A0A067ZXG4_HUMAN Loading...

Nuclear pore complex-interacting protein

AlphaFold DB , UniProt , Accession A0A067ZXG4, Species HUMAN (Homo sapiens, Human), Gene NPIP, Length 193 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
1L33.6Very low38.5Very low232 Ų232159.8 Ų159.8100%1.21584%0.838SS**  0111.70-92.1139.9000108.1
2F41.8Very low38.4Very low211 Ų211152.9 Ų152.993%0.92583%0.834SS**  trans-74.8132.1168.8-112.1-94.2000108.6
3C36.1Very low38.5Very low112 Ų112147.2 Ų147.276%0.75783%0.833SS**  trans-175.5108.6144.8-115.50000106.8
4C42.1Very low38.7Very low105 Ų105145.1 Ų145.171%0.70983%0.83SS**  77.3118.596-69.30000111.6
5L38.5Very low38.7Very low151 Ų151148.2 Ų148.279%0.79183%0.83SS**  177.999.1122.3-86.6158.2000106.6Y7L5-Y7 HydrophobicContact CD2-CD2 4.43Å; L5-Y7 HydrophobicContact CD2-CE2 3.6Å
6G46.5Very low39.7Very low67 Ų67145.9 Ų145.969%0.69182%0.821SS**  trans-87.3136.3163.400000109.3
7Y33Very low40Very low186 Ų186150 Ų15073%0.72982%0.821SS**  trans-153.7108154.9-67.8-78000104.8L5L5-Y7 HydrophobicContact CD2-CD2 4.43Å; L5-Y7 HydrophobicContact CD2-CE2 3.6Å
8E38.2Very low40.3Very low173 Ų173150.3 Ų150.381%0.80882%0.815SS**  96.1124.898.7-88.7-172.7129.200113
9W44.9Very low40.8Very low238 Ų238146.3 Ų146.390%0.90280%0.8SS**  trans-29.8141.3161.4-6777.1000115.5
10L34.2Very low41.4Very low164 Ų164141.6 Ų141.686%0.85978%0.781SS**  161.9153.6117.1-88.3158.6000111.2
11S34.8Very low41.5Very low119 Ų119143.7 Ų143.783%0.83278%0.777SS**  trans70.3111.9168.2-101.30000114.7
12G37.2Very low42.4Very low77 Ų77136.8 Ų136.879%0.79475%0.745SS**  89.1100.160.100000108.2
13G39.1Very low43Very low79 Ų79132.1 Ų132.181%0.81473%0.728SS**  trans99.6120.1159.300000117.2
14C42Very low43.7Very low117 Ų117132.1 Ų132.179%0.79172%0.721SS**  trans80.896.4147.7-152.50000118.4
15K38Very low44Very low192 Ų192129.7 Ų129.784%0.83570%0.703SS**  -173.864.4126.1-97.2158.6-174.21730110.6W17K15-W17 PolarHBondContact O-N 2.99Å
16T54.9Low44.4Very low112 Ų112127.9 Ų127.969%0.68769%0.693SS**  trans-85.670.7169.947.40000110.6
17W44.3Very low44.6Very low215 Ų215127.2 Ų127.281%0.81468%0.681SS**SBendtrans-149.1-35.2166.9-73.2100000113.2K15K15-W17 PolarHBondContact O-N 2.99Å
18H46.1Very low45.2Very low155 Ų155123.6 Ų123.672%0.71868%0.675SS**Hα-helixtrans-80-33.2-174.2-124.4-78.8000114.2V22H18-V22 WeakPolarHBondContact O-CG2 3.4Å; H18-V22 PolarHBondContact O-N 3.14Å
19S49.9Very low45.7Very low75 Ų75121.8 Ų121.852%0.52467%0.666SS.*Hα-helixtrans-77.8-30.4179.140.30000113I23S19-I23 WeakPolarHBondContact O-CB 3.32Å; S19-I23 WeakPolarHBondContact O-CD1 3.4Å; S19-I23 WeakPolarHBondContact O-CG1 3.42Å; S19-I23 PolarHBondContact O-N 3.31Å; S19-I23 VanDerWaalsContact O-N 3.09Å
20A51.8Low45.8Very low52 Ų52118 Ų11843%0.4366%0.658SS.*Hα-helixtrans-69.4-36.7174.100000112I23 N24A20-I23 PolarHBondContact O-N 2.96Å; A20-N24 WeakPolarHBondContact O-CB 3.37Å; A20-N24 PolarHBondContact O-N 3.4Å
21W45.2Very low46.3Very low185 Ų185118.4 Ų118.470%0.70166%0.655SS**Hα-helixtrans-66-43.1177.1-155.763.9000111.3I23 N24 T25W21-I23 PolarHBondContact O-N 3.43Å; W21-N24 PolarHBondContact O-N 3.26Å; W21-T25 WeakPolarHBondContact O-CB 3.19Å; W21-T25 PolarHBondContact O-N 2.88Å; W21-T25 PolarHBondContact O-OG1 3.46Å
22V52.5Low47Very low88 Ų88122.8 Ų122.853%0.53365%0.653SS.*Hα-helixtrans-66-39.6177.1176.30000111.9H18 L26H18-V22 WeakPolarHBondContact O-CG2 3.4Å; H18-V22 PolarHBondContact O-N 3.14Å; V22-L26 VanDerWaalsContact O-CB 3.28Å; V22-L26 WeakPolarHBondContact O-CB 3.01Å; V22-L26 PolarHBondContact O-N 2.81Å
23I53.3Low47.4Very low113 Ų113122.2 Ų122.258%0.57965%0.647SS**Hα-helixtrans-70-40.4177.8-64.7165.8000111.3S19 A20 W21 L26 A27S19-I23 WeakPolarHBondContact O-CB 3.32Å; S19-I23 WeakPolarHBondContact O-CD1 3.4Å; S19-I23 WeakPolarHBondContact O-CG1 3.42Å; S19-I23 PolarHBondContact O-N 3.31Å; S19-I23 VanDerWaalsContact O-N 3.09Å; A20-I23 PolarHBondContact O-N 2.96Å; W21-I23 PolarHBondContact O-N 3.43Å; I23-L26 PolarHBondContact O-N 3.48Å; I23-A27 VanDerWaalsContact O-CB 3.29Å; I23-A27 WeakPolarHBondContact O-CB 2.98Å; I23-A27 PolarHBondContact O-N 2.98Å
24N50.8Low47.8Very low112 Ų112124.5 Ų124.560%0.59965%0.646SS**Hα-helixtrans-70.2-37175.8-82.5-13.8000112.2A20 W21 L26 A27 D28A20-N24 WeakPolarHBondContact O-CB 3.37Å; A20-N24 PolarHBondContact O-N 3.4Å; W21-N24 PolarHBondContact O-N 3.26Å; N24-L26 VanDerWaalsContact C-N 3.31Å; N24-L26 PolarHBondContact O-N 3.08Å; N24-A27 PolarHBondContact O-N 3.09Å; N24-D28 WeakPolarHBondContact O-CB 3.5Å; N24-D28 PolarHBondContact O-N 3.31Å
25T49.3Very low48.1Very low54 Ų54125.5 Ų125.533%0.33164%0.643SS.*Hα-helixtrans-67.6-35.8176.6-430000110.9W21 H29W21-T25 WeakPolarHBondContact O-CB 3.19Å; W21-T25 PolarHBondContact O-N 2.88Å; W21-T25 PolarHBondContact O-OG1 3.46Å; T25-H29 WeakPolarHBondContact O-CB 3.48Å; T25-H29 PolarHBondContact O-N 2.9Å; T25-H29 VanDerWaalsContact O-N 3.15Å; T25-H29 PolarHBondContact O-ND1 3.35Å
26L46.3Very low48.4Very low113 Ų113124 Ų12459%0.59264%0.637SS**Hα-helixtrans-72.3-37.9175.3-167.271.5000112.5V22 I23 N24 H29 H30V22-L26 VanDerWaalsContact O-CB 3.28Å; V22-L26 WeakPolarHBondContact O-CB 3.01Å; V22-L26 PolarHBondContact O-N 2.81Å; I23-L26 PolarHBondContact O-N 3.48Å; N24-L26 VanDerWaalsContact C-N 3.31Å; N24-L26 PolarHBondContact O-N 3.08Å; L26-H29 PolarHBondContact O-N 3.33Å; L26-H30 PolarHBondContact O-CD2 2.88Å; L26-H30 PolarHBondContact O-N 2.97Å
27A49.9Very low48.3Very low53 Ų53122.6 Ų122.644%0.43864%0.644SS.*Hα-helixtrans-70.2-36.9174.700000112.3I23 N24 H29 H30I23-A27 VanDerWaalsContact O-CB 3.29Å; I23-A27 WeakPolarHBondContact O-CB 2.98Å; I23-A27 PolarHBondContact O-N 2.98Å; N24-A27 PolarHBondContact O-N 3.09Å; A27-H29 VanDerWaalsContact C-N 3.29Å; A27-H29 PolarHBondContact O-N 3.36Å; A27-H30 PolarHBondContact O-N 3.43Å
28D46Very low48.6Very low110 Ų110115.5 Ų115.559%0.58864%0.638SS**Hα-helixtrans-67.9-30.3176.5-162.263.7000111.7N24N24-D28 WeakPolarHBondContact O-CB 3.5Å; N24-D28 PolarHBondContact O-N 3.31Å
29H48.4Very low49.1Very low134 Ų134111 Ų11162%0.6262%0.624SS**Hα-helixtrans-78.8-19174.3-7839.2000114.3T25 L26 A27T25-H29 WeakPolarHBondContact O-CB 3.48Å; T25-H29 PolarHBondContact O-N 2.9Å; T25-H29 VanDerWaalsContact O-N 3.15Å; T25-H29 PolarHBondContact O-ND1 3.35Å; L26-H29 PolarHBondContact O-N 3.33Å; A27-H29 VanDerWaalsContact C-N 3.29Å; A27-H29 PolarHBondContact O-N 3.36Å
30H47.9Very low49.7Very low159 Ų159112.1 Ų112.174%0.73663%0.629SS**Hα-helixtrans-87.6-7.5177.4-95.2-74.3000114.1L26 A27L26-H30 PolarHBondContact O-CD2 2.88Å; L26-H30 PolarHBondContact O-N 2.97Å; A27-H30 PolarHBondContact O-N 3.43Å
31H43.7Very low49.9Very low172 Ų172118.9 Ų118.980%0.79664%0.644SS**SBendtrans-103-0.4178-107.3-61.5000115.2
32R50.7Low50.8Low212 Ų212112.5 Ų112.580%0.862%0.623SS**  trans-106.378-175.9-146.6172.4177.1-176.5-2.1111
33G44.5Very low51.3Low64 Ų64115.5 Ų115.566%0.6663%0.631SS**  trans-176.624.7-176.600000118.2
34T47.6Very low51.8Low128 Ų128114.2 Ų114.279%0.78563%0.628SS**  trans-128.731.9160.648.50000112.1F36T34-F36 PolarHBondContact O-N 3.49Å; T34-F36 VanDerWaalsContact O-N 3.08Å
35D47.8Very low52.4Low138 Ų138113.5 Ų113.574%0.73862%0.623SS**  trans-85.946.9172.9-62.8-35.3000111.9
36F45.8Very low53Low161 Ų161116.5 Ų116.571%0.70664%0.636SS**  trans-89.914.1160.2-87.7-62.9000111.4T34 G38 L42T34-F36 PolarHBondContact O-N 3.49Å; T34-F36 VanDerWaalsContact O-N 3.08Å; F36-G38 PolarHBondContact O-N 3.48Å; F36-G38 VanDerWaalsContact O-N 3.09Å; F36-L42 HydrophobicContact CB-CD1 3.46Å; F36-L42 VanDerWaalsContact CB-CD1 3.46Å; F36-L42 HydrophobicContact CD1-CD1 3.4Å; F36-L42 HydrophobicContact CE1-CD1 4.36Å; F36-L42 HydrophobicContact CG-CD1 3.68Å; F36-L42 WeakPolarHBondContact O-CD1 3.18Å
37G51.6Low53.6Low81 Ų81113.4 Ų113.484%0.83563%0.627SS**THydrogen-bonded Turntrans-81.247.5176.700000114.1
38G51.8Low54Low66 Ų66118 Ų11868%0.6864%0.637SS**THydrogen-bonded Turntrans-169-7.8179.300000117.8F36 P40F36-G38 PolarHBondContact O-N 3.48Å; F36-G38 VanDerWaalsContact O-N 3.09Å; G38-P40 VanDerWaalsContact O-CD 3.32Å; G38-P40 WeakPolarHBondContact O-CD 2.83Å
39S57Low54.9Low61 Ų61115 Ų11543%0.42762%0.624SS.*  trans-85.4118176.6-89.40000111.3W41 L42S39-W41 PolarHBondContact O-N 3.46Å; S39-L42 PolarHBondContact O-N 3.08Å
40P62.2Low55.6Low98 Ų98112.6 Ų112.664%0.63662%0.619SS**Hα-helixtrans-52.6-28.5174.6-25.834.9000112.7G38 L42 H43 V44G38-P40 VanDerWaalsContact O-CD 3.32Å; G38-P40 WeakPolarHBondContact O-CD 2.83Å; P40-L42 PolarHBondContact O-N 3.37Å; P40-H43 PolarHBondContact O-N 2.88Å; P40-V44 WeakPolarHBondContact O-CG2 3.41Å; P40-V44 PolarHBondContact O-N 3.39Å; P40-V44 VanDerWaalsContact O-N 3.14Å
41W56Low56.6Low194 Ų194108.3 Ų108.374%0.73561%0.606SS**Hα-helixtrans-63.3-32.3177.2-88.975.1000114.8S39 V44 I45S39-W41 PolarHBondContact O-N 3.46Å; W41-V44 WeakPolarHBondContact O-CB 3.04Å; W41-V44 PolarHBondContact O-N 2.93Å; W41-I45 WeakPolarHBondContact O-CD1 3.39Å; W41-I45 WeakPolarHBondContact O-CG1 3.22Å; W41-I45 PolarHBondContact O-N 3.44Å
