A0A067ZUK6_HUMAN Loading...

Nuclear pore complex-interacting protein

AlphaFold DB , UniProt , Accession A0A067ZUK6, Species HUMAN (Homo sapiens, Human), Gene NPIP, Length 208 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
1M35.3Very low37.7Very low234 Ų234159.8 Ų159.8100%1.15383%0.833SS**  0112.20-162.5170.4167.300107.8
2I36.6Very low38Very low146 Ų146156.9 Ų156.975%0.74984%0.836SS**  trans35.5114156.8-55171.3000118.7
3L33.6Very low38.1Very low164 Ų164154 Ų15486%0.85984%0.836SS**  trans-68.3127.9155.5-150.892.7000109
4R33.3Very low38.1Very low234 Ų234148.1 Ų148.188%0.88383%0.829SS**  trans-147114.7158.3-137.4177-177.6178.40.4112.2
5V40.8Very low38.2Very low110 Ų110152.9 Ų152.967%0.66783%0.829SS**  trans-54.8146173.4169.10000111.9
6T36.4Very low38.4Very low138 Ų138156.9 Ų156.985%0.84784%0.836SS**  trans-139.9117.3147.110.30000111.2
7L40.7Very low38.6Very low151 Ų151156.8 Ų156.879%0.79183%0.83SS**  trans-54.2144.9168.5-72.9143.1000111.7
8R32.9Very low38.9Very low235 Ų235161.1 Ų161.189%0.88783%0.833SS**  trans-168114.1140.4-111.6178.3-82.5-153.21.3111.3
9N41.7Very low39.3Very low159 Ų159159.2 Ų159.285%0.8583%0.831SS**  trans-128124.4149.9-132.8-34.8000104.4
10P44.7Very low39.5Very low118 Ų118160.3 Ų160.377%0.76683%0.832SS**  -150.8139.2116.833.6-14.7000114.7
11G38.8Very low40Very low69 Ų69157.5 Ų157.571%0.71183%0.832SS**  60.9116.7128.300000121.5
12S40.7Very low40.3Very low125 Ų125149.4 Ų149.487%0.87481%0.809SS**  trans73.8111.7138.5-1660000119.5
13S39.8Very low41Very low119 Ų119149.8 Ų149.883%0.83282%0.818SS**  178.6147108.286.10000111.2
14G38.3Very low41.4Very low71 Ų71144.3 Ų144.373%0.73280%0.802SS**  trans115.2104.5147.500000118.3
15R39.5Very low42.1Very low220 Ų220138 Ų13883%0.8379%0.793SS**  trans72.597.9155.5-70.8-173.6-177-174.82.9119.3E17R15-E17 PolarHBondContact O-N 3.23Å
16K41.9Very low42.2Very low218 Ų218142.8 Ų142.895%0.94880%0.8SS**  trans-61.7104.1140.7-87.4-174.3172.6-179.70108.4
17E41.3Very low42.7Very low155 Ų155141.7 Ų141.772%0.72479%0.788SS**PPolyproline II helixtrans-83.4120156.7-64.9-147.7163.200108.7R15R15-E17 PolarHBondContact O-N 3.23Å
18R44.7Very low43Very low234 Ų234136.5 Ų136.588%0.88377%0.771SS**PPolyproline II helixtrans-76.6119.2176.7-171.2-176.1-164.41753106.6E20R18-E20 PolarHBondContact O-N 2.83Å
19P46.1Very low43.7Very low124 Ų124134.4 Ų134.481%0.80576%0.763SS**PPolyproline II helixtrans-71.4117.9170.117.9-12.9000108.2
20E42.7Very low44.2Very low182 Ų182131.1 Ų131.185%0.8575%0.749SS**  trans-35.3137.3165.9-74.5-72.8143.100111.9R18 G22R18-E20 PolarHBondContact O-N 2.83Å; E20-G22 VanDerWaalsContact C-N 3.28Å; E20-G22 PolarHBondContact O-N 3.18Å
21A50.7Low44.4Very low101 Ų101133.2 Ų133.284%0.83574%0.741SS**  trans-6983.3179.300000110.4
22G41.5Very low45Very low64 Ų64134.8 Ų134.866%0.6673%0.734SS**  trans-87.698.8165.900000110.2E20 G24E20-G22 VanDerWaalsContact C-N 3.28Å; E20-G22 PolarHBondContact O-N 3.18Å; G22-G24 VanDerWaalsContact C-N 3.32Å; G22-G24 PolarHBondContact O-N 2.91Å
23T50.7Low45.6Very low154 Ų154135.6 Ų135.695%0.94572%0.723SS**  trans-6290.8165.340.10000109.7
24G43.2Very low46.2Very low50 Ų50134.3 Ų134.352%0.51571%0.711SS.*  trans-147114.7178.600000110.9G22 W26G22-G24 VanDerWaalsContact C-N 3.32Å; G22-G24 PolarHBondContact O-N 2.91Å; G24-W26 PolarHBondContact O-N 3.23Å
25S46.2Very low46.9Very low101 Ų101135.6 Ų135.671%0.70670%0.699SS**  trans-34.4109.6-179.2179.30000115.8L27S25-L27 PolarHBondContact O-N 3.36Å
