170.1-98.5180162.1-179.5-5.1111.9
33G38.6Very low47.3Very low63 Ų63123.4 Ų123.465%0.64966%0.659SS**  trans-128106.2164.200000108.8D35G33-D35 PolarHBondContact O-N 3.5Å; G33-D35 VanDerWaalsContact O-N 3.13Å
34T49.5Very low48Very low130 Ų130121.8 Ų121.880%0.79865%0.654SS**  trans-61.9100.5174.240.30000111.3
35D43.3Very low48.9Very low154 Ų154120.9 Ų120.982%0.82465%0.648SS**  trans-103.7110.3163-71.7-32.4000109.5G33 G37G33-D35 PolarHBondContact O-N 3.5Å; G33-D35 VanDerWaalsContact O-N 3.13Å; D35-G37 PolarHBondContact O-N 2.88Å
36F42.9Very low49.7Very low222 Ų222123.7 Ų123.797%0.97466%0.66SS**SBendtrans-59.169.9171.7-92.7-98.9000111.9
37G47.8Very low50.5Low46 Ų46120 Ų12047%0.47465%0.647SS.*  trans-169.524-175.500000115.5D35D35-G37 PolarHBondContact O-N 2.88Å
38G40.3Very low51.2Low48 Ų48124.1 Ų124.150%0.49565%0.654SS.*  trans-56.7152179.300000113P40 W41G38-P40 WeakPolarHBondContact O-CD 3.49Å; G38-W41 PolarHBondContact O-N 3.44Å
39S56.5Low52.1Low85 Ų85119.9 Ų119.959%0.59463%0.634SS**Hα-helixtrans-28.9-35.9-179.6-73.50000118.7W41 L42 H43S39-W41 VanDerWaalsContact C-N 3.33Å; S39-W41 PolarHBondContact O-N 3.27Å; S39-L42 PolarHBondContact O-N 3.08Å; S39-H43 PolarHBondContact O-CD2 3.5Å; S39-H43 PolarHBondContact O-N 3.14Å
40P56.9Low52.9Low96 Ų96117 Ų11762%0.62363%0.627SS**Hα-helixtrans-59.7-37.7176.7-26.836.3000114.4G38 H43 V44G38-P40 WeakPolarHBondContact O-CD 3.49Å; P40-H43 PolarHBondContact O-N 3.34Å; P40-V44 WeakPolarHBondContact O-CG2 3.4Å; P40-V44 PolarHBondContact O-N 2.95Å
41W54.1Low54Low182 Ų182112.8 Ų112.869%0.68962%0.615SS**Hα-helixtrans-72.6-34.5-177.2-113.880.8000112.4G38 S39 V44 I45G38-W41 PolarHBondContact O-N 3.44Å; S39-W41 VanDerWaalsContact C-N 3.33Å; S39-W41 PolarHBondContact O-N 3.27Å; W41-V44 PolarHBondContact O-N 3.38Å; W41-I45 HydrophobicContact CE3-CD1 3.69Å; W41-I45 HydrophobicContact CE3-CG1 4.02Å; W41-I45 HydrophobicContact CZ3-CD1 4.24Å; W41-I45 HydrophobicContact CZ3-CG1 4.4Å; W41-I45 WeakPolarHBondContact O-CB 3.06Å; W41-I45 WeakPolarHBondContact O-CD1 3.02Å; W41-I45 WeakPolarHBondContact O-CG1 3.23Å; W41-I45 PolarHBondContact O-N 2.9Å
42L59.8Low55.4Low96 Ų96109.6 Ų109.650%0.50360%0.597SS.*Hα-helixtrans-67.1-38.7172.7-73.1170.6000111.9S39 V44 I45 I46S39-L42 PolarHBondContact O-N 3.08Å; L42-V44 VanDerWaalsContact C-N 3.31Å; L42-V44 PolarHBondContact O-N 3Å; L42-I45 PolarHBondContact O-N 2.86Å; L42-I46 WeakPolarHBondContact O-CB 3.31Å; L42-I46 VanDerWaalsContact O-CG1 3.28Å; L42-I46 WeakPolarHBondContact O-CG1 3.37Å; L42-I46 PolarHBondContact O-N 3.47Å
43H60.6Low56.7Low139 Ų139103.5 Ų103.564%0.64458%0.577SS**Hα-helixtrans-60.7-41.1170.9-89.5-82.4000111.7S39 P40 I46 A47S39-H43 PolarHBondContact O-CD2 3.5Å; S39-H43 PolarHBondContact O-N 3.14Å; P40-H43 PolarHBondContact O-N 3.34Å; H43-I46 PolarHBondContact O-N 3.4Å; H43-A47 WeakPolarHBondContact O-CA 3.27Å; H43-A47 WeakPolarHBondContact O-CB 3.43Å; H43-A47 PolarHBondContact O-N 2.79Å
44V62.1Low58.5Low82 Ų82104.2 Ų104.250%0.49757%0.568SS.*Hα-helixtrans-65-46.2173.9174.50000110.9P40 W41 L42 I46 A47 F48P40-V44 WeakPolarHBondContact O-CG2 3.4Å; P40-V44 PolarHBondContact O-N 2.95Å; W41-V44 PolarHBondContact O-N 3.38Å; L42-V44 VanDerWaalsContact C-N 3.31Å; L42-V44 PolarHBondContact O-N 3Å; V44-I46 VanDerWaalsContact C-N 3.28Å; V44-I46 PolarHBondContact O-N 3.07Å; V44-A47 PolarHBondContact O-N 3.36Å; V44-F48 WeakPolarHBondContact O-CB 3.16Å; V44-F48 PolarHBondContact O-N 3.49Å
45I62.3Low59.9Low90 Ų90102.4 Ų102.446%0.46256%0.557SS.*Hα-helixtrans-63.8-28.9179.2-68161.6000112.6W41 L42 P49W41-I45 HydrophobicContact CE3-CD1 3.69Å; W41-I45 HydrophobicContact CE3-CG1 4.02Å; W41-I45 HydrophobicContact CZ3-CD1 4.24Å; W41-I45 HydrophobicContact CZ3-CG1 4.4Å; W41-I45 WeakPolarHBondContact O-CB 3.06Å; W41-I45 WeakPolarHBondContact O-CD1 3.02Å; W41-I45 WeakPolarHBondContact O-CG1 3.23Å; W41-I45 PolarHBondContact O-N 2.9Å; L42-I45 PolarHBondContact O-N 2.86Å; I45-P49 WeakPolarHBondContact O-CD 3.24Å; I45-P49 WeakPolarHBondContact O-CG 3.29Å
46I61.4Low61.8Low113 Ų11399 Ų9958%0.57954%0.538SS*.Hα-helixtrans-92.3-37.7178.9-63.9167.2000112.1L42 H43 V44 P49 T50L42-I46 WeakPolarHBondContact O-CB 3.31Å; L42-I46 VanDerWaalsContact O-CG1 3.28Å; L42-I46 WeakPolarHBondContact O-CG1 3.37Å; L42-I46 PolarHBondContact O-N 3.47Å; H43-I46 PolarHBondContact O-N 3.4Å; V44-I46 VanDerWaalsContact C-N 3.28Å; V44-I46 PolarHBondContact O-N 3.07Å; I46-P49 WeakPolarHBondContact O-CD 3.27Å; I46-T50 PolarHBondContact O-OG1 3.37Å
47A57.6Low63.5Low48 Ų4892.3 Ų92.340%0.39752%0.516SS..Hα-helixtrans-72.3-37.917900000111.7H43 V44 T50 S51H43-A47 WeakPolarHBondContact O-CA 3.27Å; H43-A47 WeakPolarHBondContact O-CB 3.43Å; H43-A47 PolarHBondContact O-N 2.79Å; V44-A47 PolarHBondContact O-N 3.36Å; A47-T50 PolarHBondContact O-N 3.46Å; A47-T50 VanDerWaalsContact O-N 3.17Å; A47-S51 WeakPolarHBondContact O-CB 3.17Å; A47-S51 PolarHBondContact O-N 2.92Å; A47-S51 PolarHBondContact O-OG 3.4Å
48F57.6Low65.1Low150 Ų15095.5 Ų95.566%0.65852%0.521SS*.Hα-helixtrans-62.7-40.1-178.4-157.6-89.6000112.3V44 T50 Y52V44-F48 WeakPolarHBondContact O-CB 3.16Å; V44-F48 PolarHBondContact O-N 3.49Å; F48-T50 PolarHBondContact O-N 3.38Å; F48-Y52 WeakPolarHBondContact O-CD1 3.3Å; F48-Y52 PolarHBondContact O-N 3Å
49P61.7Low67.3Low44 Ų44101.2 Ų101.229%0.28653%0.528SS..Hα-helixtrans-61.4-41.2171.1-28.536.2000115.6I45 I46 Y52 K53I45-P49 WeakPolarHBondContact O-CD 3.24Å; I45-P49 WeakPolarHBondContact O-CG 3.29Å; I46-P49 WeakPolarHBondContact O-CD 3.27Å; P49-Y52 HydrophobicContact CB-CD1 4.21Å; P49-Y52 HydrophobicContact CB-CE1 3.67Å; P49-Y52 HydrophobicContact CG-CE1 4.35Å; P49-Y52 WeakPolarHBondContact O-CD1 3.47Å; P49-Y52 WeakPolarHBondContact O-CE1 3.42Å; P49-K53 WeakPolarHBondContact O-CB 3.49Å; P49-K53 VanDerWaalsContact O-CG 3.28Å; P49-K53 WeakPolarHBondContact O-CG 3.26Å; P49-K53 PolarHBondContact O-N 2.87Å; P49-K53 VanDerWaalsContact O-N 3.12Å
50T60.4Low68.8Low86 Ų86101 Ų10153%0.52852%0.519SS..Hα-helixtrans-70.4-43.2-177.6-52.80000109.9I46 A47 F48 K53 V54I46-T50 PolarHBondContact O-OG1 3.37Å; A47-T50 PolarHBondContact O-N 3.46Å; A47-T50 VanDerWaalsContact O-N 3.17Å; F48-T50 PolarHBondContact O-N 3.38Å; T50-K53 PolarHBondContact O-N 3.34Å; T50-V54 VanDerWaalsContact O-CG2 3.3Å; T50-V54 WeakPolarHBondContact O-CG2 3.41Å; T50-V54 PolarHBondContact O-N 2.84Å; T50-V54 VanDerWaalsContact O-N 3.08Å
51S66.9Low70.3Confident70 Ų70100.2 Ų100.249%0.4951%0.513SS..Hα-helixtrans-64.5-44.6175.9-61.60000112.4A47 K53 V54 V55A47-S51 WeakPolarHBondContact O-CB 3.17Å; A47-S51 PolarHBondContact O-N 2.92Å; A47-S51 PolarHBondContact O-OG 3.4Å; S51-K53 VanDerWaalsContact C-N 3.31Å; S51-K53 PolarHBondContact O-N 2.73Å; S51-V54 PolarHBondContact O-N 3.34Å; S51-V55 VanDerWaalsContact O-CG2 3.32Å; S51-V55 WeakPolarHBondContact O-CG2 3.45Å; S51-V55 PolarHBondContact O-N 3.49Å
52Y75.1Confident71.9Confident108 Ų10899.2 Ų99.242%0.42451%0.51SS..Hα-helixtrans-63.8-39.3177.387.1-118.5000111.2F48 P49 V54 V55 I56F48-Y52 WeakPolarHBondContact O-CD1 3.3Å; F48-Y52 PolarHBondContact O-N 3Å; P49-Y52 HydrophobicContact CB-CD1 4.21Å; P49-Y52 HydrophobicContact CB-CE1 3.67Å; P49-Y52 HydrophobicContact CG-CE1 4.35Å; P49-Y52 WeakPolarHBondContact O-CD1 3.47Å; P49-Y52 WeakPolarHBondContact O-CE1 3.42Å; Y52-V54 VanDerWaalsContact C-N 3.29Å; Y52-V54 PolarHBondContact O-N 2.79Å; Y52-V55 PolarHBondContact O-N 3.02Å; Y52-I56 HydrophobicContact CD2-CD1 3.62Å; Y52-I56 HydrophobicContact CD2-CG1 4.46Å; Y52-I56 HydrophobicContact CE2-CD1 4.25Å; Y52-I56 WeakPolarHBondContact O-CB 3.33Å; Y52-I56 VanDerWaalsContact O-CG1 3.23Å; Y52-I56 WeakPolarHBondContact O-CG1 3.37Å; Y52-I56 PolarHBondContact O-N 3.16Å
53K75.9Confident73.2Confident121 Ų12199.1 Ų99.153%0.52651%0.509SS..Hα-helixtrans-62.7-40.7179-77-178.3-178.9178.40111P49 T50 S51 T57P49-K53 WeakPolarHBondContact O-CB 3.49Å; P49-K53 VanDerWaalsContact O-CG 3.28Å; P49-K53 WeakPolarHBondContact O-CG 3.26Å; P49-K53 PolarHBondContact O-N 2.87Å; P49-K53 VanDerWaalsContact O-N 3.12Å; T50-K53 PolarHBondContact O-N 3.34Å; S51-K53 VanDerWaalsContact C-N 3.31Å; S51-K53 PolarHBondContact O-N 2.73Å; K53-T57 VanDerWaalsContact O-CB 3.26Å; K53-T57 WeakPolarHBondContact O-CB 3.26Å; K53-T57 PolarHBondContact O-N 3.5Å; K53-T57 PolarHBondContact O-OG1 3.44Å
54V75.1Confident74.4Confident78 Ų78100.2 Ų100.247%0.47351%0.508SS..Hα-helixtrans-64.8-47.8175.91730000110.7T50 S51 Y52 I56 T57 L58T50-V54 VanDerWaalsContact O-CG2 3.3Å; T50-V54 WeakPolarHBondContact O-CG2 3.41Å; T50-V54 PolarHBondContact O-N 2.84Å; T50-V54 VanDerWaalsContact O-N 3.08Å; S51-V54 PolarHBondContact O-N 3.34Å; Y52-V54 VanDerWaalsContact C-N 3.29Å; Y52-V54 PolarHBondContact O-N 2.79Å; V54-I56 PolarHBondContact O-N 3.31Å; V54-T57 PolarHBondContact O-N 2.89Å; V54-L58 HydrophobicContact CG1-CD1 3.83Å; V54-L58 HydrophobicContact CG1-CG 4.35Å; V54-L58 WeakPolarHBondContact O-CB 3.44Å; V54-L58 VanDerWaalsContact O-CG 3.28Å; V54-L58 WeakPolarHBondContact O-CG 3.44Å; V54-L58 PolarHBondContact O-N 2.84Å
55V79.1Confident75.4Confident93 Ų93100.4 Ų100.456%0.56451%0.509SS*.Hα-helixtrans-62.9-44.9179.5173.70000111.9S51 Y52 T57 L58 W59S51-V55 VanDerWaalsContact O-CG2 3.32Å; S51-V55 WeakPolarHBondContact O-CG2 3.45Å; S51-V55 PolarHBondContact O-N 3.49Å; Y52-V55 PolarHBondContact O-N 3.02Å; V55-T57 VanDerWaalsContact C-N 3.33Å; V55-T57 PolarHBondContact O-N 2.84Å; V55-L58 PolarHBondContact O-N 2.9Å; V55-W59 WeakPolarHBondContact O-CB 3.29Å; V55-W59 PolarHBondContact O-N 2.96Å
56I82.8Confident76.2Confident82 Ų8298.1 Ų98.142%0.42150%0.501SS..Hα-helixtrans-62.6-43.3176.6-68.6177.3000110.4Y52 V54 W59 I60Y52-I56 HydrophobicContact CD2-CD1 3.62Å; Y52-I56 HydrophobicContact CD2-CG1 4.46Å; Y52-I56 HydrophobicContact CE2-CD1 4.25Å; Y52-I56 WeakPolarHBondContact O-CB 3.33Å; Y52-I56 VanDerWaalsContact O-CG1 3.23Å; Y52-I56 WeakPolarHBondContact O-CG1 3.37Å; Y52-I56 PolarHBondContact O-N 3.16Å; V54-I56 PolarHBondContact O-N 3.31Å; I56-W59 PolarHBondContact O-N 2.97Å; I56-I60 HydrophobicContact CG2-CD1 3.7Å; I56-I60 HydrophobicContact CG2-CG1 4.33Å; I56-I60 WeakPolarHBondContact O-CB 3.35Å; I56-I60 VanDerWaalsContact O-CG1 3.22Å; I56-I60 WeakPolarHBondContact O-CG1 3.38Å; I56-I60 PolarHBondContact O-N 3.47Å