42L63.9Low58.1Low52 Ų52105.2 Ų105.227%0.27259%0.589SS.*Hα-helixtrans-74.4-36.2178-76.8172.1000112.4F36 S39 P40 V44 I45 I46F36-L42 HydrophobicContact CB-CD1 3.46Å; F36-L42 VanDerWaalsContact CB-CD1 3.46Å; F36-L42 HydrophobicContact CD1-CD1 3.4Å; F36-L42 HydrophobicContact CE1-CD1 4.36Å; F36-L42 HydrophobicContact CG-CD1 3.68Å; F36-L42 WeakPolarHBondContact O-CD1 3.18Å; S39-L42 PolarHBondContact O-N 3.08Å; P40-L42 PolarHBondContact O-N 3.37Å; L42-V44 VanDerWaalsContact C-N 3.27Å; L42-V44 PolarHBondContact O-N 3.22Å; L42-I45 HydrophobicContact CD2-CD1 4.41Å; L42-I45 PolarHBondContact O-N 2.58Å; L42-I46 WeakPolarHBondContact O-CG1 3.19Å; L42-I46 PolarHBondContact O-N 3.04Å
43H62.2Low59.4Low151 Ų151101 Ų10170%0.69958%0.576SS**Hα-helixtrans-60.2-41.1168.9-84.6-88.9000110.9P40 I46 A47P40-H43 PolarHBondContact O-N 2.88Å; H43-I46 PolarHBondContact O-N 2.83Å; H43-A47 WeakPolarHBondContact O-CA 3.35Å; H43-A47 WeakPolarHBondContact O-CB 3.32Å; H43-A47 PolarHBondContact O-N 3.09Å
44V63.7Low60.9Low85 Ų85101.8 Ų101.852%0.51557%0.568SS.*Hα-helixtrans-63.2-45.9174.2176.20000111P40 W41 L42 I46 F48P40-V44 WeakPolarHBondContact O-CG2 3.41Å; P40-V44 PolarHBondContact O-N 3.39Å; P40-V44 VanDerWaalsContact O-N 3.14Å; W41-V44 WeakPolarHBondContact O-CB 3.04Å; W41-V44 PolarHBondContact O-N 2.93Å; L42-V44 VanDerWaalsContact C-N 3.27Å; L42-V44 PolarHBondContact O-N 3.22Å; V44-I46 VanDerWaalsContact C-N 3.32Å; V44-I46 PolarHBondContact O-N 3.42Å; V44-F48 WeakPolarHBondContact O-CB 3.37Å; V44-F48 PolarHBondContact O-N 3.5Å
45I63.4Low62.4Low97 Ų97100.1 Ų100.150%0.49756%0.557SS.*Hα-helixtrans-66.2-29.3-178.7-67.2160.5000112.9W41 L42 P49W41-I45 WeakPolarHBondContact O-CD1 3.39Å; W41-I45 WeakPolarHBondContact O-CG1 3.22Å; W41-I45 PolarHBondContact O-N 3.44Å; L42-I45 HydrophobicContact CD2-CD1 4.41Å; L42-I45 PolarHBondContact O-N 2.58Å; I45-P49 WeakPolarHBondContact O-CD 3.33Å; I45-P49 WeakPolarHBondContact O-CG 3.39Å
46I62.6Low64.1Low117 Ų11797.5 Ų97.560%0.654%0.542SS*.Hα-helixtrans-91.6-38.8178.7-62.5168.9000111.9L42 H43 V44 P49 T50L42-I46 WeakPolarHBondContact O-CG1 3.19Å; L42-I46 PolarHBondContact O-N 3.04Å; H43-I46 PolarHBondContact O-N 2.83Å; V44-I46 VanDerWaalsContact C-N 3.32Å; V44-I46 PolarHBondContact O-N 3.42Å; I46-P49 WeakPolarHBondContact O-CD 3.47Å; I46-T50 PolarHBondContact O-OG1 2.83Å; I46-T50 VanDerWaalsContact O-OG1 3.08Å
47A59.3Low65.8Low48 Ų4893.8 Ų93.840%0.39753%0.533SS..Hα-helixtrans-72.5-39179.300000111.7H43 T50 S51H43-A47 WeakPolarHBondContact O-CA 3.35Å; H43-A47 WeakPolarHBondContact O-CB 3.32Å; H43-A47 PolarHBondContact O-N 3.09Å; A47-T50 PolarHBondContact O-N 3.01Å; A47-T50 VanDerWaalsContact O-N 3.09Å; A47-S51 WeakPolarHBondContact O-CB 3.14Å; A47-S51 PolarHBondContact O-N 3.05Å; A47-S51 PolarHBondContact O-OG 3.24Å
48F58.9Low67.2Low149 Ų14995.3 Ų95.365%0.65452%0.521SS*.Hα-helixtrans-60.1-41.3-178.4-167.1-90.9000112.6V44 T50 Y52V44-F48 WeakPolarHBondContact O-CB 3.37Å; V44-F48 PolarHBondContact O-N 3.5Å; F48-T50 VanDerWaalsContact C-N 3.33Å; F48-T50 PolarHBondContact O-N 3.46Å; F48-Y52 WeakPolarHBondContact O-CD1 3.25Å; F48-Y52 PolarHBondContact O-N 3.3Å
49P63.8Low68.8Low47 Ų47100.2 Ų100.231%0.30552%0.519SS..Hα-helixtrans-58.9-41171.5-29.936.1000115.5I45 I46 Y52 K53I45-P49 WeakPolarHBondContact O-CD 3.33Å; I45-P49 WeakPolarHBondContact O-CG 3.39Å; I46-P49 WeakPolarHBondContact O-CD 3.47Å; P49-Y52 HydrophobicContact CB-CD1 4.28Å; P49-Y52 HydrophobicContact CB-CE1 3.78Å; P49-Y52 WeakPolarHBondContact O-CD1 3.37Å; P49-Y52 WeakPolarHBondContact O-CE1 3.37Å; P49-K53 VanDerWaalsContact O-CG 3.32Å; P49-K53 WeakPolarHBondContact O-CG 3.5Å; P49-K53 PolarHBondContact O-N 2.82Å
50T62.4Low70.3Confident85 Ų85101.5 Ų101.552%0.52152%0.521SS..Hα-helixtrans-73.9-43.8-176.3-530000109.8I46 A47 F48 K53 V54I46-T50 PolarHBondContact O-OG1 2.83Å; I46-T50 VanDerWaalsContact O-OG1 3.08Å; A47-T50 PolarHBondContact O-N 3.01Å; A47-T50 VanDerWaalsContact O-N 3.09Å; F48-T50 VanDerWaalsContact C-N 3.33Å; F48-T50 PolarHBondContact O-N 3.46Å; T50-K53 PolarHBondContact O-N 3.22Å; T50-V54 WeakPolarHBondContact O-CG2 3.35Å; T50-V54 PolarHBondContact O-N 3.48Å; T50-V54 VanDerWaalsContact O-N 3.09Å
51S69Low71.6Confident68 Ų68100.7 Ų100.748%0.47651%0.514SS..Hα-helixtrans-63.5-44.7176.5-61.90000112.3A47 K53 V54 V55A47-S51 WeakPolarHBondContact O-CB 3.14Å; A47-S51 PolarHBondContact O-N 3.05Å; A47-S51 PolarHBondContact O-OG 3.24Å; S51-K53 VanDerWaalsContact C-N 3.29Å; S51-K53 PolarHBondContact O-N 3.27Å; S51-V54 PolarHBondContact O-N 3.15Å; S51-V55 WeakPolarHBondContact O-CG2 3.31Å; S51-V55 PolarHBondContact O-N 3.23Å
52Y76.9Confident73Confident108 Ų10899.2 Ų99.242%0.42451%0.509SS..Hα-helixtrans-63.4-38.2178.586.6-114.4000111.2F48 P49 V54 V55 I56F48-Y52 WeakPolarHBondContact O-CD1 3.25Å; F48-Y52 PolarHBondContact O-N 3.3Å; P49-Y52 HydrophobicContact CB-CD1 4.28Å; P49-Y52 HydrophobicContact CB-CE1 3.78Å; P49-Y52 WeakPolarHBondContact O-CD1 3.37Å; P49-Y52 WeakPolarHBondContact O-CE1 3.37Å; Y52-V54 VanDerWaalsContact C-N 3.33Å; Y52-V54 PolarHBondContact O-N 3.46Å; Y52-V55 PolarHBondContact O-N 3.5Å; Y52-I56 HydrophobicContact CD2-CD1 3.67Å; Y52-I56 HydrophobicContact CE2-CD1 4.26Å; Y52-I56 WeakPolarHBondContact O-CB 3.33Å; Y52-I56 VanDerWaalsContact O-CG1 3.22Å; Y52-I56 WeakPolarHBondContact O-CG1 3.27Å; Y52-I56 PolarHBondContact O-N 2.95Å
53K77.3Confident74.1Confident124 Ų124101.4 Ų101.454%0.53952%0.521SS..Hα-helixtrans-64-41.2178-75.9-178.9-179.7176.30111.2P49 T50 S51 T57P49-K53 VanDerWaalsContact O-CG 3.32Å; P49-K53 WeakPolarHBondContact O-CG 3.5Å; P49-K53 PolarHBondContact O-N 2.82Å; T50-K53 PolarHBondContact O-N 3.22Å; S51-K53 VanDerWaalsContact C-N 3.29Å; S51-K53 PolarHBondContact O-N 3.27Å; K53-T57 VanDerWaalsContact O-CB 3.28Å; K53-T57 WeakPolarHBondContact O-CB 3.45Å; K53-T57 PolarHBondContact O-N 3.32Å; K53-T57 PolarHBondContact O-OG1 3.33Å
54V76Confident75.3Confident79 Ų79102.3 Ų102.348%0.47952%0.518SS..Hα-helixtrans-63.8-47.7176.2173.70000110.5T50 S51 Y52 I56 T57 L58T50-V54 WeakPolarHBondContact O-CG2 3.35Å; T50-V54 PolarHBondContact O-N 3.48Å; T50-V54 VanDerWaalsContact O-N 3.09Å; S51-V54 PolarHBondContact O-N 3.15Å; Y52-V54 VanDerWaalsContact C-N 3.33Å; Y52-V54 PolarHBondContact O-N 3.46Å; V54-I56 PolarHBondContact O-N 3.25Å; V54-T57 PolarHBondContact O-N 2.93Å; V54-L58 HydrophobicContact CG1-CD1 3.81Å; V54-L58 HydrophobicContact CG1-CG 4.35Å; V54-L58 WeakPolarHBondContact O-CB 3.42Å; V54-L58 VanDerWaalsContact O-CG 3.3Å; V54-L58 WeakPolarHBondContact O-CG 3.28Å; V54-L58 PolarHBondContact O-N 3.32Å
55V79Confident76.3Confident94 Ų94102.2 Ų102.257%0.5752%0.518SS*.Hα-helixtrans-62.2-45.5179.2174.20000111.8S51 Y52 T57 L58 W59S51-V55 WeakPolarHBondContact O-CG2 3.31Å; S51-V55 PolarHBondContact O-N 3.23Å; Y52-V55 PolarHBondContact O-N 3.5Å; V55-T57 VanDerWaalsContact C-N 3.33Å; V55-T57 PolarHBondContact O-N 2.84Å; V55-L58 PolarHBondContact O-N 3.05Å; V55-W59 WeakPolarHBondContact O-CB 3.33Å; V55-W59 PolarHBondContact O-N 2.66Å
56I83Confident77.1Confident83 Ų8399.7 Ų99.743%0.42651%0.509SS..Hα-helixtrans-62.1-43.2176.7-69.2176000110.6Y52 V54 W59 I60Y52-I56 HydrophobicContact CD2-CD1 3.67Å; Y52-I56 HydrophobicContact CE2-CD1 4.26Å; Y52-I56 WeakPolarHBondContact O-CB 3.33Å; Y52-I56 VanDerWaalsContact O-CG1 3.22Å; Y52-I56 WeakPolarHBondContact O-CG1 3.27Å; Y52-I56 PolarHBondContact O-N 2.95Å; V54-I56 PolarHBondContact O-N 3.25Å; I56-W59 PolarHBondContact O-N 2.96Å; I56-I60 HydrophobicContact CG2-CD1 3.74Å; I56-I60 HydrophobicContact CG2-CG1 4.4Å; I56-I60 VanDerWaalsContact O-CG1 3.25Å; I56-I60 WeakPolarHBondContact O-CG1 3.42Å; I56-I60 PolarHBondContact O-N 2.89Å
57T80.9Confident78Confident83 Ų8398.6 Ų98.651%0.50950%0.504SS..Hα-helixtrans-64.7-44.8179.8-55.60000111K53 V54 V55 W59 I60 V61K53-T57 VanDerWaalsContact O-CB 3.28Å; K53-T57 WeakPolarHBondContact O-CB 3.45Å; K53-T57 PolarHBondContact O-N 3.32Å; K53-T57 PolarHBondContact O-OG1 3.33Å; V54-T57 PolarHBondContact O-N 2.93Å; V55-T57 VanDerWaalsContact C-N 3.33Å; V55-T57 PolarHBondContact O-N 2.84Å; T57-W59 VanDerWaalsContact C-N 3.34Å; T57-W59 PolarHBondContact O-N 3.36Å; T57-I60 PolarHBondContact O-N 3.48Å; T57-V61 VanDerWaalsContact O-CG2 3.31Å; T57-V61 WeakPolarHBondContact O-CG2 3.31Å; T57-V61 PolarHBondContact O-N 3.47Å
58L82.6Confident79.1Confident112 Ų112100.8 Ų100.859%0.58651%0.508SS*.Hα-helixtrans-61.3-42175.3-73.3171000111.8V54 V55 V61 Y62V54-L58 HydrophobicContact CG1-CD1 3.81Å; V54-L58 HydrophobicContact CG1-CG 4.35Å; V54-L58 WeakPolarHBondContact O-CB 3.42Å; V54-L58 VanDerWaalsContact O-CG 3.3Å; V54-L58 WeakPolarHBondContact O-CG 3.28Å; V54-L58 PolarHBondContact O-N 3.32Å; V55-L58 PolarHBondContact O-N 3.05Å; L58-V61 PolarHBondContact O-N 2.86Å; L58-Y62 VanDerWaalsContact O-CB 3.27Å; L58-Y62 WeakPolarHBondContact O-CB 3.37Å; L58-Y62 PolarHBondContact O-N 2.95Å