26W42.9Very low47.6Very low211 Ų211130.4 Ų130.480%0.79969%0.688SS**THydrogen-bonded Turntrans-78.13170.1-73.988.3000113.8G24G24-W26 PolarHBondContact O-N 3.23Å
27L48.7Very low47.9Very low114 Ų114124.3 Ų124.360%0.59767%0.669SS**THydrogen-bonded Turntrans-88.1-7.1-175.2-87.2154.3000114.3S25S25-L27 PolarHBondContact O-N 3.36Å
28G47Very low48.1Very low42 Ų42122.1 Ų122.143%0.43366%0.662SS.*SBendtrans-93.3-26.3-175.600000115.9
29R47.3Very low48.4Very low191 Ų191113.3 Ų113.372%0.72164%0.639SS**Hα-helixtrans-83.7-27.5-168.7-162.2173.2-73.7148.4-2.6113.8
30T51.4Low48.3Very low90 Ų90113.5 Ų113.555%0.55263%0.634SS**Hα-helixtrans-85.8-26.9-178.6430000113.8V34T30-V34 WeakPolarHBondContact O-CG2 3.3Å; T30-V34 PolarHBondContact O-N 2.97Å
31R49.4Very low48.6Very low162 Ų162112 Ų11261%0.61163%0.626SS**Hα-helixtrans-69.6-41.7179.8-73.8-176.8-176.6158.82.2112.7Q33 V34 I35R31-Q33 PolarHBondContact O-N 3.45Å; R31-V34 PolarHBondContact O-N 2.64Å; R31-I35 HydrophobicContact CB-CD1 4.43Å; R31-I35 WeakPolarHBondContact O-CB 3.24Å; R31-I35 WeakPolarHBondContact O-CD1 3.37Å; R31-I35 WeakPolarHBondContact O-CG1 3.16Å; R31-I35 PolarHBondContact O-N 3.35Å
32N51.4Low48.4Very low103 Ų103117.2 Ų117.255%0.55162%0.624SS**Hα-helixtrans-70.9-30.8-176.9-69.2-9.2000112.8N36N32-N36 VanDerWaalsContact O-CB 3.3Å; N32-N36 WeakPolarHBondContact O-CB 3.34Å; N32-N36 VanDerWaalsContact O-CG 3.22Å; N32-N36 PolarHBondContact O-N 3.31Å; N32-N36 PolarHBondContact O-ND2 3.36Å
33Q53.3Low48.4Very low141 Ų141122.5 Ų122.566%0.65963%0.632SS**Hα-helixtrans-68-42.2172.3-90.1-178.6-11.600112.3R31 N36 T37R31-Q33 PolarHBondContact O-N 3.45Å; Q33-N36 PolarHBondContact O-N 3.25Å; Q33-T37 PolarHBondContact O-N 2.99Å; Q33-T37 PolarHBondContact O-OG1 3.48Å
34V52.4Low48.1Very low93 Ų93126 Ų12656%0.56463%0.627SS**Hα-helixtrans-68.7-38.5177.6175.10000111.4T30 R31 T37 L38T30-V34 WeakPolarHBondContact O-CG2 3.3Å; T30-V34 PolarHBondContact O-N 2.97Å; R31-V34 PolarHBondContact O-N 2.64Å; V34-T37 WeakPolarHBondContact CA-OG1 3.44Å; V34-T37 PolarHBondContact O-OG1 3.48Å; V34-L38 WeakPolarHBondContact O-CB 3.18Å; V34-L38 PolarHBondContact O-N 2.81Å
35I53.5Low48Very low97 Ų97125.9 Ų125.950%0.49763%0.626SS.*Hα-helixtrans-68.3-40.2176.8-65.8163.8000110.6R31 L38 A39R31-I35 HydrophobicContact CB-CD1 4.43Å; R31-I35 WeakPolarHBondContact O-CB 3.24Å; R31-I35 WeakPolarHBondContact O-CD1 3.37Å; R31-I35 WeakPolarHBondContact O-CG1 3.16Å; R31-I35 PolarHBondContact O-N 3.35Å; I35-L38 PolarHBondContact O-N 2.89Å; I35-A39 VanDerWaalsContact O-CB 3.24Å; I35-A39 WeakPolarHBondContact O-CB 3.45Å; I35-A39 PolarHBondContact O-N 2.89Å
36N52.4Low48Very low112 Ų112127.7 Ų127.760%0.59963%0.633SS**Hα-helixtrans-70.1-36.9177.5-73.1-9.1000112.4N32 Q33 A39 D40N32-N36 VanDerWaalsContact O-CB 3.3Å; N32-N36 WeakPolarHBondContact O-CB 3.34Å; N32-N36 VanDerWaalsContact O-CG 3.22Å; N32-N36 PolarHBondContact O-N 3.31Å; N32-N36 PolarHBondContact O-ND2 3.36Å; Q33-N36 PolarHBondContact O-N 3.25Å; N36-A39 PolarHBondContact O-N 2.96Å; N36-D40 VanDerWaalsContact O-CB 3.31Å; N36-D40 WeakPolarHBondContact O-CB 3.31Å; N36-D40 PolarHBondContact O-N 3.46Å
37T50.2Low48.3Very low89 Ų89124.6 Ų124.655%0.54663%0.632SS.*Hα-helixtrans-69.5-33.9171.929.30000112.7Q33 V34 H41Q33-T37 PolarHBondContact O-N 2.99Å; Q33-T37 PolarHBondContact O-OG1 3.48Å; V34-T37 WeakPolarHBondContact CA-OG1 3.44Å; V34-T37 PolarHBondContact O-OG1 3.48Å; T37-H41 PolarHBondContact O-N 3.01Å