57T79.4Confident77.1Confident82 Ų8296.9 Ų96.950%0.50350%0.495SS..Hα-helixtrans-64.2-43.8178.7-56.30000111.1K53 V54 V55 W59 I60 V61K53-T57 VanDerWaalsContact O-CB 3.26Å; K53-T57 WeakPolarHBondContact O-CB 3.26Å; K53-T57 PolarHBondContact O-N 3.5Å; K53-T57 PolarHBondContact O-OG1 3.44Å; V54-T57 PolarHBondContact O-N 2.89Å; V55-T57 VanDerWaalsContact C-N 3.33Å; V55-T57 PolarHBondContact O-N 2.84Å; T57-W59 PolarHBondContact O-N 3.46Å; T57-I60 PolarHBondContact O-N 2.9Å; T57-V61 VanDerWaalsContact O-CG2 3.29Å; T57-V61 WeakPolarHBondContact O-CG2 3.47Å; T57-V61 PolarHBondContact O-N 2.92Å
58L82.1Confident78.2Confident113 Ų11399.4 Ų99.459%0.59250%0.501SS*.Hα-helixtrans-62.6-41.6175.5-73171.8000111.7V54 V55 V61 Y62V54-L58 HydrophobicContact CG1-CD1 3.83Å; V54-L58 HydrophobicContact CG1-CG 4.35Å; V54-L58 WeakPolarHBondContact O-CB 3.44Å; V54-L58 VanDerWaalsContact O-CG 3.28Å; V54-L58 WeakPolarHBondContact O-CG 3.44Å; V54-L58 PolarHBondContact O-N 2.84Å; V55-L58 PolarHBondContact O-N 2.9Å; L58-V61 PolarHBondContact O-N 3.06Å; L58-Y62 VanDerWaalsContact O-CB 3.23Å; L58-Y62 WeakPolarHBondContact O-CB 3.33Å; L58-Y62 PolarHBondContact O-N 2.98Å
59W84.8Confident78.9Confident168 Ų16899.8 Ų99.864%0.63650%0.503SS*.Hα-helixtrans-65.4-41.3177.1-173.260.6000112.1V55 I56 T57 Y62 L63V55-W59 WeakPolarHBondContact O-CB 3.29Å; V55-W59 PolarHBondContact O-N 2.96Å; I56-W59 PolarHBondContact O-N 2.97Å; T57-W59 PolarHBondContact O-N 3.46Å; W59-Y62 PolarHBondContact O-N 3.18Å; W59-L63 VanDerWaalsContact O-CB 3.29Å; W59-L63 WeakPolarHBondContact O-CB 3.28Å; W59-L63 PolarHBondContact O-N 3.32Å
60I88.3Confident79.3Confident80 Ų80102 Ų10241%0.4152%0.516SS..Hα-helixtrans-62.3-48.9174.3-70167.8000110.3I56 T57 Y62 L63 W64I56-I60 HydrophobicContact CG2-CD1 3.7Å; I56-I60 HydrophobicContact CG2-CG1 4.33Å; I56-I60 WeakPolarHBondContact O-CB 3.35Å; I56-I60 VanDerWaalsContact O-CG1 3.22Å; I56-I60 WeakPolarHBondContact O-CG1 3.38Å; I56-I60 PolarHBondContact O-N 3.47Å; T57-I60 PolarHBondContact O-N 2.9Å; I60-Y62 VanDerWaalsContact C-N 3.32Å; I60-Y62 PolarHBondContact O-N 3.45Å; I60-L63 PolarHBondContact O-N 2.93Å; I60-W64 WeakPolarHBondContact O-CB 3.28Å; I60-W64 VanDerWaalsContact O-CD1 3.26Å; I60-W64 PolarHBondContact O-N 3.2Å
61V89.1Confident79.8Confident80 Ų80102.1 Ų102.149%0.48551%0.512SS..Hα-helixtrans-60.9-43.8178.5171.50000110.5T57 L58 W64 V65T57-V61 VanDerWaalsContact O-CG2 3.29Å; T57-V61 WeakPolarHBondContact O-CG2 3.47Å; T57-V61 PolarHBondContact O-N 2.92Å; L58-V61 PolarHBondContact O-N 3.06Å; V61-W64 PolarHBondContact O-N 2.93Å; V61-V65 HydrophobicContact CG1-CG2 4.33Å; V61-V65 VanDerWaalsContact O-CG2 3.3Å; V61-V65 WeakPolarHBondContact O-CG2 3.38Å; V61-V65 PolarHBondContact O-N 3.29Å
62Y87.2Confident79.5Confident160 Ų160104.8 Ų104.863%0.62752%0.515SS*.Hα-helixtrans-62.1-44177.2-179-99.2000112.4L58 W59 I60 W64 V65 S66L58-Y62 VanDerWaalsContact O-CB 3.23Å; L58-Y62 WeakPolarHBondContact O-CB 3.33Å; L58-Y62 PolarHBondContact O-N 2.98Å; W59-Y62 PolarHBondContact O-N 3.18Å; I60-Y62 VanDerWaalsContact C-N 3.32Å; I60-Y62 PolarHBondContact O-N 3.45Å; Y62-W64 VanDerWaalsContact C-N 3.34Å; Y62-W64 PolarHBondContact O-N 3.43Å; Y62-V65 PolarHBondContact O-N 2.91Å; Y62-S66 VanDerWaalsContact O-CB 3.28Å; Y62-S66 WeakPolarHBondContact O-CB 3.23Å; Y62-S66 PolarHBondContact O-N 3.4Å; Y62-S66 PolarHBondContact O-OG 3.18Å
63L86.8Confident78.5Confident94 Ų94110.2 Ų110.249%0.49254%0.535SS..Hα-helixtrans-62.9-42.2176.1-17268.9000111W59 I60 S66 L67W59-L63 VanDerWaalsContact O-CB 3.29Å; W59-L63 WeakPolarHBondContact O-CB 3.28Å; W59-L63 PolarHBondContact O-N 3.32Å; I60-L63 PolarHBondContact O-N 2.93Å; L63-S66 PolarHBondContact O-N 3.1Å; L63-L67 VanDerWaalsContact O-CB 3.28Å; L63-L67 WeakPolarHBondContact O-CB 3.33Å; L63-L67 PolarHBondContact O-N 2.86Å
64W85.6Confident77.4Confident162 Ų162107.9 Ų107.961%0.61453%0.534SS*.Hα-helixtrans-65.7-43176.4-91.193.3000112.8I60 V61 Y62 S66 L67 L68I60-W64 WeakPolarHBondContact O-CB 3.28Å; I60-W64 VanDerWaalsContact O-CD1 3.26Å; I60-W64 PolarHBondContact O-N 3.2Å; V61-W64 PolarHBondContact O-N 2.93Å; Y62-W64 VanDerWaalsContact C-N 3.34Å; Y62-W64 PolarHBondContact O-N 3.43Å; W64-S66 VanDerWaalsContact C-N 3.34Å; W64-L67 PolarHBondContact O-N 3.4Å; W64-L68 HydrophobicContact CE3-CD1 3.74Å; W64-L68 HydrophobicContact CZ3-CD1 4.26Å; W64-L68 WeakPolarHBondContact O-CB 3.21Å; W64-L68 VanDerWaalsContact O-CD1 3.29Å; W64-L68 WeakPolarHBondContact O-CD1 3.47Å; W64-L68 PolarHBondContact O-N 3.43Å
65V83.1Confident76.2Confident86 Ų86112.5 Ų112.552%0.52154%0.543SS..Hα-helixtrans-65.3-40176.3171.10000110.6V61 Y62 L68 K69V61-V65 HydrophobicContact CG1-CG2 4.33Å; V61-V65 VanDerWaalsContact O-CG2 3.3Å; V61-V65 WeakPolarHBondContact O-CG2 3.38Å; V61-V65 PolarHBondContact O-N 3.29Å; Y62-V65 PolarHBondContact O-N 2.91Å; V65-L68 PolarHBondContact O-N 3.26Å; V65-K69 WeakPolarHBondContact O-CB 3.27Å; V65-K69 PolarHBondContact O-N 3.25Å
66S80.8Confident74.8Confident42 Ų42113.4 Ų113.429%0.29455%0.545SS..Hα-helixtrans-66.3-41.4176.6-60.10000111.7Y62 L63 W64 K69 T70Y62-S66 VanDerWaalsContact O-CB 3.28Å; Y62-S66 WeakPolarHBondContact O-CB 3.23Å; Y62-S66 PolarHBondContact O-N 3.4Å; Y62-S66 PolarHBondContact O-OG 3.18Å; L63-S66 PolarHBondContact O-N 3.1Å; W64-S66 VanDerWaalsContact C-N 3.34Å; S66-K69 PolarHBondContact O-N 2.94Å; S66-T70 WeakPolarHBondContact O-CG2 3.5Å; S66-T70 PolarHBondContact O-N 3.42Å; S66-T70 PolarHBondContact O-OG1 2.96Å; S66-T70 VanDerWaalsContact O-OG1 3.06Å
67L79Confident73.2Confident87 Ų87112.2 Ų112.246%0.45555%0.552SS.*Hα-helixtrans-67.2-42.3174.5-167112.1000111.7L63 W64 K69 T70 I71L63-L67 VanDerWaalsContact O-CB 3.28Å; L63-L67 WeakPolarHBondContact O-CB 3.33Å; L63-L67 PolarHBondContact O-N 2.86Å; W64-L67 PolarHBondContact O-N 3.4Å; L67-K69 VanDerWaalsContact C-N 3.32Å; L67-K69 PolarHBondContact O-N 2.79Å; L67-T70 WeakPolarHBondContact CA-OG1 3.32Å; L67-T70 PolarHBondContact O-N 3.41Å; L67-T70 PolarHBondContact O-OG1 3.38Å; L67-I71 HydrophobicContact CD2-CD1 3.68Å; L67-I71 HydrophobicContact CG-CD1 4.01Å; L67-I71 WeakPolarHBondContact O-CB 3.23Å; L67-I71 WeakPolarHBondContact O-CD1 3.46Å; L67-I71 VanDerWaalsContact O-CG1 3.23Å; L67-I71 WeakPolarHBondContact O-CG1 3.22Å; L67-I71 PolarHBondContact O-N 2.81Å
68L80.7Confident71.8Confident102 Ų102113.6 Ų113.653%0.53455%0.553SS.*Hα-helixtrans-61.8-42.9173.6-103.680.8000111W64 V65 I71 F72W64-L68 HydrophobicContact CE3-CD1 3.74Å; W64-L68 HydrophobicContact CZ3-CD1 4.26Å; W64-L68 WeakPolarHBondContact O-CB 3.21Å; W64-L68 VanDerWaalsContact O-CD1 3.29Å; W64-L68 WeakPolarHBondContact O-CD1 3.47Å; W64-L68 PolarHBondContact O-N 3.43Å; V65-L68 PolarHBondContact O-N 3.26Å; L68-I71 PolarHBondContact O-N 3.41Å; L68-F72 VanDerWaalsContact O-CB 3.27Å; L68-F72 WeakPolarHBondContact O-CB 3.3Å; L68-F72 PolarHBondContact O-N 3.42Å
69K73.6Confident70.2Confident157 Ų157114.8 Ų114.868%0.68356%0.56SS**Hα-helixtrans-63.3-43.7180-171.6162.8175.2135.20111.2V65 S66 L67 F72 W73V65-K69 WeakPolarHBondContact O-CB 3.27Å; V65-K69 PolarHBondContact O-N 3.25Å; S66-K69 PolarHBondContact O-N 2.94Å; L67-K69 VanDerWaalsContact C-N 3.32Å; L67-K69 PolarHBondContact O-N 2.79Å; K69-F72 PolarHBondContact O-N 3.34Å; K69-W73 VanDerWaalsContact O-CB 3.26Å; K69-W73 WeakPolarHBondContact O-CB 3.34Å; K69-W73 PolarHBondContact O-N 3Å
70T70.3Confident68.7Low91 Ų91109.3 Ų109.356%0.55856%0.556SS**Hα-helixtrans-64.5-41.8175.249.50000112.8S66 L67 S74S66-T70 WeakPolarHBondContact O-CG2 3.5Å; S66-T70 PolarHBondContact O-N 3.42Å; S66-T70 PolarHBondContact O-OG1 2.96Å; S66-T70 VanDerWaalsContact O-OG1 3.06Å; L67-T70 WeakPolarHBondContact CA-OG1 3.32Å; L67-T70 PolarHBondContact O-N 3.41Å; L67-T70 PolarHBondContact O-OG1 3.38Å; T70-S74 WeakPolarHBondContact O-CB 3.41Å; T70-S74 PolarHBondContact O-N 2.89Å
71I70.8Confident67Low89 Ų89108.8 Ų108.846%0.45656%0.559SS.*Hα-helixtrans-66.9-39.7176.3-67.3167000111.7L67 L68 S74 R75L67-I71 HydrophobicContact CD2-CD1 3.68Å; L67-I71 HydrophobicContact CG-CD1 4.01Å; L67-I71 WeakPolarHBondContact O-CB 3.23Å; L67-I71 WeakPolarHBondContact O-CD1 3.46Å; L67-I71 VanDerWaalsContact O-CG1 3.23Å; L67-I71 WeakPolarHBondContact O-CG1 3.22Å; L67-I71 PolarHBondContact O-N 2.81Å; L68-I71 PolarHBondContact O-N 3.41Å; I71-S74 PolarHBondContact O-N 3.44Å; I71-S74 PolarHBondContact O-OG 3.47Å; I71-R75 PolarHBondContact O-N 2.82Å; I71-R75 VanDerWaalsContact O-N 3.14Å
72F60.7Low65.4Low126 Ų126108.1 Ų108.155%0.55356%0.555SS**Hα-helixtrans-74-35.7-178.9-147.4-96.9000111.4L68 K69 R75 N76L68-F72 VanDerWaalsContact O-CB 3.27Å; L68-F72 WeakPolarHBondContact O-CB 3.3Å; L68-F72 PolarHBondContact O-N 3.42Å; K69-F72 PolarHBondContact O-N 3.34Å; F72-R75 PolarHBondContact O-N 2.79Å; F72-N76 VanDerWaalsContact CE1-ND2 3.32Å; F72-N76 WeakPolarHBondContact CE1-ND2 3.21Å; F72-N76 PolarHBondContact O-N 2.89Å
73W53Low64Low222 Ų222104.3 Ų104.384%0.84155%0.546SS*.Hα-helixtrans-67.3-37.6172.6-141.844.1000111.7K69 R75 G77K69-W73 VanDerWaalsContact O-CB 3.26Å; K69-W73 WeakPolarHBondContact O-CB 3.34Å; K69-W73 PolarHBondContact O-N 3Å; W73-R75 PolarHBondContact O-N 3.14Å; W73-G77 PolarHBondContact O-N 3.46Å
74S53.7Low62.6Low71 Ų71104.4 Ų104.450%0.49755%0.55SS..Hα-helixtrans-67.6-20.5172.983.60000113.4T70 I71 H78T70-S74 WeakPolarHBondContact O-CB 3.41Å; T70-S74 PolarHBondContact O-N 2.89Å; I71-S74 PolarHBondContact O-N 3.44Å; I71-S74 PolarHBondContact O-OG 3.47Å; S74-H78 PolarHBondContact O-CD2 3.44Å
75R49.5Very low61.2Low175 Ų175103.5 Ų103.566%0.6655%0.553SS**Hα-helixtrans-91.5-35.9178.1-164135.586.6179.38.3112.9I71 F72 W73I71-R75 PolarHBondContact O-N 2.82Å; I71-R75 VanDerWaalsContact O-N 3.14Å; F72-R75 PolarHBondContact O-N 2.79Å; W73-R75 PolarHBondContact O-N 3.14Å