59W84.6Confident79.9Confident169 Ų169101.3 Ų101.364%0.6451%0.51SS*.Hα-helixtrans-64-42.6177.3-172.951.6000112V55 I56 T57 Y62 L63V55-W59 WeakPolarHBondContact O-CB 3.33Å; V55-W59 PolarHBondContact O-N 2.66Å; I56-W59 PolarHBondContact O-N 2.96Å; T57-W59 VanDerWaalsContact C-N 3.34Å; T57-W59 PolarHBondContact O-N 3.36Å; W59-Y62 PolarHBondContact O-N 2.94Å; W59-L63 HydrophobicContact CZ2-CD1 4.5Å; W59-L63 WeakPolarHBondContact O-CB 3.5Å; W59-L63 PolarHBondContact O-N 3.44Å
60I88.3Confident80.3Confident88 Ų88103.4 Ų103.445%0.45152%0.522SS..Hα-helixtrans-62.3-46.9175.9-69.5166.7000111I56 T57 L63 W64I56-I60 HydrophobicContact CG2-CD1 3.74Å; I56-I60 HydrophobicContact CG2-CG1 4.4Å; I56-I60 VanDerWaalsContact O-CG1 3.25Å; I56-I60 WeakPolarHBondContact O-CG1 3.42Å; I56-I60 PolarHBondContact O-N 2.89Å; T57-I60 PolarHBondContact O-N 3.48Å; I60-L63 PolarHBondContact O-N 2.94Å; I60-W64 WeakPolarHBondContact O-CB 3.3Å; I60-W64 PolarHBondContact O-N 3.39Å
61V88.8Confident80.8Confident81 Ų81104 Ų10449%0.49152%0.521SS..Hα-helixtrans-62.1-44.7178.3171.80000110.5T57 L58 L63 W64 V65T57-V61 VanDerWaalsContact O-CG2 3.31Å; T57-V61 WeakPolarHBondContact O-CG2 3.31Å; T57-V61 PolarHBondContact O-N 3.47Å; L58-V61 PolarHBondContact O-N 2.86Å; V61-L63 PolarHBondContact O-N 3.45Å; V61-W64 PolarHBondContact O-N 3.44Å; V61-V65 HydrophobicContact CG1-CG2 4.37Å; V61-V65 WeakPolarHBondContact O-CG2 3.19Å; V61-V65 PolarHBondContact O-N 3.4Å
62Y87Confident80.6Confident163 Ų163106.6 Ų106.664%0.63952%0.524SS*.Hα-helixtrans-61.1-44.2177.2-179.9-99.2000112.3L58 W59 W64 V65 S66L58-Y62 VanDerWaalsContact O-CB 3.27Å; L58-Y62 WeakPolarHBondContact O-CB 3.37Å; L58-Y62 PolarHBondContact O-N 2.95Å; W59-Y62 PolarHBondContact O-N 2.94Å; Y62-W64 VanDerWaalsContact C-N 3.33Å; Y62-W64 PolarHBondContact O-N 3.29Å; Y62-V65 PolarHBondContact O-N 2.77Å; Y62-S66 VanDerWaalsContact O-CB 3.31Å; Y62-S66 WeakPolarHBondContact O-CB 3.49Å; Y62-S66 PolarHBondContact O-N 3.03Å; Y62-S66 PolarHBondContact O-OG 3.09Å
63L86.4Confident79.5Confident99 Ų99111.9 Ų111.952%0.51854%0.543SS..Hα-helixtrans-63-41.5177.4-147.8100.3000111.1W59 I60 V61 S66 L67W59-L63 HydrophobicContact CZ2-CD1 4.5Å; W59-L63 WeakPolarHBondContact O-CB 3.5Å; W59-L63 PolarHBondContact O-N 3.44Å; I60-L63 PolarHBondContact O-N 2.94Å; V61-L63 PolarHBondContact O-N 3.45Å; L63-S66 PolarHBondContact O-N 3.44Å; L63-L67 WeakPolarHBondContact O-CB 3.39Å; L63-L67 PolarHBondContact O-N 3.45Å
64W86.4Confident78.5Confident169 Ų169110 Ų11064%0.6455%0.546SS*.Hα-helixtrans-65-46.6177-107.983.4000112.6I60 V61 Y62 S66 L67 L68I60-W64 WeakPolarHBondContact O-CB 3.3Å; I60-W64 PolarHBondContact O-N 3.39Å; V61-W64 PolarHBondContact O-N 3.44Å; Y62-W64 VanDerWaalsContact C-N 3.33Å; Y62-W64 PolarHBondContact O-N 3.29Å; W64-S66 VanDerWaalsContact C-N 3.3Å; W64-S66 PolarHBondContact O-N 3.44Å; W64-L67 PolarHBondContact O-N 2.89Å; W64-L68 HydrophobicContact CE3-CD1 3.64Å; W64-L68 HydrophobicContact CE3-CG 4.21Å; W64-L68 HydrophobicContact CZ3-CD1 4.17Å; W64-L68 WeakPolarHBondContact O-CB 3.22Å; W64-L68 WeakPolarHBondContact O-CD1 3.29Å; W64-L68 WeakPolarHBondContact O-CG 3.28Å; W64-L68 PolarHBondContact O-N 3.31Å
65V84.7Confident77.3Confident84 Ų84114.8 Ų114.851%0.50956%0.555SS.*Hα-helixtrans-63.3-38.9177.2172.40000110.8V61 Y62 L68 K69V61-V65 HydrophobicContact CG1-CG2 4.37Å; V61-V65 WeakPolarHBondContact O-CG2 3.19Å; V61-V65 PolarHBondContact O-N 3.4Å; Y62-V65 PolarHBondContact O-N 2.77Å; V65-L68 PolarHBondContact O-N 2.88Å; V65-K69 VanDerWaalsContact O-CB 3.23Å; V65-K69 WeakPolarHBondContact O-CB 3.23Å; V65-K69 PolarHBondContact O-N 3.47Å
66S81.9Confident76.1Confident44 Ų44115.2 Ų115.231%0.30855%0.554SS.*Hα-helixtrans-65.3-41.6176.3-60.10000112.1Y62 L63 W64 K69 T70Y62-S66 VanDerWaalsContact O-CB 3.31Å; Y62-S66 WeakPolarHBondContact O-CB 3.49Å; Y62-S66 PolarHBondContact O-N 3.03Å; Y62-S66 PolarHBondContact O-OG 3.09Å; L63-S66 PolarHBondContact O-N 3.44Å; W64-S66 VanDerWaalsContact C-N 3.3Å; W64-S66 PolarHBondContact O-N 3.44Å; S66-K69 PolarHBondContact O-N 3.09Å; S66-T70 WeakPolarHBondContact O-CG2 3.41Å; S66-T70 PolarHBondContact O-N 2.86Å; S66-T70 PolarHBondContact O-OG1 2.9Å; S66-T70 VanDerWaalsContact O-OG1 3.05Å
67L80.9Confident74.6Confident94 Ų94114.2 Ų114.249%0.49257%0.565SS.*Hα-helixtrans-69.1-39.8175.8-166.4125.1000112.1L63 W64 T70 I71L63-L67 WeakPolarHBondContact O-CB 3.39Å; L63-L67 PolarHBondContact O-N 3.45Å; W64-L67 PolarHBondContact O-N 2.89Å; L67-T70 WeakPolarHBondContact CA-OG1 3.31Å; L67-T70 PolarHBondContact O-N 3.39Å; L67-T70 PolarHBondContact O-OG1 3.13Å; L67-I71 HydrophobicContact CD2-CD1 3.65Å; L67-I71 HydrophobicContact CG-CD1 4.25Å; L67-I71 VanDerWaalsContact O-CG1 3.26Å; L67-I71 WeakPolarHBondContact O-CG1 3.43Å; L67-I71 PolarHBondContact O-N 3.34Å
68L82.4Confident73.3Confident93 Ų93115.5 Ų115.549%0.48757%0.565SS.*Hα-helixtrans-62.4-43.2172.9-85155.5000111.6W64 V65 I71 F72W64-L68 HydrophobicContact CE3-CD1 3.64Å; W64-L68 HydrophobicContact CE3-CG 4.21Å; W64-L68 HydrophobicContact CZ3-CD1 4.17Å; W64-L68 WeakPolarHBondContact O-CB 3.22Å; W64-L68 WeakPolarHBondContact O-CD1 3.29Å; W64-L68 WeakPolarHBondContact O-CG 3.28Å; W64-L68 PolarHBondContact O-N 3.31Å; V65-L68 PolarHBondContact O-N 2.88Å; L68-I71 PolarHBondContact O-N 3.2Å; L68-F72 VanDerWaalsContact O-CB 3.31Å; L68-F72 WeakPolarHBondContact O-CB 3.3Å; L68-F72 PolarHBondContact O-N 3.21Å
69K75.4Confident71.9Confident160 Ų160116.2 Ų116.270%0.69657%0.569SS**Hα-helixtrans-64.7-41.3179.4-172.9164.1176.7164.70111.8V65 S66 F72 W73V65-K69 VanDerWaalsContact O-CB 3.23Å; V65-K69 WeakPolarHBondContact O-CB 3.23Å; V65-K69 PolarHBondContact O-N 3.47Å; S66-K69 PolarHBondContact O-N 3.09Å; K69-F72 PolarHBondContact O-N 2.92Å; K69-W73 VanDerWaalsContact O-CB 3.28Å; K69-W73 WeakPolarHBondContact O-CB 3.21Å; K69-W73 PolarHBondContact O-N 3.44Å
70T72.4Confident70.4Confident91 Ų91111 Ų11156%0.55857%0.567SS**Hα-helixtrans-65.9-41.5175.247.70000112.6S66 L67 S74S66-T70 WeakPolarHBondContact O-CG2 3.41Å; S66-T70 PolarHBondContact O-N 2.86Å; S66-T70 PolarHBondContact O-OG1 2.9Å; S66-T70 VanDerWaalsContact O-OG1 3.05Å; L67-T70 WeakPolarHBondContact CA-OG1 3.31Å; L67-T70 PolarHBondContact O-N 3.39Å; L67-T70 PolarHBondContact O-OG1 3.13Å; T70-S74 WeakPolarHBondContact O-CB 3.35Å; T70-S74 PolarHBondContact O-N 2.83Å
71I72.6Confident68.9Low97 Ų97109.4 Ų109.450%0.49756%0.564SS.*Hα-helixtrans-66.3-42.8175.9-67.2168.2000111.6L67 L68 S74 R75L67-I71 HydrophobicContact CD2-CD1 3.65Å; L67-I71 HydrophobicContact CG-CD1 4.25Å; L67-I71 VanDerWaalsContact O-CG1 3.26Å; L67-I71 WeakPolarHBondContact O-CG1 3.43Å; L67-I71 PolarHBondContact O-N 3.34Å; L68-I71 PolarHBondContact O-N 3.2Å; I71-S74 WeakPolarHBondContact O-CB 3.26Å; I71-S74 PolarHBondContact O-N 3.45Å; I71-R75 PolarHBondContact O-N 3.33Å; I71-R75 VanDerWaalsContact O-N 3.12Å
72F64.6Low67.4Low124 Ų124108.6 Ų108.654%0.54456%0.56SS.*Hα-helixtrans-70.3-37.2-178-161.2-99.9000111.9L68 K69 S74 R75 N76L68-F72 VanDerWaalsContact O-CB 3.31Å; L68-F72 WeakPolarHBondContact O-CB 3.3Å; L68-F72 PolarHBondContact O-N 3.21Å; K69-F72 PolarHBondContact O-N 2.92Å; F72-S74 VanDerWaalsContact C-N 3.35Å; F72-R75 PolarHBondContact O-N 2.95Å; F72-R75 VanDerWaalsContact O-N 3.13Å; F72-N76 VanDerWaalsContact CE1-ND2 3.25Å; F72-N76 WeakPolarHBondContact CE1-ND2 3.41Å; F72-N76 PolarHBondContact O-N 3.14Å
73W54.8Low66.2Low219 Ų219104.8 Ų104.883%0.8355%0.55SS**Hα-helixtrans-67.8-36.2174.2-152.635.2000112K69 R75 G77K69-W73 VanDerWaalsContact O-CB 3.28Å; K69-W73 WeakPolarHBondContact O-CB 3.21Å; K69-W73 PolarHBondContact O-N 3.44Å; W73-R75 PolarHBondContact O-N 3.43Å; W73-G77 PolarHBondContact O-N 2.88Å
74S56.4Low64.9Low85 Ų85104.8 Ų104.859%0.59455%0.554SS**Hα-helixtrans-63.3-26.1170.4176.50000113.4T70 I71 F72T70-S74 WeakPolarHBondContact O-CB 3.35Å; T70-S74 PolarHBondContact O-N 2.83Å; I71-S74 WeakPolarHBondContact O-CB 3.26Å; I71-S74 PolarHBondContact O-N 3.45Å; F72-S74 VanDerWaalsContact C-N 3.35Å
75R51.4Low63.6Low179 Ų179103.4 Ų103.468%0.67556%0.555SS**Hα-helixtrans-87.9-40.5-179.4-162.214585.9176.18.6112.5I71 F72 W73 G77I71-R75 PolarHBondContact O-N 3.33Å; I71-R75 VanDerWaalsContact O-N 3.12Å; F72-R75 PolarHBondContact O-N 2.95Å; F72-R75 VanDerWaalsContact O-N 3.13Å; W73-R75 PolarHBondContact O-N 3.43Å; R75-G77 VanDerWaalsContact C-N 3.34Å; R75-G77 PolarHBondContact O-N 3.4Å
76N52.2Low62.5Low102 Ų102104.3 Ų104.355%0.54555%0.553SS.*Hα-helixtrans-75.9-17-178.7-77.916.3000114.4F72F72-N76 VanDerWaalsContact CE1-ND2 3.25Å; F72-N76 WeakPolarHBondContact CE1-ND2 3.41Å; F72-N76 PolarHBondContact O-N 3.14Å
77G52.5Low61.8Low63 Ų63110.2 Ų110.265%0.64957%0.569SS**THydrogen-bonded Turntrans-88.1-2.4177.600000115.6W73 R75W73-G77 PolarHBondContact O-N 2.88Å; R75-G77 VanDerWaalsContact C-N 3.34Å; R75-G77 PolarHBondContact O-N 3.4Å
78H52.9Low60.9Low109 Ų109108.4 Ų108.451%0.50557%0.568SS.*SBendtrans-110.6-4.6-167.4-117.614.2000116.1G80 T82H78-G80 PolarHBondContact O-N 3.11Å; H78-T82 PolarHBondContact O-OG1 3.08Å