38L45.3Very low48.3Very low109 Ų109126.8 Ų126.857%0.57164%0.644SS**Hα-helixtrans-72.3-33.6174.9-168.972.4000112.3V34 I35V34-L38 WeakPolarHBondContact O-CB 3.18Å; V34-L38 PolarHBondContact O-N 2.81Å; I35-L38 PolarHBondContact O-N 2.89Å
39A49.7Very low48.5Very low49 Ų49127.4 Ų127.441%0.40565%0.65SS.*Hα-helixtrans-72.2-38.3174.900000111.7I35 N36 H41 R42I35-A39 VanDerWaalsContact O-CB 3.24Å; I35-A39 WeakPolarHBondContact O-CB 3.45Å; I35-A39 PolarHBondContact O-N 2.89Å; N36-A39 PolarHBondContact O-N 2.96Å; A39-H41 PolarHBondContact O-N 3.33Å; A39-R42 PolarHBondContact O-N 3.29Å
40D45.4Very low48.8Very low129 Ų129121.9 Ų121.969%0.6965%0.653SS**Hα-helixtrans-67.2-25.7177.3-156.245.9000112.2N36 R42N36-D40 VanDerWaalsContact O-CB 3.31Å; N36-D40 WeakPolarHBondContact O-CB 3.31Å; N36-D40 PolarHBondContact O-N 3.46Å; D40-R42 VanDerWaalsContact C-N 3.33Å
41H47.7Very low49.4Very low150 Ų150120.6 Ų120.669%0.69465%0.648SS**THydrogen-bonded Turntrans-79.3-6.9170.9-84.222.7000115.1T37 A39T37-H41 PolarHBondContact O-N 3.01Å; A39-H41 PolarHBondContact O-N 3.33Å
42R46.5Very low50.4Low210 Ų210117.4 Ų117.479%0.79265%0.648SS**THydrogen-bonded Turntrans-91.6-0.2178-76.9-169.4178.4-1621.2114.8A39 D40A39-R42 PolarHBondContact O-N 3.29Å; D40-R42 VanDerWaalsContact C-N 3.33Å
43H41.5Very low51.1Low176 Ų176121.8 Ų121.882%0.81566%0.656SS**SBendtrans-106.410175-92.8-65.4000114.9G45H43-G45 PolarHBondContact O-N 3.13Å; H43-G45 VanDerWaalsContact O-N 3.13Å
44R44.4Very low52Low226 Ų226119.9 Ų119.985%0.85365%0.651SS**SBendtrans-86.290.8178.4-158.4175-175.3-159.41.1110.6
45G41Very low53.1Low48 Ų48121.5 Ų121.550%0.49566%0.655SS.*  trans52.6114.2151.100000116.4H43 D47H43-G45 PolarHBondContact O-N 3.13Å; H43-G45 VanDerWaalsContact O-N 3.13Å; G45-D47 PolarHBondContact O-N 3.25Å
46T46.8Very low54.2Low139 Ų139122 Ų12285%0.85366%0.658SS**  trans-63.958.6146.641.40000110.3L48T46-L48 PolarHBondContact O-N 2.65Å
47D48.9Very low55.3Low146 Ų146120.1 Ų120.178%0.78165%0.647SS**  trans-83.267162.4-66.3-34.6000106.1G45 G49G45-D47 PolarHBondContact O-N 3.25Å; D47-G49 PolarHBondContact O-N 2.84Å
48L48.6Very low56.6Low161 Ų161120.2 Ų120.284%0.84365%0.647SS**  trans-56.399.5158.9-74.3170.4000105.9T46 G50T46-L48 PolarHBondContact O-N 2.65Å; L48-G50 PolarHBondContact O-N 2.74Å
49G51.6Low58.1Low55 Ų55119.3 Ų119.357%0.56765%0.647SS**  trans-0.4102.7179.400000114.5D47 S51D47-G49 PolarHBondContact O-N 2.84Å; G49-S51 PolarHBondContact O-N 2.96Å
50G54.1Low59.3Low75 Ų75124.1 Ų124.177%0.77366%0.659SS**  trans-57.769.3-179.100000114.4L48 P52L48-G50 PolarHBondContact O-N 2.74Å; G50-P52 WeakPolarHBondContact O-CD 3.33Å
51S63Low60.8Low63 Ų63122.4 Ų122.444%0.44165%0.649SS.*  trans-95.5105.3154.8-790000106.5G49 W53 L54G49-S51 PolarHBondContact O-N 2.96Å; S51-W53 PolarHBondContact O-N 3.44Å; S51-L54 PolarHBondContact O-N 3.03Å
52P69.8Low62.2Low94 Ų94125 Ų12561%0.6165%0.653SS**Hα-helixtrans-48.1-30.9172.6-27.734.7000112G50 L54 L55 I56G50-P52 WeakPolarHBondContact O-CD 3.33Å; P52-L54 PolarHBondContact O-N 3.46Å; P52-L55 PolarHBondContact O-N 3.03Å; P52-I56 WeakPolarHBondContact O-CD1 3.44Å; P52-I56 WeakPolarHBondContact O-CG1 3.34Å; P52-I56 PolarHBondContact O-N 2.92Å
53W66.3Low63.5Low195 Ų195118.3 Ų118.374%0.73964%0.638SS**Hα-helixtrans-56.9-40.3172.2-107.771000115.1S51 I56 I57S51-W53 PolarHBondContact O-N 3.44Å; W53-I56 PolarHBondContact O-N 3.37Å; W53-I57 HydrophobicContact CE3-CD1 3.64Å; W53-I57 HydrophobicContact CE3-CG1 4.35Å; W53-I57 HydrophobicContact CZ3-CD1 4.04Å; W53-I57 WeakPolarHBondContact O-CB 3.46Å; W53-I57 WeakPolarHBondContact O-CD1 3.49Å; W53-I57 WeakPolarHBondContact O-CG1 3.37Å; W53-I57 PolarHBondContact O-N 3.49Å