76N49.1Very low60Low113 Ų113104.2 Ų104.260%0.60455%0.55SS**Hα-helixtrans-83.4-17.7-178.9-77.710.1000114.3F72F72-N76 VanDerWaalsContact CE1-ND2 3.32Å; F72-N76 WeakPolarHBondContact CE1-ND2 3.21Å; F72-N76 PolarHBondContact O-N 2.89Å
77G49.6Very low59Low56 Ų56110.4 Ų110.458%0.57757%0.567SS**SBendtrans-91.7-8.2179.100000115.8W73W73-G77 PolarHBondContact O-N 3.46Å
78H50.3Low58Low111 Ų111108.7 Ų108.751%0.51457%0.565SS.*SBendtrans-102.3-8.5-168.4-94-35.1000116.2S74 T82S74-H78 PolarHBondContact O-CD2 3.44Å; H78-T82 PolarHBondContact O-OG1 3.26Å
79D48.6Very low56.8Low138 Ų138111.3 Ų111.374%0.73857%0.569SS**THydrogen-bonded Turntrans-81.9-17.4-172.7-74.5-13.8000114.1
80G53.4Low56Low54 Ų54111.2 Ų111.256%0.55756%0.564SS**THydrogen-bonded Turntrans-99.1-37.9176.500000114.9
81S52.8Low55.4Low68 Ų68110.4 Ų110.448%0.47656%0.562SS.*Hα-helixtrans-79.7-32.8-171.5174.90000113.2Q85S81-Q85 WeakPolarHBondContact O-CB 3.29Å; S81-Q85 VanDerWaalsContact O-CG 3.27Å; S81-Q85 WeakPolarHBondContact O-CG 3.35Å; S81-Q85 PolarHBondContact O-N 2.83Å
82T54.8Low54.8Low67 Ų67111.1 Ų111.141%0.41157%0.566SS.*Hα-helixtrans-71.1-35.1-178.752.10000112.3H78 Q86H78-T82 PolarHBondContact O-OG1 3.26Å; T82-Q86 WeakPolarHBondContact O-CB 3.42Å; T82-Q86 PolarHBondContact O-N 2.94Å
83D58.7Low54.6Low79 Ų79111.6 Ų111.642%0.42257%0.565SS.*Hα-helixtrans-66.4-42.5176.5-171.565000111.8Q86 R87D83-Q86 PolarHBondContact O-N 3.38Å; D83-R87 WeakPolarHBondContact O-CB 3.35Å; D83-R87 PolarHBondContact O-N 2.88Å; D83-R87 IonicContact OD2-CZ 3.7Å; D83-R87 IonicContact OD2-NH1 3.38Å; D83-R87 PolarHBondContact OD2-NH1 2.89Å; D83-R87 IonicContact OD2-NH2 3.95Å
84V57.5Low54.8Low96 Ų96110.8 Ų110.858%0.58256%0.562SS**Hα-helixtrans-67.3-45.3178.3-179.60000111.3Q86 R87 A88V84-Q86 VanDerWaalsContact C-N 3.34Å; V84-Q86 PolarHBondContact O-N 3.31Å; V84-R87 PolarHBondContact O-N 2.86Å; V84-A88 WeakPolarHBondContact O-CB 3.46Å; V84-A88 PolarHBondContact O-N 2.84Å
85Q55.1Low54.7Low144 Ų144116.9 Ų116.967%0.67357%0.573SS**Hα-helixtrans-63.6-39.3176-73.2-101.2-43.400111.6S81 W89S81-Q85 WeakPolarHBondContact O-CB 3.29Å; S81-Q85 VanDerWaalsContact O-CG 3.27Å; S81-Q85 WeakPolarHBondContact O-CG 3.35Å; S81-Q85 PolarHBondContact O-N 2.83Å; Q85-W89 VanDerWaalsContact O-CB 3.26Å; Q85-W89 WeakPolarHBondContact O-CB 3.3Å; Q85-W89 PolarHBondContact O-N 3.42Å
86Q58Low54.7Low101 Ų101113.7 Ų113.747%0.47257%0.566SS.*Hα-helixtrans-74.9-31.8179.4-168155.3-39.100112.5T82 D83 V84 R90T82-Q86 WeakPolarHBondContact O-CB 3.42Å; T82-Q86 PolarHBondContact O-N 2.94Å; D83-Q86 PolarHBondContact O-N 3.38Å; V84-Q86 VanDerWaalsContact C-N 3.34Å; V84-Q86 PolarHBondContact O-N 3.31Å; Q86-R90 WeakPolarHBondContact O-CB 3.23Å; Q86-R90 WeakPolarHBondContact O-CG 3.42Å; Q86-R90 PolarHBondContact O-N 3.39Å
87R60.4Low54.9Low171 Ų171114 Ų11465%0.64556%0.564SS**Hα-helixtrans-69.8-42.2171.7-172.9176.7-88.4147.6-3.7111.3D83 V84 R90 S91D83-R87 WeakPolarHBondContact O-CB 3.35Å; D83-R87 PolarHBondContact O-N 2.88Å; D83-R87 IonicContact OD2-CZ 3.7Å; D83-R87 IonicContact OD2-NH1 3.38Å; D83-R87 PolarHBondContact OD2-NH1 2.89Å; D83-R87 IonicContact OD2-NH2 3.95Å; V84-R87 PolarHBondContact O-N 2.86Å; R87-R90 PolarHBondContact O-N 3.35Å; R87-S91 PolarHBondContact O-N 3.37Å; R87-S91 VanDerWaalsContact O-N 3.08Å
88A57.2Low55.1Low51 Ų51114.1 Ų114.142%0.42157%0.565SS.*Hα-helixtrans-64.9-39.4172.600000112.2V84 S91 N92V84-A88 WeakPolarHBondContact O-CB 3.46Å; V84-A88 PolarHBondContact O-N 2.84Å; A88-S91 PolarHBondContact O-N 2.85Å; A88-S91 PolarHBondContact O-OG 3.49Å; A88-N92 PolarHBondContact O-N 3.3Å
89W56.6Low54.9Low158 Ų158115 Ų11560%0.59857%0.573SS**Hα-helixtrans-67.2-40.1176.5-169.982.2000112.5Q85 S91 N92 R93Q85-W89 VanDerWaalsContact O-CB 3.26Å; Q85-W89 WeakPolarHBondContact O-CB 3.3Å; Q85-W89 PolarHBondContact O-N 3.42Å; W89-S91 VanDerWaalsContact C-N 3.35Å; W89-N92 PolarHBondContact O-N 2.83Å; W89-R93 WeakPolarHBondContact O-CB 3.29Å; W89-R93 PolarHBondContact O-N 3.44Å
90R56.3Low54.8Low155 Ų155117.7 Ų117.759%0.58557%0.573SS**Hα-helixtrans-65.2-34.8174.1-79.5-176-177.3149.6-0.8112.8Q86 R87 R94Q86-R90 WeakPolarHBondContact O-CB 3.23Å; Q86-R90 WeakPolarHBondContact O-CG 3.42Å; Q86-R90 PolarHBondContact O-N 3.39Å; R87-R90 PolarHBondContact O-N 3.35Å; R90-R94 PolarHBondContact O-N 2.89Å
91S57.3Low54.5Low74 Ų74120 Ų12052%0.51758%0.58SS.*Hα-helixtrans-73.4-39.6177.891.80000112.1R87 A88 W89 R93 R94 R95R87-S91 PolarHBondContact O-N 3.37Å; R87-S91 VanDerWaalsContact O-N 3.08Å; A88-S91 PolarHBondContact O-N 2.85Å; A88-S91 PolarHBondContact O-OG 3.49Å; W89-S91 VanDerWaalsContact C-N 3.35Å; S91-R93 PolarHBondContact O-N 3.4Å; S91-R94 PolarHBondContact O-N 3.36Å; S91-R95 PolarHBondContact O-N 3.28Å
92N58.8Low54.4Low103 Ų103123.7 Ų123.755%0.55159%0.593SS**Hα-helixtrans-69.4-31.1176.5-103.6-31.8000113.1A88 W89 R95 Q96A88-N92 PolarHBondContact O-N 3.3Å; W89-N92 PolarHBondContact O-N 2.83Å; N92-R95 PolarHBondContact O-N 2.85Å; N92-Q96 WeakPolarHBondContact O-CB 3.05Å; N92-Q96 PolarHBondContact O-N 3.5Å
93R55.7Low54Low136 Ų136125.5 Ų125.551%0.51361%0.608SS.*Hα-helixtrans-65-42.9176-168.1169.7-173.8170.13.8112.2W89 S91 Q96 E97W89-R93 WeakPolarHBondContact O-CB 3.29Å; W89-R93 PolarHBondContact O-N 3.44Å; S91-R93 PolarHBondContact O-N 3.4Å; R93-Q96 PolarHBondContact O-N 2.86Å; R93-E97 IonicContact NE-OE1 3.76Å; R93-E97 WeakPolarHBondContact O-CG 3.37Å; R93-E97 PolarHBondContact O-N 2.91Å; R93-E97 VanDerWaalsContact O-N 3.08Å
94R57.2Low53.5Low206 Ų206130.4 Ų130.478%0.77763%0.63SS**Hα-helixtrans-66-35.6174.9-71-170.5-176.1-172.31.1112.7R90 S91R90-R94 PolarHBondContact O-N 2.89Å; S91-R94 PolarHBondContact O-N 3.36Å
95R52.2Low52.6Low198 Ų198133.7 Ų133.775%0.74764%0.639SS**Hα-helixtrans-69.6-34.1174.3-111.2-171.8-173.3-168.52.6113.2S91 N92S91-R95 PolarHBondContact O-N 3.28Å; N92-R95 PolarHBondContact O-N 2.85Å
96Q50.3Low52.5Low109 Ų109133 Ų13351%0.50965%0.645SS.*Hα-helixtrans-75.3-28.8176.6-81-124.9-1600113.6N92 R93 G98 L99 R100N92-Q96 WeakPolarHBondContact O-CB 3.05Å; N92-Q96 PolarHBondContact O-N 3.5Å; R93-Q96 PolarHBondContact O-N 2.86Å; Q96-G98 PolarHBondContact O-N 2.84Å; Q96-L99 PolarHBondContact O-N 3.44Å; Q96-R100 WeakPolarHBondContact O-CB 3.41Å; Q96-R100 VanDerWaalsContact O-CG 3.25Å; Q96-R100 WeakPolarHBondContact O-CG 3.34Å; Q96-R100 PolarHBondContact O-N 3.21Å
97E52.3Low51.5Low118 Ų118137.5 Ų137.555%0.55166%0.663SS**Hα-helixtrans-65.1-26.4174.9-78.1160-174.600112.2R93R93-E97 IonicContact NE-OE1 3.76Å; R93-E97 WeakPolarHBondContact O-CG 3.37Å; R93-E97 PolarHBondContact O-N 2.91Å; R93-E97 VanDerWaalsContact O-N 3.08Å
98G53Low50.7Low59 Ų59139.1 Ų139.161%0.60868%0.675SS**Hα-helixtrans-82.2-21.4171.600000115.8Q96Q96-G98 PolarHBondContact O-N 2.84Å
99L45.9Very low50.1Low129 Ų129148.1 Ų148.168%0.67570%0.698SS**Hα-helixtrans-99-11.9179.4-79.7166.3000113.6Q96 S101 I102Q96-L99 PolarHBondContact O-N 3.44Å; L99-S101 PolarHBondContact O-N 3.4Å; L99-I102 PolarHBondContact O-N 2.85Å
100R46.6Very low49.2Very low196 Ų196147 Ų14774%0.7471%0.708SS**THydrogen-bonded Turntrans-73.5-5.9-177-91.1176.9178.7-149.9-2115.1Q96Q96-R100 WeakPolarHBondContact O-CB 3.41Å; Q96-R100 VanDerWaalsContact O-CG 3.25Å; Q96-R100 WeakPolarHBondContact O-CG 3.34Å; Q96-R100 PolarHBondContact O-N 3.21Å
101S48.1Very low49.2Very low102 Ų102144.8 Ų144.871%0.71372%0.716SS**THydrogen-bonded Turntrans-85.1-9.5172.455.50000113.6L99L99-S101 PolarHBondContact O-N 3.4Å
102I49.4Very low48.9Very low145 Ų145145.9 Ų145.974%0.74472%0.724SS**SBendtrans-137.591-178.2-48.7174.5000109.4L99L99-I102 PolarHBondContact O-N 2.85Å
103C47.1Very low48.2Very low106 Ų106149.4 Ų149.472%0.71673%0.734SS**  trans146.387.3152.1-173.60000110.5
104M48.4Very low47.9Very low182 Ų182155.2 Ų155.290%0.89776%0.756SS**  trans-86.1102149.3-79.8-139.879.400107.6
105H39.7Very low47.5Very low164 Ų164147.8 Ų147.876%0.75974%0.744SS**  trans-133.4120.4153.9-92-74000111.1K107H105-K107 PolarHBondContact O-N 2.86Å
106T51.3Low47.6Very low130 Ų130145 Ų14580%0.79874%0.744SS**  trans-29.6108.1172.342.20000115.2
107K36.9Very low47.9Very low195 Ų195146.3 Ų146.385%0.84875%0.748SS**  trans-113.796152.7-91.1-177.3176.7176.30109.5H105 R109H105-K107 PolarHBondContact O-N 2.86Å; K107-R109 PolarHBondContact O-N 3.49Å
108K45.2Very low48.2Very low206 Ų206146.7 Ų146.790%0.89675%0.753SS**  trans-53109.6160.5-84.8-177175.6177.20107.6V110K108-V110 PolarHBondContact O-N 2.96Å
109R43Very low48.4Very low240 Ų240148.6 Ų148.691%0.90675%0.752SS**  trans-86.9107.2164.2-74.7-167.9178.9-169.1-0.1107.8K107 S111K107-R109 PolarHBondContact O-N 3.49Å; R109-S111 PolarHBondContact O-N 3.4Å
110V38.7Very low49.5Very low135 Ų135147.6 Ų147.682%0.81875%0.747SS**  trans-53.8124.6167.8175.20000108.4K108K108-V110 PolarHBondContact O-N 2.96Å
111S56.1Low50.5Low108 Ų108144.8 Ų144.876%0.75574%0.74SS**  trans-66.5129.6173.551.80000110.8R109R109-S111 PolarHBondContact O-N 3.4Å
112S51.3Low51.6Low97 Ų97144.5 Ų144.568%0.67873%0.73SS**  trans-154.1145.2151.5580000111.1
113F44.7Very low52.7Low176 Ų176141.6 Ų141.677%0.77272%0.72SS**  trans8770.1-177.5-62.6-82000117.2
114R48.3Very low54.2Low258 Ų258140 Ų14097%0.97470%0.703SS**  trans-95.254.7162-165.4-175.6-172.1-140.33.4109.9
115G48.5Very low55.7Low51 Ų51135.2 Ų135.253%0.52668%0.684SS.*SBendtrans-119.2-55.6-178.500000113.8
116N55.8Low57.6Low139 Ų139132.7 Ų132.774%0.74368%0.676SS**SBendtrans-102.55.1-170.1-80.810.7000115.8I118 L120N116-I118 PolarHBondContact O-N 3.12Å; N116-L120 PolarHBondContact O-N 3.27Å
117K56Low59.2Low136 Ų136134.6 Ų134.659%0.59167%0.668SS**Hα-helixtrans-76.6-21.9-174.5-68.4-178.9-176173.60113.6K121K117-K121 VanDerWaalsContact O-CB 3.31Å; K117-K121 WeakPolarHBondContact O-CB 3.44Å; K117-K121 VanDerWaalsContact O-CD 3.23Å; K117-K121 WeakPolarHBondContact O-CD 3.28Å; K117-K121 WeakPolarHBondContact O-CG 3.39Å; K117-K121 PolarHBondContact O-N 3.36Å