79D52.4Low60.1Low128 Ų128111.3 Ų111.368%0.68457%0.572SS**THydrogen-bonded Turntrans-78.6-17.1-174.1-74.6-16.8000114.1
80G54.8Low59.4Low58 Ų58111.2 Ų111.260%0.59857%0.567SS**THydrogen-bonded Turntrans-91.5-30.9174.900000114.7H78H78-G80 PolarHBondContact O-N 3.11Å
81S55.1Low58.8Low55 Ų55110.9 Ų110.939%0.38557%0.569SS.*Hα-helixtrans-81.4-33.9-172.9176.60000112.7Q85S81-Q85 WeakPolarHBondContact O-CB 3.47Å; S81-Q85 WeakPolarHBondContact O-CG 3.34Å; S81-Q85 PolarHBondContact O-N 3.05Å
82T57.9Low58.4Low65 Ų65110.9 Ų110.940%0.39957%0.57SS.*Hα-helixtrans-69.3-37.9-178.140.30000112.4H78 Q85 Q86H78-T82 PolarHBondContact O-OG1 3.08Å; T82-Q85 PolarHBondContact O-N 3.27Å; T82-Q86 WeakPolarHBondContact O-CB 3.35Å; T82-Q86 PolarHBondContact O-N 2.9Å
83D61.8Low58.1Low82 Ų82111.4 Ų111.444%0.43957%0.568SS.*Hα-helixtrans-65.1-42.4176.6-170.962.5000112Q86 R87D83-Q86 PolarHBondContact O-N 3.43Å; D83-R87 WeakPolarHBondContact O-CB 3.23Å; D83-R87 PolarHBondContact O-N 2.82Å; D83-R87 IonicContact OD2-CZ 3.51Å; D83-R87 IonicContact OD2-NE 3.7Å; D83-R87 IonicContact OD2-NH2 2.88Å; D83-R87 PolarHBondContact OD2-NH2 3.06Å
84V59.9Low58.4Low99 Ų99111 Ų11160%0.657%0.566SS**Hα-helixtrans-66.4-44.6178.5179.90000111R87 A88V84-R87 PolarHBondContact O-N 3.37Å; V84-A88 WeakPolarHBondContact O-CB 3.45Å; V84-A88 PolarHBondContact O-N 3.48Å
85Q58.1Low58.3Low141 Ų141116.2 Ų116.266%0.65957%0.573SS**Hα-helixtrans-67.3-36.2177.1-70.8-146.4-20.200112.3S81 T82 W89S81-Q85 WeakPolarHBondContact O-CB 3.47Å; S81-Q85 WeakPolarHBondContact O-CG 3.34Å; S81-Q85 PolarHBondContact O-N 3.05Å; T82-Q85 PolarHBondContact O-N 3.27Å; Q85-W89 WeakPolarHBondContact O-CB 3.45Å; Q85-W89 PolarHBondContact O-N 2.98Å
86Q62.5Low58.4Low102 Ų102112.4 Ų112.448%0.47756%0.563SS.*Hα-helixtrans-73.4-33.6178.3-166.8156-27.500112.1T82 D83 R90T82-Q86 WeakPolarHBondContact O-CB 3.35Å; T82-Q86 PolarHBondContact O-N 2.9Å; D83-Q86 PolarHBondContact O-N 3.43Å; Q86-R90 WeakPolarHBondContact O-CG 3.31Å; Q86-R90 PolarHBondContact O-N 3.34Å
87R67Low58.6Low169 Ų169113 Ų11364%0.63856%0.563SS**Hα-helixtrans-69-43.7171.9-167.6175-64.6-173.34.7111.5D83 V84 W89 R90 S91D83-R87 WeakPolarHBondContact O-CB 3.23Å; D83-R87 PolarHBondContact O-N 2.82Å; D83-R87 IonicContact OD2-CZ 3.51Å; D83-R87 IonicContact OD2-NE 3.7Å; D83-R87 IonicContact OD2-NH2 2.88Å; D83-R87 PolarHBondContact OD2-NH2 3.06Å; V84-R87 PolarHBondContact O-N 3.37Å; R87-W89 VanDerWaalsContact C-N 3.34Å; R87-W89 PolarHBondContact O-N 3.5Å; R87-R90 PolarHBondContact O-N 2.95Å; R87-S91 PolarHBondContact O-N 2.91Å; R87-S91 VanDerWaalsContact O-N 3.13Å
88A62.5Low58.8Low56 Ų56112.5 Ų112.546%0.46356%0.557SS.*Hα-helixtrans-62.7-40.6172.900000111.8V84 S91 N92V84-A88 WeakPolarHBondContact O-CB 3.45Å; V84-A88 PolarHBondContact O-N 3.48Å; A88-S91 PolarHBondContact O-N 2.85Å; A88-N92 PolarHBondContact O-N 2.87Å
89W65.8Low58.6Low153 Ų153112.9 Ų112.958%0.5856%0.562SS**Hα-helixtrans-66.3-41.7177.9-173.285000112.7Q85 R87 S91 N92 R93Q85-W89 WeakPolarHBondContact O-CB 3.45Å; Q85-W89 PolarHBondContact O-N 2.98Å; R87-W89 VanDerWaalsContact C-N 3.34Å; R87-W89 PolarHBondContact O-N 3.5Å; W89-S91 VanDerWaalsContact C-N 3.32Å; W89-S91 PolarHBondContact O-N 3.33Å; W89-N92 PolarHBondContact O-N 3.43Å; W89-R93 WeakPolarHBondContact O-CB 3.28Å; W89-R93 PolarHBondContact O-N 3.42Å
90R59.8Low58.5Low158 Ų158115.6 Ų115.660%0.59656%0.563SS**Hα-helixtrans-62.8-38174.4-79.7-173.4-178.2142.4-1.4112.4Q86 R87Q86-R90 WeakPolarHBondContact O-CG 3.31Å; Q86-R90 PolarHBondContact O-N 3.34Å; R87-R90 PolarHBondContact O-N 2.95Å
91S59.8Low58.3Low84 Ų84117.8 Ų117.859%0.58757%0.569SS**Hα-helixtrans-66.6-45.6175.6179.40000112.1R87 A88 W89 R93 R94 R95R87-S91 PolarHBondContact O-N 2.91Å; R87-S91 VanDerWaalsContact O-N 3.13Å; A88-S91 PolarHBondContact O-N 2.85Å; W89-S91 VanDerWaalsContact C-N 3.32Å; W89-S91 PolarHBondContact O-N 3.33Å; S91-R93 VanDerWaalsContact C-N 3.33Å; S91-R93 PolarHBondContact O-N 3.41Å; S91-R94 PolarHBondContact O-N 3.39Å; S91-R95 PolarHBondContact O-N 2.9Å
92N63.4Low58.2Low98 Ų98121.9 Ų121.952%0.52459%0.585SS.*Hα-helixtrans-69.6-29.5-178.9-122.8-22.8000113.1A88 W89 R95 Q96A88-N92 PolarHBondContact O-N 2.87Å; W89-N92 PolarHBondContact O-N 3.43Å; N92-R95 PolarHBondContact O-N 3.24Å; N92-Q96 PolarHBondContact O-N 2.96Å
93R60.1Low57.8Low134 Ų134123.4 Ų123.451%0.50660%0.598SS.*Hα-helixtrans-65.7-43.5177.6-170.8166.3-177.8168.80.8112.5W89 S91 R95 Q96 E97W89-R93 WeakPolarHBondContact O-CB 3.28Å; W89-R93 PolarHBondContact O-N 3.42Å; S91-R93 VanDerWaalsContact C-N 3.33Å; S91-R93 PolarHBondContact O-N 3.41Å; R93-R95 VanDerWaalsContact C-N 3.32Å; R93-R95 PolarHBondContact O-N 3.29Å; R93-Q96 PolarHBondContact O-N 2.93Å; R93-E97 IonicContact NE-OE1 3.76Å; R93-E97 PolarHBondContact O-N 3.29Å; R93-E97 VanDerWaalsContact O-N 3.07Å
94R59.9Low57.4Low210 Ų210127.9 Ų127.979%0.79262%0.618SS**Hα-helixtrans-63.9-36.7174.9-69-170.7-176.7-174.51.3112.2S91S91-R94 PolarHBondContact O-N 3.39Å
95R55.4Low56.7Low196 Ų196131 Ų13174%0.7463%0.626SS**Hα-helixtrans-71.4-33176.7-134.7-175.2-168.2-169.84.1112.9S91 N92 R93 L99S91-R95 PolarHBondContact O-N 2.9Å; N92-R95 PolarHBondContact O-N 3.24Å; R93-R95 VanDerWaalsContact C-N 3.32Å; R93-R95 PolarHBondContact O-N 3.29Å; R95-L99 PolarHBondContact O-N 3.49Å
96Q52.9Low56.5Low99 Ų99130.5 Ų130.546%0.46363%0.632SS.*Hα-helixtrans-75.8-28.3175.3-80-14710.900113.9N92 R93 G98 L99 R100N92-Q96 PolarHBondContact O-N 2.96Å; R93-Q96 PolarHBondContact O-N 2.93Å; Q96-G98 VanDerWaalsContact C-N 3.26Å; Q96-G98 PolarHBondContact O-N 3.11Å; Q96-L99 PolarHBondContact O-N 3.41Å; Q96-R100 VanDerWaalsContact O-CB 3.24Å; Q96-R100 WeakPolarHBondContact O-CB 3.34Å; Q96-R100 VanDerWaalsContact O-CG 3.26Å; Q96-R100 WeakPolarHBondContact O-CG 3.33Å; Q96-R100 PolarHBondContact O-N 3.01Å
97E55.7Low55.6Low115 Ų115135.3 Ų135.354%0.53765%0.652SS.*Hα-helixtrans-64.8-31.5174-77.2162.5-173.800111.8R93R93-E97 IonicContact NE-OE1 3.76Å; R93-E97 PolarHBondContact O-N 3.29Å; R93-E97 VanDerWaalsContact O-N 3.07Å
98G56.8Low54.6Low52 Ų52137 Ų13754%0.53666%0.663SS.*Hα-helixtrans-77.5-24171.500000115.6Q96Q96-G98 VanDerWaalsContact C-N 3.26Å; Q96-G98 PolarHBondContact O-N 3.11Å
99L50.2Low53.8Low116 Ų116146 Ų14661%0.60769%0.686SS**Hα-helixtrans-94-18.5177.8-79.2165.9000113.6R95 Q96 S101 I102R95-L99 PolarHBondContact O-N 3.49Å; Q96-L99 PolarHBondContact O-N 3.41Å; L99-S101 PolarHBondContact O-N 3.47Å; L99-I102 PolarHBondContact O-N 2.95Å
100R48.7Very low52.8Low186 Ų186145.4 Ų145.470%0.70270%0.698SS**THydrogen-bonded Turntrans-69.9-15.1-179-93179.5177.3-160.2-1.5114.3Q96 I102Q96-R100 VanDerWaalsContact O-CB 3.24Å; Q96-R100 WeakPolarHBondContact O-CB 3.34Å; Q96-R100 VanDerWaalsContact O-CG 3.26Å; Q96-R100 WeakPolarHBondContact O-CG 3.33Å; Q96-R100 PolarHBondContact O-N 3.01Å; R100-I102 VanDerWaalsContact C-N 3.34Å
101S50.5Low52.3Low103 Ų103143.1 Ų143.172%0.7271%0.706SS**THydrogen-bonded Turntrans-80.9-11.1173.855.10000113.7L99L99-S101 PolarHBondContact O-N 3.47Å
102I53.4Low52Low142 Ų142144.3 Ų144.373%0.72872%0.715SS**THydrogen-bonded Turntrans-115.2-17.1-170.7-59.9175.4000113.8L99 R100L99-I102 PolarHBondContact O-N 2.95Å; R100-I102 VanDerWaalsContact C-N 3.34Å
103C50.8Low51.4Low97 Ų97149.1 Ų149.166%0.65573%0.731SS**  trans-134.686.6-174.7-171.50000113.3
104M51.6Low51.1Low175 Ų175153.8 Ų153.886%0.86275%0.749SS**  trans-93.194151.5-86.2-141.980.900108.7
105H46.6Very low50.8Low166 Ų166146.3 Ų146.377%0.76974%0.738SS**  trans-148.6115.7151.2-94.4-72.7000111.3
106T54.3Low51Low129 Ų129143.7 Ų143.779%0.79174%0.738SS**  trans36.990.2156.256.50000118.9
107K42.2Very low51.3Low204 Ų204145.9 Ų145.989%0.88775%0.746SS**  trans-101.1102.3151.7-92.8-176.1177.3178.30110.3R109K107-R109 PolarHBondContact O-N 3.48Å
108K47.2Very low51.5Low204 Ų204145.7 Ų145.789%0.88775%0.748SS**  trans-54.8118163.2-87.4-176.3176.6177.40108.4V110K108-V110 PolarHBondContact O-N 3.03Å
109R45.8Very low51.8Low246 Ų246147.7 Ų147.793%0.92875%0.749SS**  trans-75.1108.5169.7-69.5-172.4-179.8-171.31.7108K107 S111K107-R109 PolarHBondContact O-N 3.48Å; R109-S111 PolarHBondContact O-N 2.89Å
110V44.9Very low52.8Low139 Ų139147.4 Ų147.484%0.84275%0.748SS**  trans-64.7115.9162.4177.90000106.7K108 S112K108-V110 PolarHBondContact O-N 3.03Å; V110-S112 PolarHBondContact O-N 3.43Å
111S48.5Very low53.9Low110 Ų110145.4 Ų145.477%0.76974%0.744SS**  trans-62.5116.1-179.252.70000110.2R109 F113R109-S111 PolarHBondContact O-N 2.89Å; S111-F113 PolarHBondContact O-N 3.12Å
112S53.2Low55.1Low110 Ų110145 Ų14577%0.76973%0.734SS**  trans-68.9119.3173.745.50000110.8V110V110-S112 PolarHBondContact O-N 3.43Å
113F51.8Low56.3Low198 Ų198142.4 Ų142.487%0.86873%0.725SS**  trans12.9109.4163.7-91.8-101.7000118.1S111S111-F113 PolarHBondContact O-N 3.12Å
114R53.3Low57.8Low233 Ų233141.4 Ų141.488%0.87971%0.712SS**SBendtrans-87.34.2178.9-156.4177.4-172.1-135.93.6114.2
115G53.7Low59.4Low53 Ų53137 Ų13755%0.54670%0.695SS.*SBendtrans-81.8-37-168.600000116.4