54L73.9Confident65.4Low102 Ų102116.7 Ų116.753%0.53463%0.625SS.*Hα-helixtrans-71.4-39.3179.4-69.1176.7000111.4S51 P52 I56 I57 T58S51-L54 PolarHBondContact O-N 3.03Å; P52-L54 PolarHBondContact O-N 3.46Å; L54-I56 VanDerWaalsContact C-N 3.35Å; L54-I57 PolarHBondContact O-N 3.4Å; L54-T58 WeakPolarHBondContact O-CB 3.36Å; L54-T58 PolarHBondContact O-N 2.89Å; L54-T58 PolarHBondContact O-OG1 3.25Å
55L74.2Confident67Low126 Ų126112.9 Ų112.966%0.6662%0.615SS**Hα-helixtrans-62.4-44.3173.5-69.9173.7000110.9P52 I57 T58 V59P52-L55 PolarHBondContact O-N 3.03Å; L55-I57 PolarHBondContact O-N 3.49Å; L55-T58 PolarHBondContact O-N 3.48Å; L55-V59 WeakPolarHBondContact O-CB 3.45Å; L55-V59 VanDerWaalsContact O-CG2 3.24Å; L55-V59 WeakPolarHBondContact O-CG2 3.36Å; L55-V59 PolarHBondContact O-N 3.27Å
56I76.9Confident68.5Low109 Ų109116.9 Ų116.956%0.55962%0.619SS**Hα-helixtrans-60.3-47.9176.2-66.4162.3000110.9P52 W53 L54 T58 V59 F60P52-I56 WeakPolarHBondContact O-CD1 3.44Å; P52-I56 WeakPolarHBondContact O-CG1 3.34Å; P52-I56 PolarHBondContact O-N 2.92Å; W53-I56 PolarHBondContact O-N 3.37Å; L54-I56 VanDerWaalsContact C-N 3.35Å; I56-T58 VanDerWaalsContact C-N 3.33Å; I56-T58 PolarHBondContact O-N 2.85Å; I56-V59 PolarHBondContact O-N 2.9Å; I56-F60 WeakPolarHBondContact O-CB 3.06Å; I56-F60 PolarHBondContact O-N 3.49Å
57I75.9Confident69.9Low71 Ų71112.9 Ų112.936%0.36460%0.6SS.*Hα-helixtrans-61.4-42.8178.5-70.4164.6000110.9W53 L54 L55 F60 L61W53-I57 HydrophobicContact CE3-CD1 3.64Å; W53-I57 HydrophobicContact CE3-CG1 4.35Å; W53-I57 HydrophobicContact CZ3-CD1 4.04Å; W53-I57 WeakPolarHBondContact O-CB 3.46Å; W53-I57 WeakPolarHBondContact O-CD1 3.49Å; W53-I57 WeakPolarHBondContact O-CG1 3.37Å; W53-I57 PolarHBondContact O-N 3.49Å; L54-I57 PolarHBondContact O-N 3.4Å; L55-I57 PolarHBondContact O-N 3.49Å; I57-F60 PolarHBondContact O-N 3.05Å; I57-L61 HydrophobicContact CG2-CD1 4.02Å; I57-L61 WeakPolarHBondContact O-CB 3.36Å; I57-L61 PolarHBondContact O-N 3.28Å
58T77.1Confident71.4Confident91 Ų91109.2 Ų109.256%0.55858%0.579SS**Hα-helixtrans-70-42-176.6-450000111.4L54 L55 I56 R62L54-T58 WeakPolarHBondContact O-CB 3.36Å; L54-T58 PolarHBondContact O-N 2.89Å; L54-T58 PolarHBondContact O-OG1 3.25Å; L55-T58 PolarHBondContact O-N 3.48Å; I56-T58 VanDerWaalsContact C-N 3.33Å; I56-T58 PolarHBondContact O-N 2.85Å; T58-R62 VanDerWaalsContact O-CB 3.3Å; T58-R62 WeakPolarHBondContact O-CB 3.46Å; T58-R62 PolarHBondContact O-N 3.41Å
59V76.4Confident72.7Confident91 Ų91105 Ų10555%0.55256%0.563SS**Hα-helixtrans-63.3-45.2173.4171.50000110.2L55 I56 L61 R62 S63L55-V59 WeakPolarHBondContact O-CB 3.45Å; L55-V59 VanDerWaalsContact O-CG2 3.24Å; L55-V59 WeakPolarHBondContact O-CG2 3.36Å; L55-V59 PolarHBondContact O-N 3.27Å; I56-V59 PolarHBondContact O-N 2.9Å; V59-L61 PolarHBondContact O-N 3.4Å; V59-R62 PolarHBondContact O-N 3.31Å; V59-S63 WeakPolarHBondContact O-CB 3.38Å; V59-S63 PolarHBondContact O-N 3.25Å; V59-S63 PolarHBondContact O-OG 3.02Å; V59-S63 VanDerWaalsContact O-OG 3.08Å