118I59Low61.4Low126 Ų126133.4 Ų133.465%0.64666%0.659SS**Hα-helixtrans-77.4-55.1-177.2-61.4169.7000109.3N116 L120 K121 D122N116-I118 PolarHBondContact O-N 3.12Å; I118-L120 PolarHBondContact O-N 3.3Å; I118-K121 WeakPolarHBondContact O-CB 3.35Å; I118-K121 PolarHBondContact O-N 3.42Å; I118-K121 VanDerWaalsContact O-N 3.14Å; I118-D122 VanDerWaalsContact O-CG 3.32Å; I118-D122 PolarHBondContact O-N 2.83Å
119V56.7Low63.2Low99 Ų99128 Ų12860%0.664%0.636SS**Hα-helixtrans-59.6-43.8-179.7-176.80000112.4K121 D122 V123V119-K121 PolarHBondContact O-N 2.93Å; V119-D122 PolarHBondContact O-N 2.95Å; V119-V123 HydrophobicContact CG1-CG2 4.48Å; V119-V123 VanDerWaalsContact O-CG2 3.27Å; V119-V123 WeakPolarHBondContact O-CG2 3.35Å; V119-V123 PolarHBondContact O-N 2.65Å
120L68.5Low65.3Low108 Ų108120.2 Ų120.257%0.56562%0.615SS**Hα-helixtrans-66.7-38.3179-177.763.2000112.1N116 I118 D122 I124N116-L120 PolarHBondContact O-N 3.27Å; I118-L120 PolarHBondContact O-N 3.3Å; L120-D122 VanDerWaalsContact C-N 3.34Å; L120-I124 HydrophobicContact CD1-CD1 4.01Å; L120-I124 HydrophobicContact CD1-CG1 4.32Å; L120-I124 HydrophobicContact CD2-CD1 4.49Å; L120-I124 HydrophobicContact CG-CD1 3.81Å; L120-I124 WeakPolarHBondContact O-CB 3.4Å; L120-I124 WeakPolarHBondContact O-CD1 3.32Å; L120-I124 WeakPolarHBondContact O-CG1 3.37Å; L120-I124 PolarHBondContact O-N 2.85Å
121K67.9Low67.4Low138 Ų138116.9 Ų116.960%0.659%0.591SS**Hα-helixtrans-62-46.7175.5-80174.5-174.8-175.70110.1K117 I118 V119 V123 I124 T125K117-K121 VanDerWaalsContact O-CB 3.31Å; K117-K121 WeakPolarHBondContact O-CB 3.44Å; K117-K121 VanDerWaalsContact O-CD 3.23Å; K117-K121 WeakPolarHBondContact O-CD 3.28Å; K117-K121 WeakPolarHBondContact O-CG 3.39Å; K117-K121 PolarHBondContact O-N 3.36Å; I118-K121 WeakPolarHBondContact O-CB 3.35Å; I118-K121 PolarHBondContact O-N 3.42Å; I118-K121 VanDerWaalsContact O-N 3.14Å; V119-K121 PolarHBondContact O-N 2.93Å; K121-V123 PolarHBondContact O-N 2.83Å; K121-I124 PolarHBondContact O-N 3.27Å; K121-I124 VanDerWaalsContact O-N 3.16Å; K121-T125 PolarHBondContact O-N 3.48Å; K121-T125 PolarHBondContact O-OG1 2.77Å
122D72.1Confident68.9Low95 Ų95115.7 Ų115.751%0.50858%0.579SS.*Hα-helixtrans-62.4-42.9-178.3-66.6-23.1000112I118 V119 L120 T125 L126I118-D122 VanDerWaalsContact O-CG 3.32Å; I118-D122 PolarHBondContact O-N 2.83Å; V119-D122 PolarHBondContact O-N 2.95Å; L120-D122 VanDerWaalsContact C-N 3.34Å; D122-T125 VanDerWaalsContact CA-OG1 3.24Å; D122-T125 WeakPolarHBondContact CA-OG1 3.26Å; D122-T125 PolarHBondContact O-N 3.27Å; D122-T125 PolarHBondContact O-OG1 3.47Å; D122-L126 VanDerWaalsContact O-CB 3.29Å; D122-L126 WeakPolarHBondContact O-CB 3.3Å; D122-L126 PolarHBondContact O-N 3.5Å
123V71.8Confident70.7Confident85 Ų85116.9 Ų116.952%0.51557%0.572SS.*Hα-helixtrans-63.7-41.1174.9172.60000111.6V119 K121 L126 R127V119-V123 HydrophobicContact CG1-CG2 4.48Å; V119-V123 VanDerWaalsContact O-CG2 3.27Å; V119-V123 WeakPolarHBondContact O-CG2 3.35Å; V119-V123 PolarHBondContact O-N 2.65Å; K121-V123 PolarHBondContact O-N 2.83Å; V123-L126 PolarHBondContact O-N 3.04Å; V123-R127 WeakPolarHBondContact O-CB 3.25Å; V123-R127 PolarHBondContact O-N 3.4Å
124I77.5Confident72.8Confident72 Ų72112 Ų11237%0.36956%0.556SS.*Hα-helixtrans-67.5-41.8177.6-68.4166.7000110.9L120 K121 R127 R128L120-I124 HydrophobicContact CD1-CD1 4.01Å; L120-I124 HydrophobicContact CD1-CG1 4.32Å; L120-I124 HydrophobicContact CD2-CD1 4.49Å; L120-I124 HydrophobicContact CG-CD1 3.81Å; L120-I124 WeakPolarHBondContact O-CB 3.4Å; L120-I124 WeakPolarHBondContact O-CD1 3.32Å; L120-I124 WeakPolarHBondContact O-CG1 3.37Å; L120-I124 PolarHBondContact O-N 2.85Å; K121-I124 PolarHBondContact O-N 3.27Å; K121-I124 VanDerWaalsContact O-N 3.16Å; I124-R127 PolarHBondContact O-N 3.46Å; I124-R128 WeakPolarHBondContact O-CB 3.29Å; I124-R128 VanDerWaalsContact O-CG 3.3Å; I124-R128 WeakPolarHBondContact O-CG 3.49Å; I124-R128 PolarHBondContact O-N 2.81Å
125T80.8Confident74.5Confident81 Ų81107 Ų10750%0.49754%0.537SS..Hα-helixtrans-64.7-42174.927.20000111.9K121 D122 R128 H129K121-T125 PolarHBondContact O-N 3.48Å; K121-T125 PolarHBondContact O-OG1 2.77Å; D122-T125 VanDerWaalsContact CA-OG1 3.24Å; D122-T125 WeakPolarHBondContact CA-OG1 3.26Å; D122-T125 PolarHBondContact O-N 3.27Å; D122-T125 PolarHBondContact O-OG1 3.47Å; T125-R128 PolarHBondContact O-N 3.38Å; T125-H129 WeakPolarHBondContact O-CB 3.02Å; T125-H129 PolarHBondContact O-N 2.85Å
126L79.4Confident76.2Confident112 Ų112106.8 Ų106.859%0.58653%0.531SS*.Hα-helixtrans-63.4-45.1177.8-173.865000110.9D122 V123 R128 H129 V130D122-L126 VanDerWaalsContact O-CB 3.29Å; D122-L126 WeakPolarHBondContact O-CB 3.3Å; D122-L126 PolarHBondContact O-N 3.5Å; V123-L126 PolarHBondContact O-N 3.04Å; L126-R128 PolarHBondContact O-N 3.29Å; L126-H129 PolarHBondContact O-N 2.91Å; L126-V130 WeakPolarHBondContact O-CG2 2.79Å; L126-V130 PolarHBondContact O-N 2.84Å
127R85.3Confident77.6Confident170 Ų170107.6 Ų107.664%0.64253%0.528SS*.Hα-helixtrans-57.8-48.3174.4-179.1-178.4168.3-168.80.5111.5V123 I124 H129 V130 E131V123-R127 WeakPolarHBondContact O-CB 3.25Å; V123-R127 PolarHBondContact O-N 3.4Å; I124-R127 PolarHBondContact O-N 3.46Å; R127-H129 VanDerWaalsContact C-N 3.33Å; R127-H129 PolarHBondContact O-N 3.48Å; R127-V130 PolarHBondContact O-N 3.28Å; R127-E131 HydrophobicContact CG-CG 4.5Å; R127-E131 IonicContact CZ-OE1 3.43Å; R127-E131 IonicContact NE-OE1 2.84Å; R127-E131 PolarHBondContact NE-OE1 3.25Å; R127-E131 IonicContact NH2-OE1 3.07Å; R127-E131 PolarHBondContact NH2-OE1 3.19Å; R127-E131 WeakPolarHBondContact O-CB 3.43Å; R127-E131 WeakPolarHBondContact O-CG 3.28Å; R127-E131 PolarHBondContact O-N 3.45Å
128R83Confident78.9Confident170 Ų170106 Ų10664%0.64252%0.524SS*.Hα-helixtrans-60.9-41.6178.1-75.5176.4178.1-176.90.5111.9I124 T125 L126 E131 T132I124-R128 WeakPolarHBondContact O-CB 3.29Å; I124-R128 VanDerWaalsContact O-CG 3.3Å; I124-R128 WeakPolarHBondContact O-CG 3.49Å; I124-R128 PolarHBondContact O-N 2.81Å; T125-R128 PolarHBondContact O-N 3.38Å; L126-R128 PolarHBondContact O-N 3.29Å; R128-E131 PolarHBondContact O-N 3.37Å; R128-T132 WeakPolarHBondContact O-CG2 3.41Å; R128-T132 PolarHBondContact O-N 3.02Å; R128-T132 PolarHBondContact O-OG1 3.17Å
129H83.3Confident79.9Confident92 Ų92108.7 Ų108.743%0.42653%0.527SS..Hα-helixtrans-66.7-39.4178.5172.4-103.2000112.7T125 L126 R127 T132 K133T125-H129 WeakPolarHBondContact O-CB 3.02Å; T125-H129 PolarHBondContact O-N 2.85Å; L126-H129 PolarHBondContact O-N 2.91Å; R127-H129 VanDerWaalsContact C-N 3.33Å; R127-H129 PolarHBondContact O-N 3.48Å; H129-T132 PolarHBondContact O-OG1 3.3Å; H129-K133 VanDerWaalsContact CE1-CE 3.44Å; H129-K133 WeakPolarHBondContact CE1-CE 3.22Å; H129-K133 PolarHBondContact CE1-NZ 2.91Å; H129-K133 VanDerWaalsContact NE2-CE 3.26Å; H129-K133 WeakPolarHBondContact NE2-CE 3.48Å; H129-K133 PolarHBondContact O-N 3.5Å; H129-K133 VanDerWaalsContact O-N 3.1Å
130V86.8Confident80.8Confident77 Ų77111.4 Ų111.447%0.46753%0.53SS..Hα-helixtrans-67.4-43.9174173.60000110.6L126 R127 T132 K133 V134L126-V130 WeakPolarHBondContact O-CG2 2.79Å; L126-V130 PolarHBondContact O-N 2.84Å; R127-V130 PolarHBondContact O-N 3.28Å; V130-T132 PolarHBondContact O-N 2.82Å; V130-K133 PolarHBondContact O-N 3.07Å; V130-V134 HydrophobicContact CG1-CG2 4.31Å; V130-V134 WeakPolarHBondContact O-CG2 3.5Å; V130-V134 PolarHBondContact O-N 3.08Å
131E81.8Confident81Confident65 Ų65115.2 Ų115.230%0.30454%0.537SS..Hα-helixtrans-61-41177.6-76.6-177.2-168.500112.2R127 R128 V134 R135R127-E131 HydrophobicContact CG-CG 4.5Å; R127-E131 IonicContact CZ-OE1 3.43Å; R127-E131 IonicContact NE-OE1 2.84Å; R127-E131 PolarHBondContact NE-OE1 3.25Å; R127-E131 IonicContact NH2-OE1 3.07Å; R127-E131 PolarHBondContact NH2-OE1 3.19Å; R127-E131 WeakPolarHBondContact O-CB 3.43Å; R127-E131 WeakPolarHBondContact O-CG 3.28Å; R127-E131 PolarHBondContact O-N 3.45Å; R128-E131 PolarHBondContact O-N 3.37Å; E131-V134 PolarHBondContact O-N 2.89Å; E131-R135 WeakPolarHBondContact O-CB 3.28Å; E131-R135 WeakPolarHBondContact O-CG 3.34Å; E131-R135 PolarHBondContact O-N 3.38Å
132T88.4Confident81.2Confident83 Ų83116.3 Ų116.351%0.50954%0.542SS..Hα-helixtrans-67.3-40.9176.255.90000111.8R128 H129 V130 R135 A136R128-T132 WeakPolarHBondContact O-CG2 3.41Å; R128-T132 PolarHBondContact O-N 3.02Å; R128-T132 PolarHBondContact O-OG1 3.17Å; H129-T132 PolarHBondContact O-OG1 3.3Å; V130-T132 PolarHBondContact O-N 2.82Å; T132-R135 PolarHBondContact O-N 2.99Å; T132-A136 VanDerWaalsContact O-CB 3.3Å; T132-A136 WeakPolarHBondContact O-CB 3.38Å; T132-A136 PolarHBondContact O-N 3.13Å
133K88.4Confident81Confident121 Ų121115.7 Ų115.753%0.52654%0.542SS..Hα-helixtrans-62.1-42.9174.5-81.7-170.2172.4179.70112.3H129 V130 A136 K137H129-K133 VanDerWaalsContact CE1-CE 3.44Å; H129-K133 WeakPolarHBondContact CE1-CE 3.22Å; H129-K133 PolarHBondContact CE1-NZ 2.91Å; H129-K133 VanDerWaalsContact NE2-CE 3.26Å; H129-K133 WeakPolarHBondContact NE2-CE 3.48Å; H129-K133 PolarHBondContact O-N 3.5Å; H129-K133 VanDerWaalsContact O-N 3.1Å; V130-K133 PolarHBondContact O-N 3.07Å; K133-A136 PolarHBondContact O-N 3.47Å; K133-K137 WeakPolarHBondContact O-CB 3.01Å; K133-K137 WeakPolarHBondContact O-CG 3.37Å; K133-K137 PolarHBondContact O-N 3.04Å
134V89.4Confident80.5Confident74 Ų74115.2 Ų115.245%0.44854%0.539SS..Hα-helixtrans-65.6-45.9176.7171.50000110.5V130 E131 A136 K137 I138V130-V134 HydrophobicContact CG1-CG2 4.31Å; V130-V134 WeakPolarHBondContact O-CG2 3.5Å; V130-V134 PolarHBondContact O-N 3.08Å; E131-V134 PolarHBondContact O-N 2.89Å; V134-A136 VanDerWaalsContact C-N 3.34Å; V134-A136 PolarHBondContact O-N 2.82Å; V134-K137 PolarHBondContact O-N 3.49Å; V134-I138 HydrophobicContact CG1-CD1 3.74Å; V134-I138 HydrophobicContact CG1-CG1 4.36Å; V134-I138 VanDerWaalsContact O-CG1 3.29Å; V134-I138 WeakPolarHBondContact O-CG1 3.01Å; V134-I138 PolarHBondContact O-N 2.83Å