116N58.8Low61.3Low141 Ų141134.5 Ų134.575%0.75469%0.687SS**SBendtrans-98-5.5-166.6-116.727.8000115.9
117K59.1Low62.9Low145 Ų145136.3 Ų136.363%0.6368%0.679SS**Hα-helixtrans-80.4-18.7-175.9-72.5-179.7-179.3175.20113.9K121K117-K121 WeakPolarHBondContact O-CD 3.38Å; K117-K121 VanDerWaalsContact O-CG 3.22Å; K117-K121 WeakPolarHBondContact O-CG 3.48Å
118I61.2Low65Low111 Ų111134.8 Ų134.857%0.56967%0.667SS**Hα-helixtrans-79-53-177.1-61.1171.4000109.5L120 K121 D122I118-L120 PolarHBondContact O-N 3.13Å; I118-K121 WeakPolarHBondContact O-CB 3.32Å; I118-K121 PolarHBondContact O-N 3.33Å; I118-K121 VanDerWaalsContact O-N 3.14Å; I118-D122 PolarHBondContact O-N 3.26Å; I118-D122 VanDerWaalsContact O-N 3.13Å
119V61.2Low67Low93 Ų93129.5 Ų129.556%0.56465%0.646SS**Hα-helixtrans-59.9-42.6-178.9-177.10000112.6K121 D122 V123V119-K121 VanDerWaalsContact C-N 3.34Å; V119-K121 PolarHBondContact O-N 3.36Å; V119-D122 PolarHBondContact O-N 3.33Å; V119-V123 VanDerWaalsContact O-CG2 3.31Å; V119-V123 WeakPolarHBondContact O-CG2 3.5Å; V119-V123 PolarHBondContact O-N 3.44Å; V119-V123 VanDerWaalsContact O-N 3.08Å
120L72.6Confident69.2Low110 Ų110121.5 Ų121.558%0.57662%0.624SS**Hα-helixtrans-65.7-37.2179.2-176.564000112.3I118 I124I118-L120 PolarHBondContact O-N 3.13Å; L120-I124 HydrophobicContact CD1-CD1 4.18Å; L120-I124 HydrophobicContact CD1-CG1 4.49Å; L120-I124 HydrophobicContact CG-CD1 3.93Å; L120-I124 WeakPolarHBondContact O-CD1 3.38Å; L120-I124 WeakPolarHBondContact O-CG1 3.38Å; L120-I124 PolarHBondContact O-N 3.01Å; L120-I124 VanDerWaalsContact O-N 3.11Å
121K71.7Confident71.2Confident144 Ų144118.4 Ų118.463%0.62660%0.6SS**Hα-helixtrans-64-45.4176.6-78.3176.8179.4-173.20110.7K117 I118 V119 V123 I124 T125K117-K121 WeakPolarHBondContact O-CD 3.38Å; K117-K121 VanDerWaalsContact O-CG 3.22Å; K117-K121 WeakPolarHBondContact O-CG 3.48Å; I118-K121 WeakPolarHBondContact O-CB 3.32Å; I118-K121 PolarHBondContact O-N 3.33Å; I118-K121 VanDerWaalsContact O-N 3.14Å; V119-K121 VanDerWaalsContact C-N 3.34Å; V119-K121 PolarHBondContact O-N 3.36Å; K121-V123 PolarHBondContact O-N 2.89Å; K121-I124 PolarHBondContact O-N 3.46Å; K121-T125 PolarHBondContact O-N 3Å; K121-T125 PolarHBondContact O-OG1 3.48Å
122D76.4Confident73.3Confident96 Ų96117.2 Ų117.251%0.51359%0.589SS.*Hα-helixtrans-62.9-41.7-178.8-68-22.3000112I118 V119 T125 L126I118-D122 PolarHBondContact O-N 3.26Å; I118-D122 VanDerWaalsContact O-N 3.13Å; V119-D122 PolarHBondContact O-N 3.33Å; D122-T125 VanDerWaalsContact CA-OG1 3.23Å; D122-T125 WeakPolarHBondContact CA-OG1 3.25Å; D122-T125 PolarHBondContact O-N 2.86Å; D122-T125 PolarHBondContact O-OG1 2.88Å; D122-L126 VanDerWaalsContact O-CB 3.3Å; D122-L126 WeakPolarHBondContact O-CB 3.26Å; D122-L126 PolarHBondContact O-N 3.25Å
123V77.9Confident75.2Confident87 Ų87117.9 Ų117.953%0.52758%0.578SS.*Hα-helixtrans-63.8-41.9175.5173.10000111.6V119 K121 L126 R127V119-V123 VanDerWaalsContact O-CG2 3.31Å; V119-V123 WeakPolarHBondContact O-CG2 3.5Å; V119-V123 PolarHBondContact O-N 3.44Å; V119-V123 VanDerWaalsContact O-N 3.08Å; K121-V123 PolarHBondContact O-N 2.89Å; V123-L126 PolarHBondContact O-N 3.43Å; V123-R127 WeakPolarHBondContact O-CB 3.4Å; V123-R127 PolarHBondContact O-N 3.17Å
124I82Confident77.2Confident75 Ų75112 Ų11239%0.38556%0.558SS.*Hα-helixtrans-67.2-41.7178.2-67.8166.7000110.9L120 K121 R127 R128L120-I124 HydrophobicContact CD1-CD1 4.18Å; L120-I124 HydrophobicContact CD1-CG1 4.49Å; L120-I124 HydrophobicContact CG-CD1 3.93Å; L120-I124 WeakPolarHBondContact O-CD1 3.38Å; L120-I124 WeakPolarHBondContact O-CG1 3.38Å; L120-I124 PolarHBondContact O-N 3.01Å; L120-I124 VanDerWaalsContact O-N 3.11Å; K121-I124 PolarHBondContact O-N 3.46Å; I124-R127 PolarHBondContact O-N 3.23Å; I124-R128 WeakPolarHBondContact O-CG 3.32Å; I124-R128 PolarHBondContact O-N 2.92Å
125T85.5Confident78.8Confident84 Ų84109.4 Ų109.452%0.51555%0.548SS..Hα-helixtrans-64.9-41.3175.736.50000112.1K121 D122 R128 H129K121-T125 PolarHBondContact O-N 3Å; K121-T125 PolarHBondContact O-OG1 3.48Å; D122-T125 VanDerWaalsContact CA-OG1 3.23Å; D122-T125 WeakPolarHBondContact CA-OG1 3.25Å; D122-T125 PolarHBondContact O-N 2.86Å; D122-T125 PolarHBondContact O-OG1 2.88Å; T125-R128 PolarHBondContact O-N 3.49Å; T125-H129 WeakPolarHBondContact O-CB 3.33Å; T125-H129 PolarHBondContact O-N 3.44Å
126L85.1Confident80.6Confident113 Ų113109.3 Ų109.359%0.59254%0.542SS*.Hα-helixtrans-63.7-44.2177.9-172.264.6000111D122 V123 R128 H129 V130D122-L126 VanDerWaalsContact O-CB 3.3Å; D122-L126 WeakPolarHBondContact O-CB 3.26Å; D122-L126 PolarHBondContact O-N 3.25Å; V123-L126 PolarHBondContact O-N 3.43Å; L126-R128 PolarHBondContact O-N 3.4Å; L126-H129 PolarHBondContact O-N 3.07Å; L126-V130 WeakPolarHBondContact O-CG2 3.28Å; L126-V130 PolarHBondContact O-N 3.38Å
127R89.7Confident82.2Confident167 Ų167109.7 Ų109.763%0.6354%0.537SS*.Hα-helixtrans-58.6-48.6174.9-178.5-178.3167.7-172.7-0.2111.8V123 I124 H129 V130 E131V123-R127 WeakPolarHBondContact O-CB 3.4Å; V123-R127 PolarHBondContact O-N 3.17Å; I124-R127 PolarHBondContact O-N 3.23Å; R127-H129 VanDerWaalsContact C-N 3.31Å; R127-H129 PolarHBondContact O-N 3.29Å; R127-V130 PolarHBondContact O-N 3.36Å; R127-E131 IonicContact CZ-OE1 3.47Å; R127-E131 IonicContact NE-OE1 2.95Å; R127-E131 PolarHBondContact NE-OE1 2.96Å; R127-E131 IonicContact NH2-OE1 3.12Å; R127-E131 PolarHBondContact NH2-OE1 3.38Å; R127-E131 VanDerWaalsContact NH2-OE1 3.12Å; R127-E131 WeakPolarHBondContact O-CB 3.24Å; R127-E131 PolarHBondContact O-N 3.44Å
128R85.8Confident83.7Confident171 Ų171107.9 Ų107.965%0.64553%0.533SS*.Hα-helixtrans-60.2-41.9178.4-75.4178.6177.7179.1-0111.8I124 T125 L126 E131 T132I124-R128 WeakPolarHBondContact O-CG 3.32Å; I124-R128 PolarHBondContact O-N 2.92Å; T125-R128 PolarHBondContact O-N 3.49Å; L126-R128 PolarHBondContact O-N 3.4Å; R128-E131 PolarHBondContact O-N 2.97Å; R128-T132 WeakPolarHBondContact O-CG2 3.47Å; R128-T132 PolarHBondContact O-N 3.46Å; R128-T132 PolarHBondContact O-OG1 2.97Å
129H88.5Confident85.1Confident94 Ų94111.8 Ų111.844%0.43554%0.541SS..Hα-helixtrans-66.9-38.1178.8175-103.5000112.9T125 L126 R127 T132 K133T125-H129 WeakPolarHBondContact O-CB 3.33Å; T125-H129 PolarHBondContact O-N 3.44Å; L126-H129 PolarHBondContact O-N 3.07Å; R127-H129 VanDerWaalsContact C-N 3.31Å; R127-H129 PolarHBondContact O-N 3.29Å; H129-T132 PolarHBondContact O-OG1 2.94Å; H129-K133 WeakPolarHBondContact CE1-CE 3.36Å; H129-K133 PolarHBondContact CE1-NZ 3.4Å; H129-K133 VanDerWaalsContact NE2-CE 3.34Å; H129-K133 WeakPolarHBondContact NE2-CE 3.21Å; H129-K133 PolarHBondContact O-N 3.45Å; H129-K133 VanDerWaalsContact O-N 3.11Å
130V91.6Very high86.4Confident77 Ų77114.8 Ų114.847%0.46755%0.546SS..Hα-helixtrans-68.6-44.3174.1173.60000110.6L126 R127 T132 K133 V134L126-V130 WeakPolarHBondContact O-CG2 3.28Å; L126-V130 PolarHBondContact O-N 3.38Å; R127-V130 PolarHBondContact O-N 3.36Å; V130-T132 VanDerWaalsContact C-N 3.33Å; V130-T132 PolarHBondContact O-N 3.47Å; V130-K133 PolarHBondContact O-N 2.92Å; V130-V134 HydrophobicContact CG1-CG2 4.28Å; V130-V134 WeakPolarHBondContact O-CG2 3.34Å; V130-V134 PolarHBondContact O-N 3.12Å
131E88.3Confident87.1Confident74 Ų74118.6 Ų118.635%0.34655%0.553SS.*Hα-helixtrans-58.9-42.1176.9-81179.7-175.100112R127 R128 V134 R135R127-E131 IonicContact CZ-OE1 3.47Å; R127-E131 IonicContact NE-OE1 2.95Å; R127-E131 PolarHBondContact NE-OE1 2.96Å; R127-E131 IonicContact NH2-OE1 3.12Å; R127-E131 PolarHBondContact NH2-OE1 3.38Å; R127-E131 VanDerWaalsContact NH2-OE1 3.12Å; R127-E131 WeakPolarHBondContact O-CB 3.24Å; R127-E131 PolarHBondContact O-N 3.44Å; R128-E131 PolarHBondContact O-N 2.97Å; E131-V134 PolarHBondContact O-N 3.13Å; E131-R135 WeakPolarHBondContact O-CB 3.39Å; E131-R135 VanDerWaalsContact O-CG 3.28Å; E131-R135 WeakPolarHBondContact O-CG 3.41Å; E131-R135 PolarHBondContact O-N 2.99Å
132T92Very high87.8Confident85 Ų85120 Ų12052%0.52155%0.554SS.*Hα-helixtrans-67.2-41.2176.855.50000112.2R128 H129 V130 V134 R135 A136R128-T132 WeakPolarHBondContact O-CG2 3.47Å; R128-T132 PolarHBondContact O-N 3.46Å; R128-T132 PolarHBondContact O-OG1 2.97Å; H129-T132 PolarHBondContact O-OG1 2.94Å; V130-T132 VanDerWaalsContact C-N 3.33Å; V130-T132 PolarHBondContact O-N 3.47Å; T132-V134 PolarHBondContact O-N 2.85Å; T132-R135 PolarHBondContact O-N 3.49Å; T132-A136 WeakPolarHBondContact O-CB 3.06Å; T132-A136 PolarHBondContact O-N 2.85Å
133K92.4Very high88.1Confident125 Ų125118.4 Ų118.454%0.54355%0.548SS..Hα-helixtrans-61.9-42.1174.7-82.5-170.9174.1-178.80112.4H129 V130 A136 K137H129-K133 WeakPolarHBondContact CE1-CE 3.36Å; H129-K133 PolarHBondContact CE1-NZ 3.4Å; H129-K133 VanDerWaalsContact NE2-CE 3.34Å; H129-K133 WeakPolarHBondContact NE2-CE 3.21Å; H129-K133 PolarHBondContact O-N 3.45Å; H129-K133 VanDerWaalsContact O-N 3.11Å; V130-K133 PolarHBondContact O-N 2.92Å; K133-A136 PolarHBondContact O-N 3.35Å; K133-K137 PolarHBondContact O-N 3.1Å