60F74.3Confident73.9Confident150 Ų150106.5 Ų106.566%0.65856%0.558SS**Hα-helixtrans-62.8-44.2178.4-170.2-96.3000112.3I56 I57 R62 S63 Y64I56-F60 WeakPolarHBondContact O-CB 3.06Å; I56-F60 PolarHBondContact O-N 3.49Å; I57-F60 PolarHBondContact O-N 3.05Å; F60-R62 VanDerWaalsContact C-N 3.33Å; F60-R62 PolarHBondContact O-N 3.3Å; F60-S63 PolarHBondContact O-N 3.27Å; F60-Y64 VanDerWaalsContact O-CB 3.25Å; F60-Y64 WeakPolarHBondContact O-CB 3.34Å; F60-Y64 PolarHBondContact O-N 3.32Å
61L77.1Confident74.8Confident93 Ų93106.3 Ų106.349%0.48754%0.544SS..Hα-helixtrans-61.9-40.5175-11078.7000112.1I57 V59 K65I57-L61 HydrophobicContact CG2-CD1 4.02Å; I57-L61 WeakPolarHBondContact O-CB 3.36Å; I57-L61 PolarHBondContact O-N 3.28Å; V59-L61 PolarHBondContact O-N 3.4Å; L61-K65 WeakPolarHBondContact O-CB 3.36Å; L61-K65 WeakPolarHBondContact O-CG 3.49Å; L61-K65 PolarHBondContact O-N 3.02Å
62R78.3Confident75.6Confident205 Ų205107.3 Ų107.377%0.77455%0.548SS*.Hα-helixtrans-67.8-45.1179.6-173.6171.1175.7147.9-2.3111.1T58 V59 F60 K65 F66T58-R62 VanDerWaalsContact O-CB 3.3Å; T58-R62 WeakPolarHBondContact O-CB 3.46Å; T58-R62 PolarHBondContact O-N 3.41Å; V59-R62 PolarHBondContact O-N 3.31Å; F60-R62 VanDerWaalsContact C-N 3.33Å; F60-R62 PolarHBondContact O-N 3.3Å; R62-K65 PolarHBondContact O-N 2.67Å; R62-F66 WeakPolarHBondContact O-CB 3.49Å; R62-F66 PolarHBondContact O-N 2.94Å
63S74.1Confident75.9Confident68 Ų68105.5 Ų105.548%0.47654%0.537SS..Hα-helixtrans-64.9-39.7175.7-62.30000112.2V59 F60 F66 A67V59-S63 WeakPolarHBondContact O-CB 3.38Å; V59-S63 PolarHBondContact O-N 3.25Å; V59-S63 PolarHBondContact O-OG 3.02Å; V59-S63 VanDerWaalsContact O-OG 3.08Å; F60-S63 PolarHBondContact O-N 3.27Å; S63-F66 PolarHBondContact O-N 3.35Å; S63-A67 WeakPolarHBondContact O-CB 3.45Å; S63-A67 PolarHBondContact O-N 2.9Å
64Y81.3Confident76.4Confident142 Ų142103.1 Ų103.156%0.55753%0.529SS*.Hα-helixtrans-63.6-45.6175.8172.6-108.6000112.2F60 F66 A67 I68F60-Y64 VanDerWaalsContact O-CB 3.25Å; F60-Y64 WeakPolarHBondContact O-CB 3.34Å; F60-Y64 PolarHBondContact O-N 3.32Å; Y64-F66 VanDerWaalsContact C-N 3.28Å; Y64-F66 PolarHBondContact O-N 3.38Å; Y64-A67 PolarHBondContact O-N 3.04Å; Y64-I68 HydrophobicContact CD1-CD1 3.71Å; Y64-I68 HydrophobicContact CD2-CD1 4.23Å; Y64-I68 HydrophobicContact CD2-CG1 4.42Å; Y64-I68 HydrophobicContact CE1-CD1 3.19Å; Y64-I68 HydrophobicContact CE1-CG1 4.3Å; Y64-I68 HydrophobicContact CE2-CD1 3.76Å; Y64-I68 HydrophobicContact CE2-CG1 4.03Å; Y64-I68 HydrophobicContact CG-CD1 4.21Å; Y64-I68 WeakPolarHBondContact O-CG1 3.45Å; Y64-I68 PolarHBondContact O-N 3.32Å
65K78.4Confident76.5Confident146 Ų146102.6 Ų102.664%0.63553%0.526SS*.Hα-helixtrans-60.4-39.7173.8-77.5-177.3175.1-176.50111.9L61 R62 S69L61-K65 WeakPolarHBondContact O-CB 3.36Å; L61-K65 WeakPolarHBondContact O-CG 3.49Å; L61-K65 PolarHBondContact O-N 3.02Å; R62-K65 PolarHBondContact O-N 2.67Å; K65-S69 WeakPolarHBondContact O-CB 3.37Å; K65-S69 PolarHBondContact O-N 3.37Å
66F71.3Confident76.5Confident133 Ų13399.7 Ų99.758%0.58352%0.516SS*.Hα-helixtrans-66.9-41.6176.4-165.8-105.8000112R62 S63 Y64 S69 L70R62-F66 WeakPolarHBondContact O-CB 3.49Å; R62-F66 PolarHBondContact O-N 2.94Å; S63-F66 PolarHBondContact O-N 3.35Å; Y64-F66 VanDerWaalsContact C-N 3.28Å; Y64-F66 PolarHBondContact O-N 3.38Å; F66-S69 WeakPolarHBondContact O-CB 3.19Å; F66-S69 PolarHBondContact O-N 3.47Å; F66-L70 HydrophobicContact CD1-CD1 3.65Å; F66-L70 HydrophobicContact CD1-CG 4.15Å; F66-L70 HydrophobicContact CE1-CD1 3.45Å; F66-L70 VanDerWaalsContact CE1-CD1 3.45Å; F66-L70 HydrophobicContact CE1-CD2 4.41Å; F66-L70 HydrophobicContact CE1-CG 3.98Å; F66-L70 HydrophobicContact CZ-CD1 4.27Å; F66-L70 HydrophobicContact CZ-CD2 4.45Å; F66-L70 HydrophobicContact CZ-CG 4.4Å; F66-L70 WeakPolarHBondContact O-CB 3.36Å; F66-L70 WeakPolarHBondContact O-CG 3.26Å; F66-L70 PolarHBondContact O-N 2.89Å