135R84Confident79.7Confident152 Ų152116 Ų11657%0.57455%0.547SS*.Hα-helixtrans-61.1-40.7176.1-73.6175.2-173.8-161.54.8112.2E131 T132 I138 R139E131-R135 WeakPolarHBondContact O-CB 3.28Å; E131-R135 WeakPolarHBondContact O-CG 3.34Å; E131-R135 PolarHBondContact O-N 3.38Å; T132-R135 PolarHBondContact O-N 2.99Å; R135-I138 PolarHBondContact O-N 2.94Å; R135-R139 WeakPolarHBondContact O-CB 3.49Å; R135-R139 WeakPolarHBondContact O-CG 3.3Å; R135-R139 PolarHBondContact O-N 3.47Å
136A85.2Confident78.6Confident47 Ų47120 Ų12039%0.38856%0.558SS.*Hα-helixtrans-64.4-42.3175.600000111.6T132 K133 V134 R139 K140T132-A136 VanDerWaalsContact O-CB 3.3Å; T132-A136 WeakPolarHBondContact O-CB 3.38Å; T132-A136 PolarHBondContact O-N 3.13Å; K133-A136 PolarHBondContact O-N 3.47Å; V134-A136 VanDerWaalsContact C-N 3.34Å; V134-A136 PolarHBondContact O-N 2.82Å; A136-R139 PolarHBondContact O-N 3.35Å; A136-K140 WeakPolarHBondContact O-CB 3.21Å; A136-K140 WeakPolarHBondContact O-CG 3.28Å; A136-K140 PolarHBondContact O-N 2.96Å
137K84.4Confident77.6Confident156 Ų156120.1 Ų120.168%0.67856%0.558SS**Hα-helixtrans-63.4-42.6173.8-77.2-178.4177.7-175.70112.1K133 V134 K140 R141K133-K137 WeakPolarHBondContact O-CB 3.01Å; K133-K137 WeakPolarHBondContact O-CG 3.37Å; K133-K137 PolarHBondContact O-N 3.04Å; V134-K137 PolarHBondContact O-N 3.49Å; K137-K140 PolarHBondContact O-N 2.86Å; K137-R141 VanDerWaalsContact O-CB 3.28Å; K137-R141 WeakPolarHBondContact O-CB 3.44Å; K137-R141 PolarHBondContact O-N 3.14Å
138I82.5Confident76.1Confident102 Ų102117.8 Ų117.852%0.52356%0.558SS.*Hα-helixtrans-63.5-44.9176.2-68.4167.3000110.6V134 R135 R141 K142V134-I138 HydrophobicContact CG1-CD1 3.74Å; V134-I138 HydrophobicContact CG1-CG1 4.36Å; V134-I138 VanDerWaalsContact O-CG1 3.29Å; V134-I138 WeakPolarHBondContact O-CG1 3.01Å; V134-I138 PolarHBondContact O-N 2.83Å; R135-I138 PolarHBondContact O-N 2.94Å; I138-R141 PolarHBondContact O-N 3.41Å; I138-K142 VanDerWaalsContact O-CB 3.3Å; I138-K142 WeakPolarHBondContact O-CB 3.31Å; I138-K142 PolarHBondContact O-N 3.23Å
139R79.8Confident74.8Confident183 Ų183117.4 Ų117.469%0.69156%0.563SS**Hα-helixtrans-62.3-47.3176.1-75.1177.9-179.5-179.7-0.9111.5R135 A136 R141 K142 V143R135-R139 WeakPolarHBondContact O-CB 3.49Å; R135-R139 WeakPolarHBondContact O-CG 3.3Å; R135-R139 PolarHBondContact O-N 3.47Å; A136-R139 PolarHBondContact O-N 3.35Å; R139-R141 PolarHBondContact O-N 3.31Å; R139-K142 PolarHBondContact O-N 3.11Å; R139-V143 WeakPolarHBondContact O-CB 3.35Å; R139-V143 VanDerWaalsContact O-CG2 3.25Å; R139-V143 WeakPolarHBondContact O-CG2 3.27Å; R139-V143 PolarHBondContact O-N 3.47Å
140K76.6Confident73.5Confident156 Ų156121.2 Ų121.268%0.67858%0.581SS**Hα-helixtrans-57.9-48175.1-76.3-173.1179.3-168.10111.1A136 K137 K142 V143 T144A136-K140 WeakPolarHBondContact O-CB 3.21Å; A136-K140 WeakPolarHBondContact O-CG 3.28Å; A136-K140 PolarHBondContact O-N 2.96Å; K137-K140 PolarHBondContact O-N 2.86Å; K140-K142 PolarHBondContact O-N 3.42Å; K140-V143 PolarHBondContact O-N 2.9Å; K140-T144 WeakPolarHBondContact O-CG2 3.43Å; K140-T144 PolarHBondContact O-N 2.98Å; K140-T144 PolarHBondContact O-OG1 2.72Å; K140-T144 VanDerWaalsContact O-OG1 3.07Å
141R72.9Confident71.9Confident188 Ų188123.4 Ų123.471%0.70959%0.59SS**Hα-helixtrans-60.1-44.9177-168.7177.2-177-160.91.1111.8K137 I138 R139 T144 T145K137-R141 VanDerWaalsContact O-CB 3.28Å; K137-R141 WeakPolarHBondContact O-CB 3.44Å; K137-R141 PolarHBondContact O-N 3.14Å; I138-R141 PolarHBondContact O-N 3.41Å; R139-R141 PolarHBondContact O-N 3.31Å; R141-T144 VanDerWaalsContact CA-OG1 3.31Å; R141-T144 WeakPolarHBondContact CA-OG1 3.4Å; R141-T144 PolarHBondContact O-N 2.9Å; R141-T144 PolarHBondContact O-OG1 2.98Å; R141-T145 WeakPolarHBondContact O-CB 3.4Å; R141-T145 PolarHBondContact O-N 2.58Å; R141-T145 PolarHBondContact O-OG1 2.82Å
142K71.9Confident70.6Confident161 Ų161129.7 Ų129.770%0.762%0.616SS**Hα-helixtrans-64.5-40.3177.9-169.4175.9-1771790111.9I138 R139 K140 T145 K146I138-K142 VanDerWaalsContact O-CB 3.3Å; I138-K142 WeakPolarHBondContact O-CB 3.31Å; I138-K142 PolarHBondContact O-N 3.23Å; R139-K142 PolarHBondContact O-N 3.11Å; K140-K142 PolarHBondContact O-N 3.42Å; K142-T145 PolarHBondContact O-N 3.44Å; K142-K146 WeakPolarHBondContact O-CB 3.43Å; K142-K146 PolarHBondContact O-N 3.35Å
143V67.8Low69.2Low83 Ų83130.3 Ų130.350%0.50362%0.615SS.*Hα-helixtrans-65.5-46.91751700000110.5R139 K140 T145 K146 I147R139-V143 WeakPolarHBondContact O-CB 3.35Å; R139-V143 VanDerWaalsContact O-CG2 3.25Å; R139-V143 WeakPolarHBondContact O-CG2 3.27Å; R139-V143 PolarHBondContact O-N 3.47Å; K140-V143 PolarHBondContact O-N 2.9Å; V143-T145 VanDerWaalsContact C-N 3.33Å; V143-T145 PolarHBondContact O-N 3.37Å; V143-K146 PolarHBondContact O-N 3.43Å; V143-K146 VanDerWaalsContact O-N 3.14Å; V143-I147 HydrophobicContact CG1-CD1 3.66Å; V143-I147 HydrophobicContact CG1-CG1 4.37Å; V143-I147 VanDerWaalsContact O-CG1 3.27Å; V143-I147 WeakPolarHBondContact O-CG1 3.41Å; V143-I147 PolarHBondContact O-N 3.49Å
144T60.3Low67.7Low74 Ų74130.8 Ų130.845%0.45462%0.624SS.*Hα-helixtrans-64.8-35.6176.5540000112.5K140 R141 K146 I147 N148K140-T144 WeakPolarHBondContact O-CG2 3.43Å; K140-T144 PolarHBondContact O-N 2.98Å; K140-T144 PolarHBondContact O-OG1 2.72Å; K140-T144 VanDerWaalsContact O-OG1 3.07Å; R141-T144 VanDerWaalsContact CA-OG1 3.31Å; R141-T144 WeakPolarHBondContact CA-OG1 3.4Å; R141-T144 PolarHBondContact O-N 2.9Å; R141-T144 PolarHBondContact O-OG1 2.98Å; T144-K146 VanDerWaalsContact C-N 3.34Å; T144-I147 PolarHBondContact O-N 3Å; T144-N148 WeakPolarHBondContact O-CB 3.32Å; T144-N148 PolarHBondContact O-N 2.88Å
145T61.4Low66Low90 Ų90129.7 Ų129.755%0.55263%0.627SS**Hα-helixtrans-67.8-35.1174.2-61.10000111.6R141 K142 V143R141-T145 WeakPolarHBondContact O-CB 3.4Å; R141-T145 PolarHBondContact O-N 2.58Å; R141-T145 PolarHBondContact O-OG1 2.82Å; K142-T145 PolarHBondContact O-N 3.44Å; V143-T145 VanDerWaalsContact C-N 3.33Å; V143-T145 PolarHBondContact O-N 3.37Å
146K58.1Low64.6Low165 Ų165131.4 Ų131.472%0.71764%0.639SS**Hα-helixtrans-72.5-38.9176-160.4-178-175.1-168.90111.9K142 V143 T144 N148 H149K142-K146 WeakPolarHBondContact O-CB 3.43Å; K142-K146 PolarHBondContact O-N 3.35Å; V143-K146 PolarHBondContact O-N 3.43Å; V143-K146 VanDerWaalsContact O-N 3.14Å; T144-K146 VanDerWaalsContact C-N 3.34Å; K146-N148 VanDerWaalsContact C-N 3.35Å; K146-H149 PolarHBondContact O-N 3.09Å
147I57.8Low63.2Low113 Ų113139.6 Ų139.658%0.57966%0.66SS**Hα-helixtrans-64.4-40.4174.4-67166.9000110.3V143 T144 H149 H150V143-I147 HydrophobicContact CG1-CD1 3.66Å; V143-I147 HydrophobicContact CG1-CG1 4.37Å; V143-I147 VanDerWaalsContact O-CG1 3.27Å; V143-I147 WeakPolarHBondContact O-CG1 3.41Å; V143-I147 PolarHBondContact O-N 3.49Å; T144-I147 PolarHBondContact O-N 3Å; I147-H149 PolarHBondContact O-N 2.9Å; I147-H149 VanDerWaalsContact O-N 3.11Å; I147-H150 PolarHBondContact O-N 3.12Å
148N54.9Low61.7Low122 Ų122138 Ų13865%0.65265%0.653SS**THydrogen-bonded Turntrans-71.82.7175.6-79.3-18000115.1T144 K146T144-N148 WeakPolarHBondContact O-CB 3.32Å; T144-N148 PolarHBondContact O-N 2.88Å; K146-N148 VanDerWaalsContact C-N 3.35Å
149H55.9Low60.7Low161 Ų161136.7 Ų136.775%0.74565%0.65SS**THydrogen-bonded Turntrans-96.7-6.3173.8-161.232.8000113.6K146 I147K146-H149 PolarHBondContact O-N 3.09Å; I147-H149 PolarHBondContact O-N 2.9Å; I147-H149 VanDerWaalsContact O-N 3.11Å
150H54.5Low60.2Low172 Ų172130.1 Ų130.180%0.79663%0.634SS**  trans-95.7-1.6-180-99-72.4000115.6I147 K152I147-H150 PolarHBondContact O-N 3.12Å; H150-K152 PolarHBondContact O-N 2.79Å
151D54.7Low60Low123 Ų123131.5 Ų131.566%0.65864%0.635SS**SBendtrans-67.5105.9162.4-79.5-15.1000107.6I153D151-I153 WeakPolarHBondContact O-CG1 3.49Å; D151-I153 PolarHBondContact O-N 2.93Å
152K54.1Low60.2Low198 Ų198130 Ų13086%0.86163%0.634SS**  trans-55.592.4164.5-86.7176.9173.5176.40107.2H150 N154H150-K152 PolarHBondContact O-N 2.79Å; K152-N154 PolarHBondContact O-N 3.5Å
153I58.5Low60.4Low95 Ų95127.8 Ų127.849%0.48763%0.626SS.*  trans-66.592.8171.1-64.3171.7000105.1D151 G155 K158D151-I153 WeakPolarHBondContact O-CG1 3.49Å; D151-I153 PolarHBondContact O-N 2.93Å; I153-G155 PolarHBondContact O-N 3.45Å; I153-K158 VanDerWaalsContact CD1-CE 3.49Å; I153-K158 HydrophobicContact CG2-CD 3.45Å; I153-K158 VanDerWaalsContact CG2-CD 3.45Å; I153-K158 HydrophobicContact CG2-CG 3.61Å
154N57.4Low61.3Low132 Ų132130.6 Ų130.671%0.70663%0.632SS**  trans-46.7109.3168.6-94-23.5000108K152 K156 R157K152-N154 PolarHBondContact O-N 3.5Å; N154-K156 PolarHBondContact O-N 3.3Å; N154-R157 PolarHBondContact O-N 3.25Å; N154-R157 VanDerWaalsContact O-N 3.12Å
155G53.9Low62.7Low50 Ų50132.1 Ų132.152%0.51564%0.635SS.*Hα-helixtrans-53.6-22.7-169.800000113.8I153 R157 T159I153-G155 PolarHBondContact O-N 3.45Å; G155-R157 PolarHBondContact O-N 3.34Å; G155-T159 PolarHBondContact O-N 3.26Å; G155-T159 PolarHBondContact O-OG1 3.46Å
156K53.9Low63.9Low189 Ų189134.2 Ų134.282%0.82264%0.636SS**Hα-helixtrans-62.7-38.1178.8-63.3-173.9178-177.30114.2N154 A160N154-K156 PolarHBondContact O-N 3.3Å; K156-A160 PolarHBondContact O-N 3.43Å
157R54.8Low65.3Low219 Ų219132.2 Ų132.283%0.82663%0.629SS**Hα-helixtrans-77.5-31.1-175-158.6176-172.3173.93.1112.9N154 G155 R161N154-R157 PolarHBondContact O-N 3.25Å; N154-R157 VanDerWaalsContact O-N 3.12Å; G155-R157 PolarHBondContact O-N 3.34Å; R157-R161 PolarHBondContact O-N 2.92Å
158K54.4Low66.9Low122 Ų122135.8 Ų135.853%0.5364%0.636SS.*Hα-helixtrans-70.2-38.6175.3-80.8-168.5177166.10111.9I153 R161 K162I153-K158 VanDerWaalsContact CD1-CE 3.49Å; I153-K158 HydrophobicContact CG2-CD 3.45Å; I153-K158 VanDerWaalsContact CG2-CD 3.45Å; I153-K158 HydrophobicContact CG2-CG 3.61Å; K158-R161 PolarHBondContact O-N 3.41Å; K158-K162 WeakPolarHBondContact O-CB 3.3Å; K158-K162 PolarHBondContact O-N 3Å
159T60.5Low68.6Low75 Ų75132.6 Ų132.646%0.4663%0.627SS.*Hα-helixtrans-66.2-44.2178.1-440000111.3G155 R161 K162 Q163G155-T159 PolarHBondContact O-N 3.26Å; G155-T159 PolarHBondContact O-OG1 3.46Å; T159-R161 PolarHBondContact O-N 3.44Å; T159-K162 PolarHBondContact O-N 3.3Å; T159-Q163 WeakPolarHBondContact O-CB 3.35Å; T159-Q163 WeakPolarHBondContact O-CG 3.46Å; T159-Q163 PolarHBondContact O-N 2.96Å