134V93.6Very high88Confident74 Ų74117.7 Ų117.745%0.44854%0.544SS..Hα-helixtrans-65.7-47.5177.4171.70000110.3V130 E131 T132 A136 K137 I138V130-V134 HydrophobicContact CG1-CG2 4.28Å; V130-V134 WeakPolarHBondContact O-CG2 3.34Å; V130-V134 PolarHBondContact O-N 3.12Å; E131-V134 PolarHBondContact O-N 3.13Å; T132-V134 PolarHBondContact O-N 2.85Å; V134-A136 VanDerWaalsContact C-N 3.32Å; V134-A136 PolarHBondContact O-N 2.99Å; V134-K137 PolarHBondContact O-N 3.46Å; V134-K137 VanDerWaalsContact O-N 3.17Å; V134-I138 HydrophobicContact CG1-CD1 3.83Å; V134-I138 HydrophobicContact CG1-CG1 4.45Å; V134-I138 WeakPolarHBondContact O-CG1 3.18Å; V134-I138 PolarHBondContact O-N 3.39Å
135R88.8Confident88Confident178 Ų178118.6 Ų118.667%0.67255%0.553SS**Hα-helixtrans-58.9-42.2176.1-74.7178.6-176.6-156.62.4112.3E131 T132 I138 R139E131-R135 WeakPolarHBondContact O-CB 3.39Å; E131-R135 VanDerWaalsContact O-CG 3.28Å; E131-R135 WeakPolarHBondContact O-CG 3.41Å; E131-R135 PolarHBondContact O-N 2.99Å; T132-R135 PolarHBondContact O-N 3.49Å; R135-I138 PolarHBondContact O-N 2.82Å; R135-R139 WeakPolarHBondContact O-CB 3.43Å; R135-R139 PolarHBondContact O-N 2.88Å
136A91.4Very high87.7Confident51 Ų51119.2 Ų119.242%0.42155%0.55SS..Hα-helixtrans-63.6-41.4176.600000112.1T132 K133 V134 R139 K140T132-A136 WeakPolarHBondContact O-CB 3.06Å; T132-A136 PolarHBondContact O-N 2.85Å; K133-A136 PolarHBondContact O-N 3.35Å; V134-A136 VanDerWaalsContact C-N 3.32Å; V134-A136 PolarHBondContact O-N 2.99Å; A136-R139 PolarHBondContact O-N 3.38Å; A136-K140 WeakPolarHBondContact O-CB 3.48Å; A136-K140 WeakPolarHBondContact O-CG 3.42Å; A136-K140 PolarHBondContact O-N 3.48Å
137K91.1Very high87.4Confident149 Ų149118 Ų11865%0.64854%0.544SS*.Hα-helixtrans-63.9-42.9174.8-80.9-178.4177.1-178.50112.2K133 V134 K140 R141K133-K137 PolarHBondContact O-N 3.1Å; V134-K137 PolarHBondContact O-N 3.46Å; V134-K137 VanDerWaalsContact O-N 3.17Å; K137-K140 PolarHBondContact O-N 3.44Å; K137-R141 WeakPolarHBondContact O-CG 3.35Å; K137-R141 PolarHBondContact O-N 2.8Å
138I91.3Very high86.5Confident108 Ų108114.8 Ų114.855%0.55454%0.538SS*.Hα-helixtrans-61.5-47.6176.4-67.7167.8000110.2V134 R135 K140 R141 R142V134-I138 HydrophobicContact CG1-CD1 3.83Å; V134-I138 HydrophobicContact CG1-CG1 4.45Å; V134-I138 WeakPolarHBondContact O-CG1 3.18Å; V134-I138 PolarHBondContact O-N 3.39Å; R135-I138 PolarHBondContact O-N 2.82Å; I138-K140 PolarHBondContact O-N 3.44Å; I138-R141 PolarHBondContact O-N 3.35Å; I138-R142 PolarHBondContact O-N 2.94Å
139R89.6Confident86Confident192 Ų192112 Ų11273%0.72553%0.533SS*.Hα-helixtrans-60.4-45.9178.1-172.7176.1178.7173.2-0.2111.8R135 A136 R142 V143R135-R139 WeakPolarHBondContact O-CB 3.43Å; R135-R139 PolarHBondContact O-N 2.88Å; A136-R139 PolarHBondContact O-N 3.38Å; R139-R142 PolarHBondContact O-N 3.32Å; R139-V143 VanDerWaalsContact O-CG2 3.31Å; R139-V143 WeakPolarHBondContact O-CG2 3.49Å; R139-V143 PolarHBondContact O-N 2.94Å
140K89.3Confident85.3Confident157 Ų157113.3 Ų113.368%0.68354%0.539SS*.Hα-helixtrans-58.7-48.2176.3-78.1-173.5178-170.20111.8A136 K137 I138 R142 V143 T144A136-K140 WeakPolarHBondContact O-CB 3.48Å; A136-K140 WeakPolarHBondContact O-CG 3.42Å; A136-K140 PolarHBondContact O-N 3.48Å; K137-K140 PolarHBondContact O-N 3.44Å; I138-K140 PolarHBondContact O-N 3.44Å; K140-R142 PolarHBondContact O-N 3.38Å; K140-V143 PolarHBondContact O-N 2.93Å; K140-T144 WeakPolarHBondContact O-CG2 3.47Å; K140-T144 PolarHBondContact O-N 3.35Å; K140-T144 PolarHBondContact O-OG1 3.13Å; K140-T144 VanDerWaalsContact O-OG1 3.1Å
141R86.9Confident84.4Confident190 Ų190114.2 Ų114.272%0.71754%0.541SS*.Hα-helixtrans-60.9-43.3178.2-75.5-171.8-174.7-145.91.8112.3K137 I138 T144 T145K137-R141 WeakPolarHBondContact O-CG 3.35Å; K137-R141 PolarHBondContact O-N 2.8Å; I138-R141 PolarHBondContact O-N 3.35Å; R141-T144 WeakPolarHBondContact CA-OG1 3.3Å; R141-T144 PolarHBondContact O-N 2.94Å; R141-T144 PolarHBondContact O-OG1 3.03Å; R141-T145 WeakPolarHBondContact O-CB 3.47Å; R141-T145 PolarHBondContact O-N 2.98Å; R141-T145 PolarHBondContact O-OG1 3.4Å
142R86.8Confident83.9Confident173 Ų173117.9 Ų117.965%0.65356%0.556SS**Hα-helixtrans-60.9-48.1177.9-173.7176.4177174.61.2111.8I138 R139 K140 T144 T145 E146I138-R142 PolarHBondContact O-N 2.94Å; R139-R142 PolarHBondContact O-N 3.32Å; K140-R142 PolarHBondContact O-N 3.38Å; R142-T144 PolarHBondContact O-N 2.98Å; R142-T145 PolarHBondContact O-N 3.24Å; R142-E146 PolarHBondContact O-N 3.27Å
143V82.8Confident83.3Confident63 Ų63117.9 Ų117.938%0.38255%0.552SS.*Hα-helixtrans-60.5-45.3178171.50000111.1R139 K140 T145 E146 I147R139-V143 VanDerWaalsContact O-CG2 3.31Å; R139-V143 WeakPolarHBondContact O-CG2 3.49Å; R139-V143 PolarHBondContact O-N 2.94Å; K140-V143 PolarHBondContact O-N 2.93Å; V143-T145 VanDerWaalsContact C-N 3.31Å; V143-T145 PolarHBondContact O-N 3.03Å; V143-E146 PolarHBondContact O-N 3.1Å; V143-I147 HydrophobicContact CG1-CD1 3.77Å; V143-I147 HydrophobicContact CG1-CG1 4.46Å; V143-I147 VanDerWaalsContact O-CG1 3.3Å; V143-I147 WeakPolarHBondContact O-CG1 3.38Å; V143-I147 PolarHBondContact O-N 3.04Å
144T75.3Confident82.8Confident72 Ų72115.5 Ų115.544%0.44255%0.545SS..Hα-helixtrans-64-36.5177.950.70000112.6K140 R141 R142 N148K140-T144 WeakPolarHBondContact O-CG2 3.47Å; K140-T144 PolarHBondContact O-N 3.35Å; K140-T144 PolarHBondContact O-OG1 3.13Å; K140-T144 VanDerWaalsContact O-OG1 3.1Å; R141-T144 WeakPolarHBondContact CA-OG1 3.3Å; R141-T144 PolarHBondContact O-N 2.94Å; R141-T144 PolarHBondContact O-OG1 3.03Å; R142-T144 PolarHBondContact O-N 2.98Å; T144-N148 WeakPolarHBondContact O-CB 3.42Å; T144-N148 PolarHBondContact O-N 3.4Å; T144-N148 PolarHBondContact O-ND2 2.98Å; T144-N148 VanDerWaalsContact O-ND2 3.13Å
145T82.4Confident82.3Confident94 Ų94113.6 Ų113.658%0.57754%0.54SS*.Hα-helixtrans-68.4-40.1177.3-590000111.6R141 R142 V143 H149R141-T145 WeakPolarHBondContact O-CB 3.47Å; R141-T145 PolarHBondContact O-N 2.98Å; R141-T145 PolarHBondContact O-OG1 3.4Å; R142-T145 PolarHBondContact O-N 3.24Å; V143-T145 VanDerWaalsContact C-N 3.31Å; V143-T145 PolarHBondContact O-N 3.03Å; T145-H149 WeakPolarHBondContact O-CB 3.31Å; T145-H149 PolarHBondContact O-N 3.4Å
146E78.6Confident82Confident96 Ų96112.8 Ų112.845%0.44954%0.541SS..Hα-helixtrans-63.4-47.7174.8-81.6177.6160.600111.6R142 V143 N148 H149 H150R142-E146 PolarHBondContact O-N 3.27Å; V143-E146 PolarHBondContact O-N 3.1Å; E146-N148 VanDerWaalsContact C-N 3.34Å; E146-N148 PolarHBondContact O-N 3Å; E146-H149 WeakPolarHBondContact O-CB 3.36Å; E146-H149 PolarHBondContact O-N 3.22Å; E146-H149 VanDerWaalsContact O-N 3.1Å; E146-H150 PolarHBondContact O-CD2 3.48Å; E146-H150 PolarHBondContact O-N 3.49Å
147I79.1Confident81.6Confident89 Ų89119.7 Ų119.746%0.45656%0.556SS.*Hα-helixtrans-56.7-48.9177.2-66.4167000110.5V143 H149 H150 D151V143-I147 HydrophobicContact CG1-CD1 3.77Å; V143-I147 HydrophobicContact CG1-CG1 4.46Å; V143-I147 VanDerWaalsContact O-CG1 3.3Å; V143-I147 WeakPolarHBondContact O-CG1 3.38Å; V143-I147 PolarHBondContact O-N 3.04Å; I147-H149 VanDerWaalsContact C-N 3.26Å; I147-H149 PolarHBondContact O-N 3.47Å; I147-H150 PolarHBondContact O-N 2.84Å; I147-D151 PolarHBondContact O-N 2.99Å
148N70.4Confident81.2Confident98 Ų98118.8 Ų118.852%0.52455%0.552SS.*Hα-helixtrans-61.4-33.5178.6-73.5-26.2000113.1T144 E146 K152T144-N148 WeakPolarHBondContact O-CB 3.42Å; T144-N148 PolarHBondContact O-N 3.4Å; T144-N148 PolarHBondContact O-ND2 2.98Å; T144-N148 VanDerWaalsContact O-ND2 3.13Å; E146-N148 VanDerWaalsContact C-N 3.34Å; E146-N148 PolarHBondContact O-N 3Å; N148-K152 WeakPolarHBondContact O-CG 3.37Å; N148-K152 PolarHBondContact O-N 3.31Å
149H76.6Confident80.9Confident114 Ų114117.4 Ų117.453%0.52855%0.549SS..Hα-helixtrans-72.3-42.7176.6-175.8-104.4000111.6T145 E146 I147 D151 K152 I153T145-H149 WeakPolarHBondContact O-CB 3.31Å; T145-H149 PolarHBondContact O-N 3.4Å; E146-H149 WeakPolarHBondContact O-CB 3.36Å; E146-H149 PolarHBondContact O-N 3.22Å; E146-H149 VanDerWaalsContact O-N 3.1Å; I147-H149 VanDerWaalsContact C-N 3.26Å; I147-H149 PolarHBondContact O-N 3.47Å; H149-D151 PolarHBondContact O-N 2.89Å; H149-K152 PolarHBondContact O-N 3.05Å; H149-I153 WeakPolarHBondContact CE1-CD1 3.41Å; H149-I153 WeakPolarHBondContact ND1-CD1 3.37Å; H149-I153 WeakPolarHBondContact O-CG1 3.49Å; H149-I153 PolarHBondContact O-N 2.93Å
150H73.6Confident80.9Confident120 Ų120110.4 Ų110.456%0.55653%0.533SS*.Hα-helixtrans-61.2-42.1175.6-76.2-67.9000112.2E146 I147 I153 N154E146-H150 PolarHBondContact O-CD2 3.48Å; E146-H150 PolarHBondContact O-N 3.49Å; I147-H150 PolarHBondContact O-N 2.84Å; H150-I153 PolarHBondContact O-N 3.36Å; H150-N154 WeakPolarHBondContact O-CB 3.18Å; H150-N154 PolarHBondContact O-N 3.36Å
151D72.8Confident81Confident97 Ų97111.7 Ų111.752%0.51953%0.533SS..Hα-helixtrans-65.5-40.8178-72.8-24.5000112.3I147 H149 N154 G155I147-D151 PolarHBondContact O-N 2.99Å; H149-D151 PolarHBondContact O-N 2.89Å; D151-N154 PolarHBondContact O-N 3.32Å; D151-G155 PolarHBondContact O-N 3.02Å