67A75.8Confident76.3Confident54 Ų5498.9 Ų98.945%0.44652%0.516SS..Hα-helixtrans-64.5-4217600000112.3S63 Y64 L70 C71S63-A67 WeakPolarHBondContact O-CB 3.45Å; S63-A67 PolarHBondContact O-N 2.9Å; Y64-A67 PolarHBondContact O-N 3.04Å; A67-L70 PolarHBondContact O-N 3.16Å; A67-C71 VanDerWaalsContact O-CB 3.26Å; A67-C71 WeakPolarHBondContact O-CB 3.43Å; A67-C71 PolarHBondContact O-N 2.84Å
68I80.3Confident76Confident69 Ų6997.5 Ų97.535%0.35451%0.512SS..Hα-helixtrans-61.1-48.5171.7-66162.3000109.9Y64 L70 C71 T72Y64-I68 HydrophobicContact CD1-CD1 3.71Å; Y64-I68 HydrophobicContact CD2-CD1 4.23Å; Y64-I68 HydrophobicContact CD2-CG1 4.42Å; Y64-I68 HydrophobicContact CE1-CD1 3.19Å; Y64-I68 HydrophobicContact CE1-CG1 4.3Å; Y64-I68 HydrophobicContact CE2-CD1 3.76Å; Y64-I68 HydrophobicContact CE2-CG1 4.03Å; Y64-I68 HydrophobicContact CG-CD1 4.21Å; Y64-I68 WeakPolarHBondContact O-CG1 3.45Å; Y64-I68 PolarHBondContact O-N 3.32Å; I68-L70 VanDerWaalsContact C-N 3.31Å; I68-L70 PolarHBondContact O-N 3.49Å; I68-C71 WeakPolarHBondContact O-CB 3.3Å; I68-C71 PolarHBondContact O-N 3.17Å; I68-C71 VanDerWaalsContact O-N 3.16Å; I68-T72 WeakPolarHBondContact O-CB 3.38Å; I68-T72 PolarHBondContact O-N 3.36Å; I68-T72 PolarHBondContact O-OG1 3.34Å
69S77.8Confident75.6Confident72 Ų7299.5 Ų99.550%0.50351%0.514SS..Hα-helixtrans-57.8-43.7179.2-172.60000112K65 F66 S73K65-S69 WeakPolarHBondContact O-CB 3.37Å; K65-S69 PolarHBondContact O-N 3.37Å; F66-S69 WeakPolarHBondContact O-CB 3.19Å; F66-S69 PolarHBondContact O-N 3.47Å; S69-S73 VanDerWaalsContact O-CB 3.27Å; S69-S73 WeakPolarHBondContact O-CB 3.45Å; S69-S73 PolarHBondContact O-N 3Å; S69-S73 PolarHBondContact O-OG 2.89Å
70L75.7Confident75.2Confident87 Ų8799.5 Ų99.546%0.45551%0.51SS..Hα-helixtrans-64.2-46175.6-75176.6000111.3F66 A67 I68 S73 Y74F66-L70 HydrophobicContact CD1-CD1 3.65Å; F66-L70 HydrophobicContact CD1-CG 4.15Å; F66-L70 HydrophobicContact CE1-CD1 3.45Å; F66-L70 VanDerWaalsContact CE1-CD1 3.45Å; F66-L70 HydrophobicContact CE1-CD2 4.41Å; F66-L70 HydrophobicContact CE1-CG 3.98Å; F66-L70 HydrophobicContact CZ-CD1 4.27Å; F66-L70 HydrophobicContact CZ-CD2 4.45Å; F66-L70 HydrophobicContact CZ-CG 4.4Å; F66-L70 WeakPolarHBondContact O-CB 3.36Å; F66-L70 WeakPolarHBondContact O-CG 3.26Å; F66-L70 PolarHBondContact O-N 2.89Å; A67-L70 PolarHBondContact O-N 3.16Å; I68-L70 VanDerWaalsContact C-N 3.31Å; I68-L70 PolarHBondContact O-N 3.49Å; L70-S73 WeakPolarHBondContact CA-OG 3.2Å; L70-S73 PolarHBondContact O-N 3.02Å; L70-S73 PolarHBondContact O-OG 3Å; L70-Y74 VanDerWaalsContact O-CB 3.28Å; L70-Y74 WeakPolarHBondContact O-CB 3.47Å; L70-Y74 PolarHBondContact O-N 3.38Å
71C74.1Confident74.7Confident71 Ų71100.4 Ų100.448%0.4851%0.514SS..Hα-helixtrans-60.2-48177-173.20000111.6A67 I68 S73 Y74 L75A67-C71 VanDerWaalsContact O-CB 3.26Å; A67-C71 WeakPolarHBondContact O-CB 3.43Å; A67-C71 PolarHBondContact O-N 2.84Å; I68-C71 WeakPolarHBondContact O-CB 3.3Å; I68-C71 PolarHBondContact O-N 3.17Å; I68-C71 VanDerWaalsContact O-N 3.16Å; C71-S73 PolarHBondContact O-N 3.06Å; C71-Y74 PolarHBondContact O-N 2.81Å; C71-L75 WeakPolarHBondContact O-CB 3.38Å; C71-L75 VanDerWaalsContact O-CG 3.25Å; C71-L75 WeakPolarHBondContact O-CG 3.24Å; C71-L75 PolarHBondContact O-N 3.01Å