160A69.1Low70.3Confident44 Ų44129.2 Ų129.236%0.36461%0.611SS.*Hα-helixtrans-63-40.7176.600000112.9K156 K164K156-A160 PolarHBondContact O-N 3.43Å; A160-K164 WeakPolarHBondContact O-CB 3.4Å; A160-K164 WeakPolarHBondContact O-CG 3.41Å; A160-K164 PolarHBondContact O-N 3.27Å
161R73.8Confident72Confident185 Ų185125.9 Ų125.970%0.69860%0.596SS**Hα-helixtrans-68.4-40.4176.5-168.2176.5178.4174.60.5111.8R157 K158 T159 K164 M165R157-R161 PolarHBondContact O-N 2.92Å; K158-R161 PolarHBondContact O-N 3.41Å; T159-R161 PolarHBondContact O-N 3.44Å; R161-K164 PolarHBondContact O-N 3.23Å; R161-M165 HydrophobicContact CG-CE 4.14Å; R161-M165 WeakPolarHBondContact O-CG 3.43Å; R161-M165 PolarHBondContact O-N 3.19Å
162K76.5Confident73.8Confident156 Ų156125.4 Ų125.468%0.67859%0.593SS**Hα-helixtrans-62.5-45.4173.9-103.8-174.3171-174.60111.8K158 T159 K164 M165 F166K158-K162 WeakPolarHBondContact O-CB 3.3Å; K158-K162 PolarHBondContact O-N 3Å; T159-K162 PolarHBondContact O-N 3.3Å; K162-K164 PolarHBondContact O-N 3.47Å; K162-M165 HydrophobicContact CG-CE 4.42Å; K162-M165 PolarHBondContact O-N 2.98Å; K162-F166 WeakPolarHBondContact O-CB 3.49Å; K162-F166 PolarHBondContact O-N 3.47Å
163Q76.1Confident75.3Confident116 Ų116124.1 Ų124.154%0.54258%0.583SS.*Hα-helixtrans-61.2-43.9176.7-77174.4-19.500111.6T159 M165 F166 Q167T159-Q163 WeakPolarHBondContact O-CB 3.35Å; T159-Q163 WeakPolarHBondContact O-CG 3.46Å; T159-Q163 PolarHBondContact O-N 2.96Å; Q163-M165 VanDerWaalsContact C-N 3.35Å; Q163-M165 PolarHBondContact O-N 3.29Å; Q163-F166 PolarHBondContact O-N 3.46Å; Q163-Q167 WeakPolarHBondContact O-CB 3.43Å; Q163-Q167 WeakPolarHBondContact O-CG 3.38Å; Q163-Q167 PolarHBondContact O-N 3.45Å
164K87.1Confident76.6Confident142 Ų142127.7 Ų127.762%0.61759%0.59SS**Hα-helixtrans-62.3-38.6174.6-75.9-177.4178.7-172.90113A160 R161 K162 R168A160-K164 WeakPolarHBondContact O-CB 3.4Å; A160-K164 WeakPolarHBondContact O-CG 3.41Å; A160-K164 PolarHBondContact O-N 3.27Å; R161-K164 PolarHBondContact O-N 3.23Å; K162-K164 PolarHBondContact O-N 3.47Å; K164-R168 WeakPolarHBondContact O-CB 3.35Å; K164-R168 WeakPolarHBondContact O-CG 3.41Å; K164-R168 PolarHBondContact O-N 2.87Å
165M89.1Confident78Confident106 Ų106128.7 Ų128.752%0.52258%0.584SS.*Hα-helixtrans-68.6-38.7175.3-73.7-175.1-63.100111.8R161 K162 Q163 R168 A169R161-M165 HydrophobicContact CG-CE 4.14Å; R161-M165 WeakPolarHBondContact O-CG 3.43Å; R161-M165 PolarHBondContact O-N 3.19Å; K162-M165 HydrophobicContact CG-CE 4.42Å; K162-M165 PolarHBondContact O-N 2.98Å; Q163-M165 VanDerWaalsContact C-N 3.35Å; Q163-M165 PolarHBondContact O-N 3.29Å; M165-R168 PolarHBondContact O-N 3.44Å; M165-A169 WeakPolarHBondContact O-CB 3.48Å; M165-A169 PolarHBondContact O-N 2.96Å
166F86.1Confident79.4Confident133 Ų133129.2 Ų129.258%0.58358%0.583SS**Hα-helixtrans-65.8-44.1176.3-171.4-103.8000112K162 Q163 R168 A169 Q170K162-F166 WeakPolarHBondContact O-CB 3.49Å; K162-F166 PolarHBondContact O-N 3.47Å; Q163-F166 PolarHBondContact O-N 3.46Å; F166-R168 PolarHBondContact O-N 2.85Å; F166-A169 PolarHBondContact O-N 2.81Å; F166-Q170 HydrophobicContact CD1-CG 4.46Å; F166-Q170 HydrophobicContact CE1-CG 4.23Å; F166-Q170 HydrophobicContact CZ-CG 4.5Å; F166-Q170 WeakPolarHBondContact O-CG 3.22Å; F166-Q170 PolarHBondContact O-N 2.97Å
167Q88.4Confident80.6Confident123 Ų123124.2 Ų124.258%0.57556%0.563SS**Hα-helixtrans-60.1-45.4173.4-75.5175.5-16.500111.7Q163 A169 Q170 E171Q163-Q167 WeakPolarHBondContact O-CB 3.43Å; Q163-Q167 WeakPolarHBondContact O-CG 3.38Å; Q163-Q167 PolarHBondContact O-N 3.45Å; Q167-A169 VanDerWaalsContact C-N 3.34Å; Q167-A169 PolarHBondContact O-N 3.23Å; Q167-Q170 PolarHBondContact O-N 3.03Å; Q167-E171 PolarHBondContact O-N 3.47Å
168R91.6Very high81.9Confident188 Ų188117.5 Ų117.571%0.70954%0.543SS*.Hα-helixtrans-62-39.7175.7-78.4-178179.8-169.6-1.4112.8K164 M165 F166 E171 L172K164-R168 WeakPolarHBondContact O-CB 3.35Å; K164-R168 WeakPolarHBondContact O-CG 3.41Å; K164-R168 PolarHBondContact O-N 2.87Å; M165-R168 PolarHBondContact O-N 3.44Å; F166-R168 PolarHBondContact O-N 2.85Å; R168-E171 PolarHBondContact O-N 2.76Å; R168-L172 WeakPolarHBondContact O-CG 3.46Å; R168-L172 PolarHBondContact O-N 2.91Å
169A89.7Confident82.9Confident56 Ų56118.4 Ų118.446%0.46354%0.544SS..Hα-helixtrans-65.4-40.6176.200000111.8M165 F166 Q167 E171 L172 R173M165-A169 WeakPolarHBondContact O-CB 3.48Å; M165-A169 PolarHBondContact O-N 2.96Å; F166-A169 PolarHBondContact O-N 2.81Å; Q167-A169 VanDerWaalsContact C-N 3.34Å; Q167-A169 PolarHBondContact O-N 3.23Å; A169-E171 VanDerWaalsContact C-N 3.35Å; A169-L172 PolarHBondContact O-N 3.38Å; A169-R173 WeakPolarHBondContact O-CB 3.31Å; A169-R173 PolarHBondContact O-N 3.41Å
170Q91.2Very high83.3Confident90 Ų90120.1 Ų120.142%0.42155%0.547SS..Hα-helixtrans-64.2-39.1174.2-75.4-173.9-25.400112.2F166 Q167 R173 R174F166-Q170 HydrophobicContact CD1-CG 4.46Å; F166-Q170 HydrophobicContact CE1-CG 4.23Å; F166-Q170 HydrophobicContact CZ-CG 4.5Å; F166-Q170 WeakPolarHBondContact O-CG 3.22Å; F166-Q170 PolarHBondContact O-N 2.97Å; Q167-Q170 PolarHBondContact O-N 3.03Å; Q170-R173 WeakPolarHBondContact O-CB 3.45Å; Q170-R173 PolarHBondContact O-N 3.48Å; Q170-R174 WeakPolarHBondContact O-CG 3.33Å; Q170-R174 PolarHBondContact O-N 3.12Å
171E91.4Very high83.2Confident101 Ų101122.6 Ų122.647%0.47255%0.549SS..Hα-helixtrans-70.5-39.4178.3-172.3154.6164.400112.8Q167 R168 A169 R173 R174 R175Q167-E171 PolarHBondContact O-N 3.47Å; R168-E171 PolarHBondContact O-N 2.76Å; A169-E171 VanDerWaalsContact C-N 3.35Å; E171-R173 VanDerWaalsContact C-N 3.27Å; E171-R173 PolarHBondContact O-N 3.02Å; E171-R174 PolarHBondContact O-N 3.36Å; E171-R175 WeakPolarHBondContact O-CG 3.14Å; E171-R175 PolarHBondContact O-N 3.22Å; E171-R175 IonicContact OE1-CZ 3.18Å; E171-R175 IonicContact OE1-NE 3.96Å; E171-R175 IonicContact OE1-NH2 3.56Å; E171-R175 PolarHBondContact OE1-NH2 2.76Å
172L91.8Very high83Confident114 Ų114119.3 Ų119.360%0.59755%0.553SS**Hα-helixtrans-60-39.5171.3-74.7171.8000111.7R168 A169 R175 A176R168-L172 WeakPolarHBondContact O-CG 3.46Å; R168-L172 PolarHBondContact O-N 2.91Å; A169-L172 PolarHBondContact O-N 3.38Å; L172-R175 PolarHBondContact O-N 3.09Å; L172-A176 WeakPolarHBondContact O-CB 3.3Å; L172-A176 PolarHBondContact O-N 3.33Å
173R86.3Confident82.8Confident171 Ų171118.3 Ų118.365%0.64555%0.549SS*.Hα-helixtrans-62.7-46.2174.9-177.2178.3173.6164.83.7111.8A169 Q170 E171 R175 A176 E177A169-R173 WeakPolarHBondContact O-CB 3.31Å; A169-R173 PolarHBondContact O-N 3.41Å; Q170-R173 WeakPolarHBondContact O-CB 3.45Å; Q170-R173 PolarHBondContact O-N 3.48Å; E171-R173 VanDerWaalsContact C-N 3.27Å; E171-R173 PolarHBondContact O-N 3.02Å; R173-R175 VanDerWaalsContact C-N 3.35Å; R173-R175 PolarHBondContact O-N 3.15Å; R173-A176 PolarHBondContact O-N 2.98Å; R173-E177 WeakPolarHBondContact CG-OE1 3.34Å; R173-E177 IonicContact CZ-OE1 2.75Å; R173-E177 IonicContact NE-OE1 3.08Å; R173-E177 PolarHBondContact NE-OE1 3.49Å; R173-E177 VanDerWaalsContact NE-OE1 3.07Å; R173-E177 IonicContact NH2-OE1 3.68Å; R173-E177 WeakPolarHBondContact O-CG 3.3Å; R173-E177 PolarHBondContact O-N 3.23Å
174R86.3Confident82.3Confident170 Ų170114.6 Ų114.664%0.64253%0.533SS*.Hα-helixtrans-60-43.8175.8-72.8-179.7-179.4178.5-0.2111.8Q170 E171 A176 E177 D178Q170-R174 WeakPolarHBondContact O-CG 3.33Å; Q170-R174 PolarHBondContact O-N 3.12Å; E171-R174 PolarHBondContact O-N 3.36Å; R174-A176 VanDerWaalsContact C-N 3.34Å; R174-A176 PolarHBondContact O-N 3.42Å; R174-E177 PolarHBondContact O-N 2.95Å; R174-D178 WeakPolarHBondContact O-CB 3.02Å; R174-D178 VanDerWaalsContact O-CG 3.29Å; R174-D178 PolarHBondContact O-N 2.87Å
175R86.1Confident81.6Confident152 Ų152111.2 Ų111.257%0.57453%0.525SS*.Hα-helixtrans-63.1-38176.2-71.1-178.8-168.9171.24.5112.9E171 L172 R173 D178 Y179E171-R175 WeakPolarHBondContact O-CG 3.14Å; E171-R175 PolarHBondContact O-N 3.22Å; E171-R175 IonicContact OE1-CZ 3.18Å; E171-R175 IonicContact OE1-NE 3.96Å; E171-R175 IonicContact OE1-NH2 3.56Å; E171-R175 PolarHBondContact OE1-NH2 2.76Å; L172-R175 PolarHBondContact O-N 3.09Å; R173-R175 VanDerWaalsContact C-N 3.35Å; R173-R175 PolarHBondContact O-N 3.15Å; R175-D178 PolarHBondContact O-N 2.78Å; R175-Y179 VanDerWaalsContact O-CB 3.27Å; R175-Y179 WeakPolarHBondContact O-CB 3.27Å; R175-Y179 PolarHBondContact O-N 3.44Å
176A82.9Confident80.5Confident61 Ų61111.3 Ų111.350%0.50453%0.534SS..Hα-helixtrans-67.2-41.6175.500000111.7L172 R173 R174 Y179 H180L172-A176 WeakPolarHBondContact O-CB 3.3Å; L172-A176 PolarHBondContact O-N 3.33Å; R173-A176 PolarHBondContact O-N 2.98Å; R174-A176 VanDerWaalsContact C-N 3.34Å; R174-A176 PolarHBondContact O-N 3.42Å; A176-Y179 PolarHBondContact O-N 3.49Å; A176-H180 WeakPolarHBondContact O-CB 3.47Å; A176-H180 PolarHBondContact O-N 3.36Å
177E79.8Confident79.6Confident84 Ų84109.3 Ų109.339%0.39354%0.536SS..Hα-helixtrans-63.2-42.1174.8-72.5172.4-16600111.3R173 R174 H180 K181R173-E177 WeakPolarHBondContact CG-OE1 3.34Å; R173-E177 IonicContact CZ-OE1 2.75Å; R173-E177 IonicContact NE-OE1 3.08Å; R173-E177 PolarHBondContact NE-OE1 3.49Å; R173-E177 VanDerWaalsContact NE-OE1 3.07Å; R173-E177 IonicContact NH2-OE1 3.68Å; R173-E177 WeakPolarHBondContact O-CG 3.3Å; R173-E177 PolarHBondContact O-N 3.23Å; R174-E177 PolarHBondContact O-N 2.95Å; E177-H180 PolarHBondContact O-N 2.92Å; E177-K181 VanDerWaalsContact O-CG 3.3Å; E177-K181 WeakPolarHBondContact O-CG 3.38Å; E177-K181 PolarHBondContact O-N 3.25Å
178D82.8Confident78.5Confident78 Ų78105.3 Ų105.342%0.41752%0.524SS..Hα-helixtrans-70.5-37.7177.9-67.6-23.2000112.1R174 R175 H180 K181 C182R174-D178 WeakPolarHBondContact O-CB 3.02Å; R174-D178 VanDerWaalsContact O-CG 3.29Å; R174-D178 PolarHBondContact O-N 2.87Å; R175-D178 PolarHBondContact O-N 2.78Å; D178-H180 VanDerWaalsContact C-N 3.33Å; D178-H180 PolarHBondContact O-N 3.4Å; D178-K181 WeakPolarHBondContact O-CB 3.48Å; D178-K181 PolarHBondContact O-N 2.93Å; D178-K181 IonicContact OD1-NZ 3.97Å; D178-K181 PolarHBondContact OD1-NZ 3.5Å; D178-K181 VanDerWaalsContact OD1-NZ 3.08Å; D178-C182 PolarHBondContact O-N 3.46Å; D178-C182 PolarHBondContact O-SG 2.87Å