152K78.4Confident81.1Confident151 Ų151110 Ų11066%0.65753%0.531SS*.Hα-helixtrans-62.7-42.4174.6-77.8178.8-179.9-177.30112.2N148 H149 K156N148-K152 WeakPolarHBondContact O-CG 3.37Å; N148-K152 PolarHBondContact O-N 3.31Å; H149-K152 PolarHBondContact O-N 3.05Å; K152-K156 WeakPolarHBondContact O-CG 3.39Å; K152-K156 PolarHBondContact O-N 3.18Å
153I79.3Confident81.4Confident85 Ų85107.4 Ų107.444%0.43653%0.526SS..Hα-helixtrans-65.1-45.1176.5-70173.7000110.5H149 H150 G155 K156 R157H149-I153 WeakPolarHBondContact CE1-CD1 3.41Å; H149-I153 WeakPolarHBondContact ND1-CD1 3.37Å; H149-I153 WeakPolarHBondContact O-CG1 3.49Å; H149-I153 PolarHBondContact O-N 2.93Å; H150-I153 PolarHBondContact O-N 3.36Å; I153-G155 PolarHBondContact O-N 3.01Å; I153-K156 PolarHBondContact O-N 3.38Å; I153-R157 WeakPolarHBondContact O-CB 3.46Å; I153-R157 PolarHBondContact O-N 2.99Å
154N80.2Confident81.9Confident75 Ų75111 Ų11140%0.40154%0.537SS..Hα-helixtrans-64.3-41.5179.9-165.920.6000111.5H150 D151 R157 K158H150-N154 WeakPolarHBondContact O-CB 3.18Å; H150-N154 PolarHBondContact O-N 3.36Å; D151-N154 PolarHBondContact O-N 3.32Å; N154-R157 PolarHBondContact O-N 3.05Å; N154-K158 WeakPolarHBondContact O-CG 3.45Å; N154-K158 PolarHBondContact O-N 3.24Å
155G83.2Confident82.8Confident33 Ų33112.6 Ų112.634%0.3454%0.54SS..Hα-helixtrans-57.4-51.5173.200000112.2D151 I153 R157 K158 T159D151-G155 PolarHBondContact O-N 3.02Å; I153-G155 PolarHBondContact O-N 3.01Å; G155-R157 VanDerWaalsContact C-N 3.33Å; G155-R157 PolarHBondContact O-N 3.49Å; G155-K158 PolarHBondContact O-N 3.33Å; G155-T159 PolarHBondContact O-N 3.4Å; G155-T159 PolarHBondContact O-OG1 2.95Å; G155-T159 VanDerWaalsContact O-OG1 3.11Å
156K83.7Confident83.3Confident162 Ų162114.4 Ų114.470%0.70454%0.54SS*.Hα-helixtrans-58.7-42.4176.9-73.7-179.5177.8-173.60112.4K152 I153 K158 T159 A160K152-K156 WeakPolarHBondContact O-CG 3.39Å; K152-K156 PolarHBondContact O-N 3.18Å; I153-K156 PolarHBondContact O-N 3.38Å; K156-K158 PolarHBondContact O-N 2.94Å; K156-T159 PolarHBondContact O-N 2.95Å; K156-A160 WeakPolarHBondContact O-CB 3.5Å; K156-A160 PolarHBondContact O-N 3.35Å
157R81.6Confident84.1Confident195 Ų195115.9 Ų115.974%0.73655%0.547SS*.Hα-helixtrans-63.4-41.2178.5-169.5177.4-176.7178.21.1112.1I153 N154 G155 R161I153-R157 WeakPolarHBondContact O-CB 3.46Å; I153-R157 PolarHBondContact O-N 2.99Å; N154-R157 PolarHBondContact O-N 3.05Å; G155-R157 VanDerWaalsContact C-N 3.33Å; G155-R157 PolarHBondContact O-N 3.49Å; R157-R161 WeakPolarHBondContact O-CB 3.46Å; R157-R161 PolarHBondContact O-N 2.94Å
158K83.9Confident84.8Confident130 Ų130120.1 Ų120.157%0.56556%0.558SS**Hα-helixtrans-64.6-43.3175.8-73177.8-178.7-179.10111.7N154 G155 K156 R161 K162N154-K158 WeakPolarHBondContact O-CG 3.45Å; N154-K158 PolarHBondContact O-N 3.24Å; G155-K158 PolarHBondContact O-N 3.33Å; K156-K158 PolarHBondContact O-N 2.94Å; K158-R161 PolarHBondContact O-N 3.11Å; K158-K162 PolarHBondContact O-N 3.21Å
159T85.8Confident86Confident80 Ų80118 Ų11849%0.49155%0.553SS.*Hα-helixtrans-63.9-45.9177.4-53.60000111.8G155 K156 R161 K162 Q163G155-T159 PolarHBondContact O-N 3.4Å; G155-T159 PolarHBondContact O-OG1 2.95Å; G155-T159 VanDerWaalsContact O-OG1 3.11Å; K156-T159 PolarHBondContact O-N 2.95Å; T159-R161 VanDerWaalsContact C-N 3.32Å; T159-R161 PolarHBondContact O-N 3.34Å; T159-K162 PolarHBondContact O-N 3.04Å; T159-Q163 PolarHBondContact O-N 3.38Å
160A88.8Confident86.9Confident45 Ų45116.7 Ų116.737%0.37255%0.548SS..Hα-helixtrans-62-39.117700000112.3K156 Q163 K164K156-A160 WeakPolarHBondContact O-CB 3.5Å; K156-A160 PolarHBondContact O-N 3.35Å; A160-Q163 PolarHBondContact O-N 3.47Å; A160-K164 WeakPolarHBondContact O-CG 3.45Å; A160-K164 PolarHBondContact O-N 3.02Å
161R90.7Very high87.9Confident184 Ų184115.7 Ų115.769%0.69454%0.543SS*.Hα-helixtrans-65.2-41.8175.8-166.5179.1178.3174.50111.7R157 K158 T159 K164 M165R157-R161 WeakPolarHBondContact O-CB 3.46Å; R157-R161 PolarHBondContact O-N 2.94Å; K158-R161 PolarHBondContact O-N 3.11Å; T159-R161 VanDerWaalsContact C-N 3.32Å; T159-R161 PolarHBondContact O-N 3.34Å; R161-K164 PolarHBondContact O-N 3.47Å; R161-M165 HydrophobicContact CG-CE 4.16Å; R161-M165 WeakPolarHBondContact O-CG 3.47Å; R161-M165 PolarHBondContact O-N 3.28Å
162K90.4Very high88.9Confident153 Ų153116.5 Ų116.567%0.66555%0.547SS*.Hα-helixtrans-61.4-45.8174.3-81-173.3174.4-1740111.9K158 T159 K164 M165 F166K158-K162 PolarHBondContact O-N 3.21Å; T159-K162 PolarHBondContact O-N 3.04Å; K162-K164 PolarHBondContact O-N 3.43Å; K162-M165 PolarHBondContact O-N 2.92Å; K162-F166 WeakPolarHBondContact O-CB 3.4Å; K162-F166 PolarHBondContact O-N 3.27Å
163Q91.2Very high89.6Confident120 Ų120118.1 Ų118.156%0.56155%0.549SS*.Hα-helixtrans-60.4-44.2177.4-76178.5-22.600112.2T159 A160 M165 F166 Q167T159-Q163 PolarHBondContact O-N 3.38Å; A160-Q163 PolarHBondContact O-N 3.47Å; Q163-M165 PolarHBondContact O-N 3.45Å; Q163-F166 PolarHBondContact O-N 3.04Å; Q163-Q167 WeakPolarHBondContact O-CG 3.43Å; Q163-Q167 PolarHBondContact O-N 3.03Å
164K94.6Very high90.3Very high139 Ų139122.1 Ų122.160%0.60456%0.559SS**Hα-helixtrans-62.8-40.5175.9-75.3-175.7178.2-173.70113A160 R161 K162 R168A160-K164 WeakPolarHBondContact O-CG 3.45Å; A160-K164 PolarHBondContact O-N 3.02Å; R161-K164 PolarHBondContact O-N 3.47Å; K162-K164 PolarHBondContact O-N 3.43Å; K164-R168 WeakPolarHBondContact O-CG 3.4Å; K164-R168 PolarHBondContact O-N 3.5Å
165M94.1Very high90.8Very high104 Ų104125.9 Ų125.951%0.51257%0.567SS.*Hα-helixtrans-66.5-39.9176.2-72.5-173.1-63.500111.6R161 K162 Q163 R168 A169R161-M165 HydrophobicContact CG-CE 4.16Å; R161-M165 WeakPolarHBondContact O-CG 3.47Å; R161-M165 PolarHBondContact O-N 3.28Å; K162-M165 PolarHBondContact O-N 2.92Å; Q163-M165 PolarHBondContact O-N 3.45Å; M165-R168 PolarHBondContact O-N 2.97Å; M165-A169 WeakPolarHBondContact O-CB 3.47Å; M165-A169 PolarHBondContact O-N 3.28Å
166F93.1Very high91.2Very high132 Ų132127.3 Ų127.358%0.57958%0.576SS**Hα-helixtrans-63.7-45176.6-171.5-101.8000112.1K162 Q163 R168 A169 Q170K162-F166 WeakPolarHBondContact O-CB 3.4Å; K162-F166 PolarHBondContact O-N 3.27Å; Q163-F166 PolarHBondContact O-N 3.04Å; F166-R168 PolarHBondContact O-N 3.03Å; F166-A169 PolarHBondContact O-N 3.44Å; F166-Q170 HydrophobicContact CD1-CG 4.44Å; F166-Q170 HydrophobicContact CE1-CG 4.17Å; F166-Q170 HydrophobicContact CZ-CG 4.46Å; F166-Q170 WeakPolarHBondContact O-CG 3.49Å; F166-Q170 PolarHBondContact O-N 3.04Å
167Q94.8Very high91.6Very high127 Ų127124.8 Ų124.859%0.59357%0.566SS**Hα-helixtrans-59.9-45.7174.4-75.8177.3-15.900112.1Q163 A169 Q170 E171Q163-Q167 WeakPolarHBondContact O-CG 3.43Å; Q163-Q167 PolarHBondContact O-N 3.03Å; Q167-A169 VanDerWaalsContact C-N 3.34Å; Q167-A169 PolarHBondContact O-N 2.91Å; Q167-Q170 PolarHBondContact O-N 3.02Å; Q167-E171 PolarHBondContact O-N 2.99Å
168R94.4Very high92Very high178 Ų178119.7 Ų119.767%0.67255%0.554SS**Hα-helixtrans-62.2-39.7176.3-76.3-179179-171.7-2112.7K164 M165 F166 Q170 E171 L172K164-R168 WeakPolarHBondContact O-CG 3.4Å; K164-R168 PolarHBondContact O-N 3.5Å; M165-R168 PolarHBondContact O-N 2.97Å; F166-R168 PolarHBondContact O-N 3.03Å; R168-Q170 VanDerWaalsContact C-N 3.35Å; R168-E171 PolarHBondContact O-N 3.24Å; R168-L172 WeakPolarHBondContact O-CG 3.48Å; R168-L172 PolarHBondContact O-N 3.41Å
169A94.8Very high92.3Very high53 Ų53120.9 Ų120.944%0.43856%0.556SS.*Hα-helixtrans-65.4-38.9176.400000112M165 F166 Q167 L172 R173M165-A169 WeakPolarHBondContact O-CB 3.47Å; M165-A169 PolarHBondContact O-N 3.28Å; F166-A169 PolarHBondContact O-N 3.44Å; Q167-A169 VanDerWaalsContact C-N 3.34Å; Q167-A169 PolarHBondContact O-N 2.91Å; A169-L172 PolarHBondContact O-N 3.49Å; A169-R173 PolarHBondContact O-N 3.39Å
170Q94.8Very high92.2Very high88 Ų88122.9 Ų122.941%0.41156%0.559SS.*Hα-helixtrans-65-40.6173.5-74.7-174.1-30.400112.3F166 Q167 R168 R173 R174F166-Q170 HydrophobicContact CD1-CG 4.44Å; F166-Q170 HydrophobicContact CE1-CG 4.17Å; F166-Q170 HydrophobicContact CZ-CG 4.46Å; F166-Q170 WeakPolarHBondContact O-CG 3.49Å; F166-Q170 PolarHBondContact O-N 3.04Å; Q167-Q170 PolarHBondContact O-N 3.02Å; R168-Q170 VanDerWaalsContact C-N 3.35Å; Q170-R173 WeakPolarHBondContact O-CB 3.37Å; Q170-R173 PolarHBondContact O-N 3.32Å; Q170-R174 PolarHBondContact O-N 2.94Å
171E94.8Very high92Very high98 Ų98127.5 Ų127.546%0.45857%0.571SS.*Hα-helixtrans-65.2-41.7177-167.5-179.916900112Q167 R168 R173 R174 R175Q167-E171 PolarHBondContact O-N 2.99Å; R168-E171 PolarHBondContact O-N 3.24Å; E171-R173 VanDerWaalsContact C-N 3.34Å; E171-R173 PolarHBondContact O-N 3.4Å; E171-R174 PolarHBondContact O-N 2.97Å; E171-R175 WeakPolarHBondContact O-CG 3.39Å; E171-R175 PolarHBondContact O-N 3.34Å; E171-R175 IonicContact OE1-CZ 3.55Å; E171-R175 IonicContact OE1-NE 3.73Å; E171-R175 IonicContact OE1-NH2 2.73Å; E171-R175 PolarHBondContact OE1-NH2 3.18Å