72T79.6Confident73.9Confident85 Ų8599.2 Ų99.252%0.52151%0.511SS..Hα-helixtrans-61.4-44.5176.1-56.40000111.2I68 L75 C76I68-T72 WeakPolarHBondContact O-CB 3.38Å; I68-T72 PolarHBondContact O-N 3.36Å; I68-T72 PolarHBondContact O-OG1 3.34Å; T72-L75 PolarHBondContact O-N 3.26Å; T72-C76 WeakPolarHBondContact O-CB 3.18Å; T72-C76 PolarHBondContact O-N 2.96Å
73S74.8Confident73.1Confident56 Ų5694.1 Ų94.139%0.39250%0.498SS..Hα-helixtrans-64.5-40.5177.5720000112.3S69 L70 C71 C76 V77S69-S73 VanDerWaalsContact O-CB 3.27Å; S69-S73 WeakPolarHBondContact O-CB 3.45Å; S69-S73 PolarHBondContact O-N 3Å; S69-S73 PolarHBondContact O-OG 2.89Å; L70-S73 WeakPolarHBondContact CA-OG 3.2Å; L70-S73 PolarHBondContact O-N 3.02Å; L70-S73 PolarHBondContact O-OG 3Å; C71-S73 PolarHBondContact O-N 3.06Å; S73-C76 PolarHBondContact O-N 3.29Å; S73-V77 WeakPolarHBondContact O-CB 3.35Å; S73-V77 VanDerWaalsContact O-CG2 3.29Å; S73-V77 WeakPolarHBondContact O-CG2 3.41Å; S73-V77 PolarHBondContact O-N 3.25Å
74Y77.9Confident71.9Confident145 Ų14598.5 Ų98.557%0.56951%0.508SS*.Hα-helixtrans-67.6-42.5178.8-178.5-100.7000111.8L70 C71 C76 S78L70-Y74 VanDerWaalsContact O-CB 3.28Å; L70-Y74 WeakPolarHBondContact O-CB 3.47Å; L70-Y74 PolarHBondContact O-N 3.38Å; C71-Y74 PolarHBondContact O-N 2.81Å; Y74-C76 VanDerWaalsContact C-N 3.33Å; Y74-S78 VanDerWaalsContact O-CB 3.28Å; Y74-S78 WeakPolarHBondContact O-CB 3.49Å; Y74-S78 PolarHBondContact O-N 3.07Å; Y74-S78 PolarHBondContact O-OG 3.06Å
75L75.8Confident70.6Confident90 Ų9096.5 Ų96.547%0.47151%0.513SS..Hα-helixtrans-63.7-40.1172.5-70.6172000111.1C71 T72 S78 F79C71-L75 WeakPolarHBondContact O-CB 3.38Å; C71-L75 VanDerWaalsContact O-CG 3.25Å; C71-L75 WeakPolarHBondContact O-CG 3.24Å; C71-L75 PolarHBondContact O-N 3.01Å; T72-L75 PolarHBondContact O-N 3.26Å; L75-S78 PolarHBondContact O-N 3.11Å; L75-F79 VanDerWaalsContact O-CB 3.31Å; L75-F79 WeakPolarHBondContact O-CB 3.29Å; L75-F79 PolarHBondContact O-N 3.46Å
76C73.4Confident69.2Low66 Ų6694.7 Ų94.745%0.44652%0.519SS..Hα-helixtrans-66.9-45.8178.9-159.10000111.7T72 S73 Y74 S78 F79 L80T72-C76 WeakPolarHBondContact O-CB 3.18Å; T72-C76 PolarHBondContact O-N 2.96Å; S73-C76 PolarHBondContact O-N 3.29Å; Y74-C76 VanDerWaalsContact C-N 3.33Å; C76-S78 VanDerWaalsContact C-N 3.32Å; C76-S78 PolarHBondContact O-N 2.64Å; C76-F79 PolarHBondContact O-N 2.89Å; C76-L80 WeakPolarHBondContact O-CB 3.4Å; C76-L80 WeakPolarHBondContact O-CD1 3.42Å; C76-L80 PolarHBondContact O-N 3.28Å
77V72.2Confident68.3Low92 Ų9297.4 Ų97.456%0.55853%0.533SS*.Hα-helixtrans-63.2-39.6174.8172.20000111.1S73 F79 K81S73-V77 WeakPolarHBondContact O-CB 3.35Å; S73-V77 VanDerWaalsContact O-CG2 3.29Å; S73-V77 WeakPolarHBondContact O-CG2 3.41Å; S73-V77 PolarHBondContact O-N 3.25Å; V77-F79 VanDerWaalsContact C-N 3.31Å; V77-F79 PolarHBondContact O-N 2.96Å; V77-K81 WeakPolarHBondContact O-CB 3.45Å; V77-K81 PolarHBondContact O-N 2.91Å
78S70Confident67Low41 Ų41102.1 Ų102.129%0.28755%0.551SS.*Hα-helixtrans-62.4-40.7174.7-60.20000111.3Y74 L75 C76 T82Y74-S78 VanDerWaalsContact O-CB 3.28Å; Y74-S78 WeakPolarHBondContact O-CB 3.49Å; Y74-S78 PolarHBondContact O-N 3.07Å; Y74-S78 PolarHBondContact O-OG 3.06Å; L75-S78 PolarHBondContact O-N 3.11Å; C76-S78 VanDerWaalsContact C-N 3.32Å; C76-S78 PolarHBondContact O-N 2.64Å; S78-T82 WeakPolarHBondContact O-CG2 3.4Å; S78-T82 PolarHBondContact O-N 2.98Å; S78-T82 PolarHBondContact O-OG1 3.49Å