179Y73.6Confident77.4Confident142 Ų142100.7 Ų100.756%0.55751%0.507SS*.Hα-helixtrans-60.2-42.5171-177.4-99.3000112.2R175 A176 K181 C182 K183R175-Y179 VanDerWaalsContact O-CB 3.27Å; R175-Y179 WeakPolarHBondContact O-CB 3.27Å; R175-Y179 PolarHBondContact O-N 3.44Å; A176-Y179 PolarHBondContact O-N 3.49Å; Y179-K181 VanDerWaalsContact C-N 3.33Å; Y179-C182 PolarHBondContact O-N 2.95Å; Y179-K183 HydrophobicContact CD1-CD 4.31Å; Y179-K183 HydrophobicContact CE1-CD 3.59Å; Y179-K183 HydrophobicContact CE1-CG 4.32Å; Y179-K183 HydrophobicContact CE2-CD 4.38Å; Y179-K183 WeakPolarHBondContact O-CB 3.49Å; Y179-K183 PolarHBondContact O-N 3.25Å; Y179-K183 WeakPolarHBondContact OH-CE 3.42Å; Y179-K183 PolarHBondContact OH-NZ 3.4Å
180H69.8Low76.4Confident110 Ų110105.1 Ų105.151%0.50952%0.516SS..Hα-helixtrans-65.5-37.1175.5-171.873.1000111.8A176 E177 D178 I184A176-H180 WeakPolarHBondContact O-CB 3.47Å; A176-H180 PolarHBondContact O-N 3.36Å; E177-H180 PolarHBondContact O-N 2.92Å; D178-H180 VanDerWaalsContact C-N 3.33Å; D178-H180 PolarHBondContact O-N 3.4Å; H180-I184 WeakPolarHBondContact CE1-CD1 3.4Å; H180-I184 WeakPolarHBondContact NE2-CD1 3.45Å; H180-I184 PolarHBondContact O-N 3.5Å
181K67.8Low75.4Confident96 Ų96103.8 Ų103.842%0.41752%0.52SS..Hα-helixtrans-63.9-47.4172.1-70.8171.6-164.9159.20111.2E177 D178 Y179 K183 I184 R189E177-K181 VanDerWaalsContact O-CG 3.3Å; E177-K181 WeakPolarHBondContact O-CG 3.38Å; E177-K181 PolarHBondContact O-N 3.25Å; D178-K181 WeakPolarHBondContact O-CB 3.48Å; D178-K181 PolarHBondContact O-N 2.93Å; D178-K181 IonicContact OD1-NZ 3.97Å; D178-K181 PolarHBondContact OD1-NZ 3.5Å; D178-K181 VanDerWaalsContact OD1-NZ 3.08Å; Y179-K181 VanDerWaalsContact C-N 3.33Å; K181-K183 VanDerWaalsContact C-N 3.31Å; K181-K183 PolarHBondContact O-N 3.24Å; K181-I184 PolarHBondContact O-N 3.34Å; K181-I184 VanDerWaalsContact O-O 3.14Å; K181-R189 VanDerWaalsContact CB-NH2 3.33Å; K181-R189 PolarHBondContact O-NH2 3.02Å
182C69.3Low74.3Confident116 Ų116103.6 Ų103.678%0.78452%0.522SS*.Hα-helixtrans-68.3-28.6-177.9-670000113.3D178 Y179D178-C182 PolarHBondContact O-N 3.46Å; D178-C182 PolarHBondContact O-SG 2.87Å; Y179-C182 PolarHBondContact O-N 2.95Å
183K70.8Confident73.1Confident135 Ų135101.9 Ų101.959%0.58752%0.518SS*.Hα-helixtrans-82.7-25.3178.7-85.6-161.4163.9-1750115.2Y179 K181Y179-K183 HydrophobicContact CD1-CD 4.31Å; Y179-K183 HydrophobicContact CE1-CD 3.59Å; Y179-K183 HydrophobicContact CE1-CG 4.32Å; Y179-K183 HydrophobicContact CE2-CD 4.38Å; Y179-K183 WeakPolarHBondContact O-CB 3.49Å; Y179-K183 PolarHBondContact O-N 3.25Å; Y179-K183 WeakPolarHBondContact OH-CE 3.42Å; Y179-K183 PolarHBondContact OH-NZ 3.4Å; K181-K183 VanDerWaalsContact C-N 3.31Å; K181-K183 PolarHBondContact O-N 3.24Å
184I67.3Low72.5Confident38 Ų3897.8 Ų97.820%0.19551%0.509CS..SBendtrans-105.5113.6-178.4-54-174000109.6H180 K181 A188 R189H180-I184 WeakPolarHBondContact CE1-CD1 3.4Å; H180-I184 WeakPolarHBondContact NE2-CD1 3.45Å; H180-I184 PolarHBondContact O-N 3.5Å; K181-I184 PolarHBondContact O-N 3.34Å; K181-I184 VanDerWaalsContact O-O 3.14Å; I184-A188 HydrophobicContact CG2-CB 3.72Å; I184-R189 HydrophobicContact CB-CG 4Å; I184-R189 HydrophobicContact CG2-CG 3.48Å; I184-R189 VanDerWaalsContact CG2-CG 3.48Å; I184-R189 PolarHBondContact O-NE 2.97Å; I184-R189 VanDerWaalsContact O-NE 3.15Å; I184-R189 PolarHBondContact O-NH2 3.24Å
185P71.4Confident71.8Confident72 Ų7298.2 Ų98.247%0.46851%0.511SS..  trans-59.1145.8177.221.1-28.6000110.4S187 A188 R189P185-S187 PolarHBondContact O-N 2.94Å; P185-A188 HydrophobicContact CG-CB 3.9Å; P185-A188 PolarHBondContact O-N 3.07Å; P185-R189 PolarHBondContact O-N 3.35Å
186P67.3Low71.1Confident107 Ų10794.8 Ų94.870%0.69551%0.507SS*.Hα-helixtrans-52.5-33.9-175.4-27.834.4000114.2R189 K190P186-R189 PolarHBondContact O-N 2.89Å; P186-K190 PolarHBondContact O-N 2.98Å
187S66.3Low70.5Confident92 Ų92101.2 Ų101.264%0.64352%0.518SS*.Hα-helixtrans-63.9-43.7175.953.20000113.1P185 R189 K190 A191P185-S187 PolarHBondContact O-N 2.94Å; S187-R189 VanDerWaalsContact C-N 3.32Å; S187-R189 PolarHBondContact O-N 2.88Å; S187-K190 PolarHBondContact O-N 3.33Å; S187-A191 PolarHBondContact O-N 2.94Å
188A66.1Low69.8Low39 Ų39103.1 Ų103.132%0.32253%0.528SS..Hα-helixtrans-69.4-29178.700000112.4I184 P185 A191 L192I184-A188 HydrophobicContact CG2-CB 3.72Å; P185-A188 HydrophobicContact CG-CB 3.9Å; P185-A188 PolarHBondContact O-N 3.07Å; A188-A191 PolarHBondContact O-N 3.36Å; A188-L192 WeakPolarHBondContact O-CB 3.16Å; A188-L192 PolarHBondContact O-N 2.85Å
189R67.1Low68.9Low90 Ų90101 Ų10134%0.3452%0.522SS..Hα-helixtrans-66.2-39.6172.6-60.2-168.3-154.6156.913.9112.1K181 I184 P185 P186 S187 L192 C193K181-R189 VanDerWaalsContact CB-NH2 3.33Å; K181-R189 PolarHBondContact O-NH2 3.02Å; I184-R189 HydrophobicContact CB-CG 4Å; I184-R189 HydrophobicContact CG2-CG 3.48Å; I184-R189 VanDerWaalsContact CG2-CG 3.48Å; I184-R189 PolarHBondContact O-NE 2.97Å; I184-R189 VanDerWaalsContact O-NE 3.15Å; I184-R189 PolarHBondContact O-NH2 3.24Å; P185-R189 PolarHBondContact O-N 3.35Å; P186-R189 PolarHBondContact O-N 2.89Å; S187-R189 VanDerWaalsContact C-N 3.32Å; S187-R189 PolarHBondContact O-N 2.88Å; R189-L192 PolarHBondContact O-N 2.99Å; R189-C193 WeakPolarHBondContact O-CB 3.39Å; R189-C193 PolarHBondContact O-N 3.03Å; R189-C193 PolarHBondContact O-SG 3.14Å; R189-C193 VanDerWaalsContact O-SG 3.38Å
190K68.9Low68.3Low150 Ų15096.4 Ų96.465%0.65251%0.513SS*.Hα-helixtrans-65.6-41.7177.6-164.1174.6-177.8-178.90111P186 S187 N194P186-K190 PolarHBondContact O-N 2.98Å; S187-K190 PolarHBondContact O-N 3.33Å; K190-N194 VanDerWaalsContact O-CB 3.32Å; K190-N194 WeakPolarHBondContact O-CB 3.44Å; K190-N194 PolarHBondContact O-N 3.32Å; K190-N194 PolarHBondContact O-ND2 3.5Å
191A69.6Low67.8Low61 Ų6192.6 Ų92.650%0.50450%0.501SS..Hα-helixtrans-62.6-44.1173.500000112.1S187 A188 N194 W195S187-A191 PolarHBondContact O-N 2.94Å; A188-A191 PolarHBondContact O-N 3.36Å; A191-N194 PolarHBondContact O-N 2.84Å; A191-W195 WeakPolarHBondContact O-CB 3.46Å; A191-W195 PolarHBondContact O-N 3.28Å
192L68.5Low67.3Low98 Ų9894.9 Ų94.951%0.51351%0.513SS..Hα-helixtrans-65.7-43.4178.5-152.9106.5000112.2A188 R189 N194 W195 V196A188-L192 WeakPolarHBondContact O-CB 3.16Å; A188-L192 PolarHBondContact O-N 2.85Å; R189-L192 PolarHBondContact O-N 2.99Å; L192-N194 VanDerWaalsContact C-N 3.34Å; L192-N194 PolarHBondContact O-N 2.84Å; L192-W195 PolarHBondContact O-N 3.02Å; L192-V196 VanDerWaalsContact O-CG2 3.31Å; L192-V196 WeakPolarHBondContact O-CG2 3.46Å; L192-V196 PolarHBondContact O-N 3.46Å
193C67.1Low66.5Low78 Ų7896.7 Ų96.753%0.52751%0.51SS..Hα-helixtrans-64.5-38.1175.3-75.10000112.3R189 R197R189-C193 WeakPolarHBondContact O-CB 3.39Å; R189-C193 PolarHBondContact O-N 3.03Å; R189-C193 PolarHBondContact O-SG 3.14Å; R189-C193 VanDerWaalsContact O-SG 3.38Å; C193-R197 WeakPolarHBondContact O-CB 3.37Å; C193-R197 WeakPolarHBondContact O-CG 3.46Å; C193-R197 PolarHBondContact O-N 2.93Å
194N73.1Confident65.4Low85 Ų8599.1 Ų99.146%0.45552%0.515SS..Hα-helixtrans-67.4-41.3174.7-74.5-8.7000111.2K190 A191 L192 R197 M198K190-N194 VanDerWaalsContact O-CB 3.32Å; K190-N194 WeakPolarHBondContact O-CB 3.44Å; K190-N194 PolarHBondContact O-N 3.32Å; K190-N194 PolarHBondContact O-ND2 3.5Å; A191-N194 PolarHBondContact O-N 2.84Å; L192-N194 VanDerWaalsContact C-N 3.34Å; L192-N194 PolarHBondContact O-N 2.84Å; N194-R197 PolarHBondContact O-N 3.44Å; N194-M198 WeakPolarHBondContact O-CB 3.3Å; N194-M198 VanDerWaalsContact O-CG 3.3Å; N194-M198 WeakPolarHBondContact O-CG 3.44Å; N194-M198 PolarHBondContact O-N 2.75Å
195W72.4Confident64.6Low178 Ų178105.4 Ų105.467%0.67454%0.543SS*.Hα-helixtrans-64.2-44.5175.9-176.874.1000112.2A191 L192 R197 M198 A199A191-W195 WeakPolarHBondContact O-CB 3.46Å; A191-W195 PolarHBondContact O-N 3.28Å; L192-W195 PolarHBondContact O-N 3.02Å; W195-R197 VanDerWaalsContact C-N 3.31Å; W195-R197 PolarHBondContact O-N 3.15Å; W195-M198 PolarHBondContact O-N 3.14Å; W195-A199 WeakPolarHBondContact O-CB 3.41Å; W195-A199 PolarHBondContact O-N 3.45Å
196V72.3Confident63.8Low81 Ų81107.2 Ų107.249%0.49156%0.558SS.*Hα-helixtrans-62.3-38174.3171.60000111.4L192 A200L192-V196 VanDerWaalsContact O-CG2 3.31Å; L192-V196 WeakPolarHBondContact O-CG2 3.46Å; L192-V196 PolarHBondContact O-N 3.46Å; V196-A200 WeakPolarHBondContact O-CB 3.49Å; V196-A200 PolarHBondContact O-N 3.36Å
197R69.2Low63.2Low195 Ų195105.1 Ų105.174%0.73655%0.546SS*.Hα-helixtrans-66.5-41.8174-84.5-178.7131.9174.6-3.2112.6C193 N194 W195 A200 A201C193-R197 WeakPolarHBondContact O-CB 3.37Å; C193-R197 WeakPolarHBondContact O-CG 3.46Å; C193-R197 PolarHBondContact O-N 2.93Å; N194-R197 PolarHBondContact O-N 3.44Å; W195-R197 VanDerWaalsContact C-N 3.31Å; W195-R197 PolarHBondContact O-N 3.15Å; R197-A200 PolarHBondContact O-N 2.84Å; R197-A201 WeakPolarHBondContact O-CB 3.3Å; R197-A201 PolarHBondContact O-N 3.45Å
198M66.3Low62.6Low124 Ų124104.3 Ų104.361%0.61155%0.552SS**Hα-helixtrans-67.3-46.4177.4-73.8-59.3-61.100111.2N194 W195 A200 A201 E202N194-M198 WeakPolarHBondContact O-CB 3.3Å; N194-M198 VanDerWaalsContact O-CG 3.3Å; N194-M198 WeakPolarHBondContact O-CG 3.44Å; N194-M198 PolarHBondContact O-N 2.75Å; W195-M198 PolarHBondContact O-N 3.14Å; M198-A200 VanDerWaalsContact C-N 3.29Å; M198-A200 PolarHBondContact O-N 3.38Å; M198-A201 CarbonylContact O-C 3.58Å; M198-A201 WeakPolarHBondContact O-CA 3.47Å; M198-A201 WeakPolarHBondContact O-CB 3.44Å; M198-A201 PolarHBondContact O-N 3.31Å; M198-E202 VanDerWaalsContact O-CB 3.3Å; M198-E202 WeakPolarHBondContact O-CB 3.32Å; M198-E202 PolarHBondContact O-N 3.4Å
199A63.2Low61.9Low35 Ų35109.2 Ų109.229%0.28957%0.572SS.*Hα-helixtrans-61-38.9175.700000111.7W195 E202 H203W195-A199 WeakPolarHBondContact O-CB 3.41Å; W195-A199 PolarHBondContact O-N 3.45Å; A199-E202 PolarHBondContact O-N 3.49Å; A199-H203 WeakPolarHBondContact O-CB 3.39Å; A199-H203 PolarHBondContact O-N 2.93Å