172L95.4Very high91.6Very high114 Ų114122.8 Ų122.860%0.59757%0.565SS**Hα-helixtrans-62.1-40.3173.9-73.8171.6000112.2R168 A169 R175 A176R168-L172 WeakPolarHBondContact O-CG 3.48Å; R168-L172 PolarHBondContact O-N 3.41Å; A169-L172 PolarHBondContact O-N 3.49Å; L172-R175 PolarHBondContact O-N 3.48Å; L172-A176 WeakPolarHBondContact O-CB 3.42Å; L172-A176 PolarHBondContact O-N 3.27Å
173R92.9Very high91Very high185 Ų185120.1 Ų120.170%0.69855%0.554SS**Hα-helixtrans-59.2-48.5172.9-92.1-174.5170.5-179.3-3.7111.8A169 Q170 E171 R175 A176 E177A169-R173 PolarHBondContact O-N 3.39Å; Q170-R173 WeakPolarHBondContact O-CB 3.37Å; Q170-R173 PolarHBondContact O-N 3.32Å; E171-R173 VanDerWaalsContact C-N 3.34Å; E171-R173 PolarHBondContact O-N 3.4Å; R173-R175 VanDerWaalsContact C-N 3.35Å; R173-R175 PolarHBondContact O-N 2.88Å; R173-A176 PolarHBondContact O-N 2.94Å; R173-E177 WeakPolarHBondContact O-CG 3.48Å; R173-E177 PolarHBondContact O-N 2.73Å
174R92.5Very high90.3Very high170 Ų170117.6 Ų117.664%0.64255%0.547SS*.Hα-helixtrans-58.9-44.7177.5-71.8-179-176.8175.80.5112Q170 E171 A176 E177 D178Q170-R174 PolarHBondContact O-N 2.94Å; E171-R174 PolarHBondContact O-N 2.97Å; R174-A176 VanDerWaalsContact C-N 3.33Å; R174-A176 PolarHBondContact O-N 3.42Å; R174-E177 PolarHBondContact O-N 2.94Å; R174-D178 WeakPolarHBondContact O-CB 3.48Å; R174-D178 VanDerWaalsContact O-CG 3.3Å; R174-D178 PolarHBondContact O-N 3.45Å
175R92.1Very high89.2Confident154 Ų154121 Ų12158%0.58156%0.555SS**Hα-helixtrans-62.9-37.6176.8-71.3-175.1-168.8176.53.8113E171 L172 R173 Y179E171-R175 WeakPolarHBondContact O-CG 3.39Å; E171-R175 PolarHBondContact O-N 3.34Å; E171-R175 IonicContact OE1-CZ 3.55Å; E171-R175 IonicContact OE1-NE 3.73Å; E171-R175 IonicContact OE1-NH2 2.73Å; E171-R175 PolarHBondContact OE1-NH2 3.18Å; L172-R175 PolarHBondContact O-N 3.48Å; R173-R175 VanDerWaalsContact C-N 3.35Å; R173-R175 PolarHBondContact O-N 2.88Å; R175-Y179 WeakPolarHBondContact O-CB 3.47Å; R175-Y179 PolarHBondContact O-N 3.38Å
176A91.8Very high88Confident62 Ų62120.3 Ų120.351%0.51256%0.561SS.*Hα-helixtrans-68.2-40.9176.300000111.8L172 R173 R174 Y179 H180L172-A176 WeakPolarHBondContact O-CB 3.42Å; L172-A176 PolarHBondContact O-N 3.27Å; R173-A176 PolarHBondContact O-N 2.94Å; R174-A176 VanDerWaalsContact C-N 3.33Å; R174-A176 PolarHBondContact O-N 3.42Å; A176-Y179 PolarHBondContact O-N 2.97Å; A176-H180 WeakPolarHBondContact O-CB 3.31Å; A176-H180 PolarHBondContact O-N 3.27Å
177E91.3Very high86.7Confident110 Ų110121.4 Ų121.451%0.51457%0.566SS.*Hα-helixtrans-62.7-43.7173.9-72.5169.9-159.300111.7R173 R174 H180 K181R173-E177 WeakPolarHBondContact O-CG 3.48Å; R173-E177 PolarHBondContact O-N 2.73Å; R174-E177 PolarHBondContact O-N 2.94Å; E177-H180 PolarHBondContact O-N 2.89Å; E177-K181 WeakPolarHBondContact O-CG 3.35Å; E177-K181 PolarHBondContact O-N 3.26Å
178D90.6Very high85Confident87 Ų87121 Ų12147%0.46557%0.567SS.*Hα-helixtrans-65.3-43.1176.9-71-24.2000111.6R174 H180 K181 C182R174-D178 WeakPolarHBondContact O-CB 3.48Å; R174-D178 VanDerWaalsContact O-CG 3.3Å; R174-D178 PolarHBondContact O-N 3.45Å; D178-H180 VanDerWaalsContact C-N 3.29Å; D178-H180 PolarHBondContact O-N 3.28Å; D178-K181 PolarHBondContact O-N 3.4Å; D178-C182 WeakPolarHBondContact O-CB 3.49Å; D178-C182 PolarHBondContact O-N 3.38Å; D178-C182 PolarHBondContact O-SG 2.89Å; D178-C182 VanDerWaalsContact O-SG 3.38Å
179Y88.6Confident83.3Confident156 Ų156117.7 Ų117.761%0.61257%0.568SS**Hα-helixtrans-58.3-42.9172.9178.7-96.9000111.3R175 A176 K183R175-Y179 WeakPolarHBondContact O-CB 3.47Å; R175-Y179 PolarHBondContact O-N 3.38Å; A176-Y179 PolarHBondContact O-N 2.97Å; Y179-K183 HydrophobicContact CE1-CD 4.1Å; Y179-K183 VanDerWaalsContact O-CB 3.29Å; Y179-K183 WeakPolarHBondContact O-CB 3.35Å; Y179-K183 PolarHBondContact O-N 3.45Å
180H85.1Confident81.7Confident122 Ų122119.7 Ų119.757%0.56559%0.585SS**Hα-helixtrans-65.9-43.6177.4-168.125.4000112.2A176 E177 D178 K183 V184A176-H180 WeakPolarHBondContact O-CB 3.31Å; A176-H180 PolarHBondContact O-N 3.27Å; E177-H180 PolarHBondContact O-N 2.89Å; D178-H180 VanDerWaalsContact C-N 3.29Å; D178-H180 PolarHBondContact O-N 3.28Å; H180-K183 PolarHBondContact O-N 2.87Å; H180-V184 WeakPolarHBondContact O-CG2 3.46Å; H180-V184 PolarHBondContact O-N 2.88Å
181K83.6Confident80Confident141 Ų141122.2 Ų122.261%0.61361%0.606SS**Hα-helixtrans-59.9-46.4174.9-78.9179.3179.9173.80112.3E177 D178 K183 V184 R185E177-K181 WeakPolarHBondContact O-CG 3.35Å; E177-K181 PolarHBondContact O-N 3.26Å; D178-K181 PolarHBondContact O-N 3.4Å; K181-K183 VanDerWaalsContact C-N 3.3Å; K181-K183 PolarHBondContact O-N 3.25Å; K181-V184 PolarHBondContact O-N 2.97Å; K181-R185 VanDerWaalsContact O-CB 3.31Å; K181-R185 WeakPolarHBondContact O-CB 3.29Å; K181-R185 PolarHBondContact O-N 2.92Å
182C82.9Confident77.8Confident86 Ų86121.8 Ų121.858%0.58162%0.619SS**Hα-helixtrans-61.3-41.4176.4-72.50000111.4D178 R185 S186D178-C182 WeakPolarHBondContact O-CB 3.49Å; D178-C182 PolarHBondContact O-N 3.38Å; D178-C182 PolarHBondContact O-SG 2.89Å; D178-C182 VanDerWaalsContact O-SG 3.38Å; C182-R185 PolarHBondContact O-N 3.25Å; C182-S186 PolarHBondContact O-N 3.45Å; C182-S186 PolarHBondContact O-OG 3.26Å
183K77.9Confident75.5Confident96 Ų96123.5 Ų123.542%0.41767%0.665SS.*Hα-helixtrans-64.8-45.4177.3-169.6165-173.4176.80111.9Y179 H180 K181 R185 S186 F187Y179-K183 HydrophobicContact CE1-CD 4.1Å; Y179-K183 VanDerWaalsContact O-CB 3.29Å; Y179-K183 WeakPolarHBondContact O-CB 3.35Å; Y179-K183 PolarHBondContact O-N 3.45Å; H180-K183 PolarHBondContact O-N 2.87Å; K181-K183 VanDerWaalsContact C-N 3.3Å; K181-K183 PolarHBondContact O-N 3.25Å; K183-R185 VanDerWaalsContact C-N 3.35Å; K183-R185 PolarHBondContact O-N 3.1Å; K183-S186 WeakPolarHBondContact CA-OG 2.97Å; K183-S186 PolarHBondContact O-N 3.4Å; K183-S186 PolarHBondContact O-OG 2.95Å; K183-F187 HydrophobicContact CD-CE2 4.49Å; K183-F187 HydrophobicContact CG-CD2 4.22Å; K183-F187 HydrophobicContact CG-CE2 3.64Å; K183-F187 WeakPolarHBondContact O-CD2 3.44Å; K183-F187 PolarHBondContact O-N 3.48Å
184V75.4Confident74.6Confident68 Ų68120.4 Ų120.441%0.41266%0.663SS.*Hα-helixtrans-62.8-42.3175.1172.80000111.2H180 K181 S186 F187 L188H180-V184 WeakPolarHBondContact O-CG2 3.46Å; H180-V184 PolarHBondContact O-N 2.88Å; K181-V184 PolarHBondContact O-N 2.97Å; V184-S186 VanDerWaalsContact C-N 3.29Å; V184-S186 PolarHBondContact O-N 3.37Å; V184-F187 PolarHBondContact O-N 3.37Å; V184-F187 VanDerWaalsContact O-N 3.1Å; V184-L188 HydrophobicContact CG1-CD1 4.14Å; V184-L188 PolarHBondContact O-N 3.33Å
185R72.1Confident73.7Confident209 Ų209117.8 Ų117.879%0.78966%0.664SS**Hα-helixtrans-62.7-33176.6-168.1175.2-169.6175.73.5112.8K181 C182 K183 F187K181-R185 VanDerWaalsContact O-CB 3.31Å; K181-R185 WeakPolarHBondContact O-CB 3.29Å; K181-R185 PolarHBondContact O-N 2.92Å; C182-R185 PolarHBondContact O-N 3.25Å; K183-R185 VanDerWaalsContact C-N 3.35Å; K183-R185 PolarHBondContact O-N 3.1Å; R185-F187 VanDerWaalsContact C-N 3.27Å; R185-F187 PolarHBondContact O-N 2.67Å
186S68.7Low72.6Confident90 Ų90115.8 Ų115.863%0.62967%0.669SS**Hα-helixtrans-72.6-16.4175.258.30000114.5C182 K183 V184C182-S186 PolarHBondContact O-N 3.45Å; C182-S186 PolarHBondContact O-OG 3.26Å; K183-S186 WeakPolarHBondContact CA-OG 2.97Å; K183-S186 PolarHBondContact O-N 3.4Å; K183-S186 PolarHBondContact O-OG 2.95Å; V184-S186 VanDerWaalsContact C-N 3.29Å; V184-S186 PolarHBondContact O-N 3.37Å
187F66.1Low71.5Confident156 Ų156118.9 Ų118.968%0.68468%0.678SS**Hα-helixtrans-98.5-13.2177.1-70.3-65000113.8K183 V184 R185K183-F187 HydrophobicContact CD-CE2 4.49Å; K183-F187 HydrophobicContact CG-CD2 4.22Å; K183-F187 HydrophobicContact CG-CE2 3.64Å; K183-F187 WeakPolarHBondContact O-CD2 3.44Å; K183-F187 PolarHBondContact O-N 3.48Å; V184-F187 PolarHBondContact O-N 3.37Å; V184-F187 VanDerWaalsContact O-N 3.1Å; R185-F187 VanDerWaalsContact C-N 3.27Å; R185-F187 PolarHBondContact O-N 2.67Å
188L60.2Low70.3Confident119 Ų119119.5 Ų119.562%0.62369%0.688SS**SBendtrans-89.9117.2172.6-77.5161.9000108.7V184 A190V184-L188 HydrophobicContact CG1-CD1 4.14Å; V184-L188 PolarHBondContact O-N 3.33Å; L188-A190 PolarHBondContact O-N 2.84Å
189P57.6Low68.9Low107 Ų107121.7 Ų121.770%0.69570%0.703SS**  trans-60133.8173.724.6-30.4000108.3V191P189-V191 VanDerWaalsContact C-N 3.33Å; P189-V191 PolarHBondContact O-N 3.33Å
190A62.1Low67.5Low96 Ų96119.2 Ų119.279%0.79371%0.709SS**  trans-60.3100.8171.600000107.6L188 A192L188-A190 PolarHBondContact O-N 2.84Å; A190-A192 PolarHBondContact O-N 2.86Å
191V57.7Low66.1Low140 Ų140119 Ų11985%0.84872%0.721SS**  trans-71.284.6164.1-178.40000105.1P189P189-V191 VanDerWaalsContact C-N 3.33Å; P189-V191 PolarHBondContact O-N 3.33Å
192A50.2Low64.7Low89 Ų89117.2 Ų117.274%0.73673%0.73SS**  trans-70.5120.8168.400000107.2A190A190-A192 PolarHBondContact O-N 2.86Å
193G45.4Very low63Low150 Ų150120 Ų120100%1.54674%0.743SS**  trans-76.80162.800000111.1

Retrieved 193 of 193 residues in 87.6 ms (Link to these results)