200A60Low60.9Low44 Ų44109.9 Ų109.936%0.36459%0.588SS.*Hα-helixtrans-69.5-30.9173.600000112.9V196 R197 M198 R204V196-A200 WeakPolarHBondContact O-CB 3.49Å; V196-A200 PolarHBondContact O-N 3.36Å; R197-A200 PolarHBondContact O-N 2.84Å; M198-A200 VanDerWaalsContact C-N 3.29Å; M198-A200 PolarHBondContact O-N 3.38Å; A200-R204 WeakPolarHBondContact O-CD 3.45Å; A200-R204 WeakPolarHBondContact O-CG 3.37Å; A200-R204 PolarHBondContact O-N 3.19Å
201A60.7Low59.7Low31 Ų31112.1 Ų112.126%0.25659%0.594SS.*Hα-helixtrans-73.9-38173.100000112R197 M198 R204 H205R197-A201 WeakPolarHBondContact O-CB 3.3Å; R197-A201 PolarHBondContact O-N 3.45Å; M198-A201 CarbonylContact O-C 3.58Å; M198-A201 WeakPolarHBondContact O-CA 3.47Å; M198-A201 WeakPolarHBondContact O-CB 3.44Å; M198-A201 PolarHBondContact O-N 3.31Å; A201-R204 VanDerWaalsContact O-CB 3.3Å; A201-R204 WeakPolarHBondContact O-CB 3.4Å; A201-R204 PolarHBondContact O-N 3.15Å; A201-R204 VanDerWaalsContact O-N 3.09Å; A201-H205 PolarHBondContact O-CD2 2.85Å; A201-H205 PolarHBondContact O-N 3.08Å
202E55.8Low58.4Low143 Ų143120.1 Ų120.167%0.66861%0.611SS**Hα-helixtrans-68.8-41.1178-163.9167.5-167.900111M198 A199 R204 H205 S206M198-E202 VanDerWaalsContact O-CB 3.3Å; M198-E202 WeakPolarHBondContact O-CB 3.32Å; M198-E202 PolarHBondContact O-N 3.4Å; A199-E202 PolarHBondContact O-N 3.49Å; E202-R204 PolarHBondContact O-N 3.23Å; E202-H205 PolarHBondContact O-N 2.62Å; E202-S206 PolarHBondContact O-N 3.46Å
203H52.5Low57.4Low154 Ų154118.9 Ų118.971%0.71361%0.609SS**Hα-helixtrans-61.8-25.3169.3-119.2-73.4000113.4A199 S207A199-H203 WeakPolarHBondContact O-CB 3.39Å; A199-H203 PolarHBondContact O-N 2.93Å; H203-S207 PolarHBondContact O-OG 3.43Å
204R49.3Very low56.3Low187 Ų187125.7 Ų125.771%0.70663%0.625SS**Hα-helixtrans-79.2-29.1178.5-76.5166.9-174.8-178.7-1.1113.5A200 A201 E202 S207A200-R204 WeakPolarHBondContact O-CD 3.45Å; A200-R204 WeakPolarHBondContact O-CG 3.37Å; A200-R204 PolarHBondContact O-N 3.19Å; A201-R204 VanDerWaalsContact O-CB 3.3Å; A201-R204 WeakPolarHBondContact O-CB 3.4Å; A201-R204 PolarHBondContact O-N 3.15Å; A201-R204 VanDerWaalsContact O-N 3.09Å; E202-R204 PolarHBondContact O-N 3.23Å; R204-S207 PolarHBondContact O-OG 3.48Å
205H50.6Low55.1Low170 Ų170125.8 Ų125.879%0.78763%0.625SS**Hα-helixtrans-78.2-26177.5-71-64.3000112.7A201 E202A201-H205 PolarHBondContact O-CD2 2.85Å; A201-H205 PolarHBondContact O-N 3.08Å; E202-H205 PolarHBondContact O-N 2.62Å
206S52.9Low54.3Low110 Ų110121.5 Ų121.577%0.76962%0.618SS**SBendtrans-86.4-12.6178.8-164.40000114.4E202E202-S206 PolarHBondContact O-N 3.46Å
207S55.9Low53.3Low63 Ų63121.5 Ų121.544%0.44163%0.627SS.*SBendtrans-97.2-9.4-172.362.20000115.6H203 R204 L209H203-S207 PolarHBondContact O-OG 3.43Å; R204-S207 PolarHBondContact O-OG 3.48Å; S207-L209 PolarHBondContact O-N 3.25Å
208G54.1Low52.4Low75 Ų75118.3 Ų118.377%0.77362%0.62SS**  trans57.113.4172.700000117
209L50.8Low51.7Low142 Ų142115 Ų11574%0.74361%0.607SS**  trans-90.9134.5-173.4-81.2164.7000111.5S207S207-L209 PolarHBondContact O-N 3.25Å
210P45.3Very low51.3Low104 Ų104117.6 Ų117.668%0.67562%0.616SS**  trans-65.3136.317924.7-30.6000111.3W212P210-W212 PolarHBondContact O-N 2.94Å; P210-W212 VanDerWaalsContact O-N 3.15Å
211Y43.4Very low51Low197 Ų197122.8 Ų122.877%0.77363%0.63SS**  trans-57.3109.8-179.5172.9-106.2000111.8P213Y211-P213 HydrophobicContact CD1-CG 4.21Å; Y211-P213 HydrophobicContact CE1-CB 3.82Å; Y211-P213 HydrophobicContact CE1-CG 3.58Å; Y211-P213 HydrophobicContact CE2-CB 4.45Å
212W43.8Very low50.9Low229 Ų229126.3 Ų126.387%0.86765%0.645SS**  trans-97.5111.9156.6-84.388.5000107.9P210 Y214P210-W212 PolarHBondContact O-N 2.94Å; P210-W212 VanDerWaalsContact O-N 3.15Å; W212-Y214 PolarHBondContact O-N 2.96Å
213P46.1Very low50.9Low72 Ų72128.5 Ų128.547%0.46865%0.647SS.*  trans-58.5118.31744.9-1.8000107.8Y211 L215Y211-P213 HydrophobicContact CD1-CG 4.21Å; Y211-P213 HydrophobicContact CE1-CB 3.82Å; Y211-P213 HydrophobicContact CE1-CG 3.58Å; Y211-P213 HydrophobicContact CE2-CB 4.45Å; P213-L215 PolarHBondContact O-N 3.27Å
214Y45.1Very low51Low221 Ų221128.3 Ų128.387%0.86765%0.648SS**  trans-46.4116.3166.2-142.9-97.3000106.9W212 T216W212-Y214 PolarHBondContact O-N 2.96Å; Y214-T216 PolarHBondContact O-N 3.19Å
215L47.6Very low51.2Low87 Ų87122.4 Ų122.446%0.45565%0.646SS.*  trans-49.7107.1169.3-82.7156.3000106.8P213 T219P213-L215 PolarHBondContact O-N 3.27Å; L215-T219 HydrophobicContact CD2-CG2 3.49Å; L215-T219 VanDerWaalsContact CD2-CG2 3.49Å
216T55.2Low51.4Low87 Ų87121.7 Ų121.753%0.53464%0.642SS.*  trans-54.4145.6177.5-34.30000107.2Y214 E218 T219 L220Y214-T216 PolarHBondContact O-N 3.19Å; T216-E218 HydrophobicContact CG2-CB 4.34Å; T216-E218 CarbonylContact O-C 3.53Å; T216-E218 PolarHBondContact O-N 2.95Å; T216-T219 PolarHBondContact N-OG1 3.05Å; T216-T219 WeakPolarHBondContact O-CA 3.28Å; T216-T219 WeakPolarHBondContact O-CB 3.47Å; T216-T219 PolarHBondContact O-N 3.33Å; T216-T219 PolarHBondContact O-OG1 2.96Å; T216-L220 PolarHBondContact O-N 3.48Å
217A50.9Low51.6Low81 Ų81125 Ų12567%0.66965%0.646SS**Hα-helixtrans-52.2-27.9176.900000112L220 K221A217-L220 PolarHBondContact O-N 2.95Å; A217-K221 VanDerWaalsContact O-CB 3.28Å; A217-K221 WeakPolarHBondContact O-CB 3.49Å; A217-K221 PolarHBondContact O-N 3.38Å
218E52Low51.7Low128 Ų128127.1 Ų127.160%0.59866%0.658SS**Hα-helixtrans-52.6-49.3166.7-130.285.3-144.200113.4T216 K221 N222T216-E218 HydrophobicContact CG2-CB 4.34Å; T216-E218 CarbonylContact O-C 3.53Å; T216-E218 PolarHBondContact O-N 2.95Å; E218-K221 PolarHBondContact O-N 3.33Å; E218-N222 VanDerWaalsContact O-CG 3.22Å; E218-N222 PolarHBondContact O-N 3.26Å; E218-N222 PolarHBondContact O-ND2 3.47Å
219T51Low52Low55 Ų55129.2 Ų129.234%0.33766%0.658SS.*Hα-helixtrans-71.2-33.9-176.5-29.40000111.9L215 T216 R223L215-T219 HydrophobicContact CD2-CG2 3.49Å; L215-T219 VanDerWaalsContact CD2-CG2 3.49Å; T216-T219 PolarHBondContact N-OG1 3.05Å; T216-T219 WeakPolarHBondContact O-CA 3.28Å; T216-T219 WeakPolarHBondContact O-CB 3.47Å; T216-T219 PolarHBondContact O-N 3.33Å; T216-T219 PolarHBondContact O-OG1 2.96Å; T219-R223 PolarHBondContact O-N 2.75Å
220L53.8Low52.4Low89 Ų89127.9 Ų127.947%0.46666%0.658SS.*Hα-helixtrans-72-35.9174.7-123153.7000111.5T216 A217 R223 M224T216-L220 PolarHBondContact O-N 3.48Å; A217-L220 PolarHBondContact O-N 2.95Å; L220-R223 PolarHBondContact O-N 3.29Å; L220-M224 HydrophobicContact CD2-CE 3.25Å; L220-M224 PolarHBondContact O-N 2.97Å; L220-M224 VanDerWaalsContact O-N 3.14Å
221K55.4Low52.5Low154 Ų154128.8 Ų128.867%0.6766%0.663SS**Hα-helixtrans-68.4-39.7174.8-167.9-178.4173.5-168.80112.1A217 E218 R223 M224 G225A217-K221 VanDerWaalsContact O-CB 3.28Å; A217-K221 WeakPolarHBondContact O-CB 3.49Å; A217-K221 PolarHBondContact O-N 3.38Å; E218-K221 PolarHBondContact O-N 3.33Å; K221-R223 VanDerWaalsContact C-N 3.3Å; K221-R223 PolarHBondContact O-N 3.4Å; K221-M224 PolarHBondContact O-N 3.26Å; K221-G225 PolarHBondContact O-N 3.36Å
222N56.9Low52.9Low104 Ų104125.8 Ų125.856%0.55667%0.666SS**Hα-helixtrans-68.2-28.2176.4-68-15.5000112.9E218 H226E218-N222 VanDerWaalsContact O-CG 3.22Å; E218-N222 PolarHBondContact O-N 3.26Å; E218-N222 PolarHBondContact O-ND2 3.47Å; N222-H226 PolarHBondContact O-ND1 3.43Å
223R56.3Low53.1Low190 Ų190123.1 Ų123.172%0.71766%0.663SS**Hα-helixtrans-79.1-31.3173.8-78.3-171.8176.4-173.50.4114T219 L220 K221 G225T219-R223 PolarHBondContact O-N 2.75Å; L220-R223 PolarHBondContact O-N 3.29Å; K221-R223 VanDerWaalsContact C-N 3.3Å; K221-R223 PolarHBondContact O-N 3.4Å; R223-G225 VanDerWaalsContact C-N 3.33Å
224M54.4Low53.2Low149 Ų149128.9 Ų128.973%0.73468%0.684SS**Hα-helixtrans-77.1-17175.6-88.4-176.2-111.200113.9L220 K221L220-M224 HydrophobicContact CD2-CE 3.25Å; L220-M224 PolarHBondContact O-N 2.97Å; L220-M224 VanDerWaalsContact O-N 3.14Å; K221-M224 PolarHBondContact O-N 3.26Å
225G52.8Low53.1Low64 Ų64126.7 Ų126.766%0.6668%0.681SS**THydrogen-bonded Turntrans-86.2-9.8-179.900000115.6K221 R223K221-G225 PolarHBondContact O-N 3.36Å; R223-G225 VanDerWaalsContact C-N 3.33Å
226H56Low53.1Low155 Ų155131.6 Ų131.672%0.71872%0.723SS**  trans-95.2113.5177.8-74.777000109.6N222N222-H226 PolarHBondContact O-ND1 3.43Å
227Q57Low53Low179 Ų179133.8 Ų133.884%0.83673%0.732SS**PPolyproline II helixtrans-61.7140.5163-82.1-161.9-4.100109.1
228P57.9Low53.1Low108 Ų108136.6 Ų136.670%0.70174%0.735SS**PPolyproline II helixtrans-60.2142.1168.926-31.4000109.1
229P60.6Low53.1Low118 Ų118137.1 Ų137.177%0.76674%0.743SS**PPolyproline II helixtrans-58.5144.7176.924.8-32.4000109.9
230P59.3Low53.3Low114 Ų114141.9 Ų141.974%0.7477%0.767SS**PPolyproline II helixtrans-61147-17925.2-32.8000110.4T232P230-T232 PolarHBondContact O-N 2.93Å
231P46.4Very low53.2Low123 Ų123145.2 Ų145.280%0.79979%0.786SS**PPolyproline II helixtrans-62122.1-178.125.1-32.4000109.7Q233P231-Q233 PolarHBondContact O-N 3.18Å; P231-Q233 VanDerWaalsContact O-N 3.15Å
232T52.8Low53.1Low135 Ų135144.6 Ų144.683%0.82879%0.793SS**PPolyproline II helixtrans-59.4116.7172.2-290000108P230 Q234P230-T232 PolarHBondContact O-N 2.93Å; T232-Q234 PolarHBondContact O-N 3.36Å; T232-Q234 VanDerWaalsContact O-N 3.14Å
233Q47.8Very low52.8Low173 Ų173147.5 Ų147.581%0.80881%0.81SS**  trans-64.4114.7169.1-69.6-151.221.500108P231 H235P231-Q233 PolarHBondContact O-N 3.18Å; P231-Q233 VanDerWaalsContact O-N 3.15Å; Q233-H235 PolarHBondContact O-N 3.49Å
234Q48.3Very low52.5Low193 Ų193144.2 Ų144.290%0.90282%0.817SS**  trans-74.3112.4159.5-72.9-162.8-28.500106.9T232T232-Q234 PolarHBondContact O-N 3.36Å; T232-Q234 VanDerWaalsContact O-N 3.14Å
235H41.8Very low52.4Low174 Ų174143.8 Ų143.881%0.80682%0.824SS**  trans-77.8139.8166.8-136.3-102.7000108.2Q233Q233-H235 PolarHBondContact O-N 3.49Å
236S47.9Very low52.3Low190 Ų190151.1 Ų151.1100%1.32984%0.839SS**  trans-47.30-173.9-55.20000116.4

Retrieved 236 of 236 residues in 48 ms (Link to these results)