79F69.5Low65.6Low134 Ų134102.2 Ų102.259%0.58857%0.569SS**Hα-helixtrans-73-42.9178.9-164.2-107.4000112.7L75 C76 V77 K81 T82 I83L75-F79 VanDerWaalsContact O-CB 3.31Å; L75-F79 WeakPolarHBondContact O-CB 3.29Å; L75-F79 PolarHBondContact O-N 3.46Å; C76-F79 PolarHBondContact O-N 2.89Å; V77-F79 VanDerWaalsContact C-N 3.31Å; V77-F79 PolarHBondContact O-N 2.96Å; F79-K81 VanDerWaalsContact C-N 3.3Å; F79-K81 PolarHBondContact O-N 3.45Å; F79-T82 WeakPolarHBondContact CA-OG1 3.35Å; F79-T82 WeakPolarHBondContact O-CA 3.34Å; F79-T82 PolarHBondContact O-N 2.61Å; F79-T82 PolarHBondContact O-OG1 2.89Å; F79-I83 HydrophobicContact CD1-CD1 3.59Å; F79-I83 HydrophobicContact CD1-CG1 4.38Å; F79-I83 HydrophobicContact CE1-CD1 3.17Å; F79-I83 HydrophobicContact CE1-CG1 4.22Å; F79-I83 HydrophobicContact CG-CD1 4.46Å; F79-I83 HydrophobicContact CZ-CD1 3.72Å; F79-I83 WeakPolarHBondContact O-CG1 3.45Å; F79-I83 PolarHBondContact O-N 3.43Å
80L67.8Low64Low90 Ų90107.8 Ų107.847%0.47159%0.586SS.*Hα-helixtrans-59.5-41.4173.6-88.1148.7000111.5C76 T82 I83 F84C76-L80 WeakPolarHBondContact O-CB 3.4Å; C76-L80 WeakPolarHBondContact O-CD1 3.42Å; C76-L80 PolarHBondContact O-N 3.28Å; L80-T82 PolarHBondContact O-N 2.96Å; L80-I83 PolarHBondContact O-N 3.3Å; L80-F84 PolarHBondContact O-N 2.9Å
81K63.4Low63.1Low169 Ų169111.7 Ų111.774%0.73561%0.608SS**Hα-helixtrans-68.4-20.7175.5-168.2144.8180153.70113.3V77 F79V77-K81 WeakPolarHBondContact O-CB 3.45Å; V77-K81 PolarHBondContact O-N 2.91Å; F79-K81 VanDerWaalsContact C-N 3.3Å; F79-K81 PolarHBondContact O-N 3.45Å
82T59.7Low62.3Low69 Ų69110.2 Ų110.242%0.42361%0.605SS.*Hα-helixtrans-85.9-25.7170.653.60000114.1S78 F79 L80S78-T82 WeakPolarHBondContact O-CG2 3.4Å; S78-T82 PolarHBondContact O-N 2.98Å; S78-T82 PolarHBondContact O-OG1 3.49Å; F79-T82 WeakPolarHBondContact CA-OG1 3.35Å; F79-T82 WeakPolarHBondContact O-CA 3.34Å; F79-T82 PolarHBondContact O-N 2.61Å; F79-T82 PolarHBondContact O-OG1 2.89Å; L80-T82 PolarHBondContact O-N 2.96Å
83I61.6Low61.2Low98 Ų98109.9 Ų109.950%0.50361%0.606SS.*Hα-helixtrans-88.5-33.9-178.6-69.4-176.5000112.3F79 L80 P85F79-I83 HydrophobicContact CD1-CD1 3.59Å; F79-I83 HydrophobicContact CD1-CG1 4.38Å; F79-I83 HydrophobicContact CE1-CD1 3.17Å; F79-I83 HydrophobicContact CE1-CG1 4.22Å; F79-I83 HydrophobicContact CG-CD1 4.46Å; F79-I83 HydrophobicContact CZ-CD1 3.72Å; F79-I83 WeakPolarHBondContact O-CG1 3.45Å; F79-I83 PolarHBondContact O-N 3.43Å; L80-I83 PolarHBondContact O-N 3.3Å; I83-P85 VanDerWaalsContact C-CD 3.47Å; I83-P85 WeakPolarHBondContact O-CD 3.37Å
84F48.7Very low60.4Low160 Ų160112.7 Ų112.770%0.70262%0.621SS**  trans-109.585.6175.4-79-85.9000110.9L80 S86L80-F84 PolarHBondContact O-N 2.9Å; F84-S86 PolarHBondContact O-N 2.86Å; F84-S86 VanDerWaalsContact O-N 3.14Å
85P54.4Low59.8Low100 Ų100111 Ų11165%0.64962%0.622SS**  trans-67.1108.7160.927-28.2000107.4I83 Q87I83-P85 VanDerWaalsContact C-CD 3.47Å; I83-P85 WeakPolarHBondContact O-CD 3.37Å; P85-Q87 PolarHBondContact O-N 3.01Å
86S49.9Very low59.1Low108 Ų108111.4 Ų111.476%0.75563%0.628SS**  trans-60.8112.6171.662.90000108.2F84 N88F84-S86 PolarHBondContact O-N 2.86Å; F84-S86 VanDerWaalsContact O-N 3.14Å; S86-N88 PolarHBondContact O-N 3.46Å
87Q52.8Low58.5Low189 Ų189114.2 Ų114.288%0.88363%0.634SS**  trans-61.7100.9169-89.4175.9-7.500108.7P85P85-Q87 PolarHBondContact O-N 3.01Å
88N48.8Very low58.1Low154 Ų154115.2 Ų115.282%0.82463%0.633SS**  trans-126115.9153.9-83.2-13.2000106.2S86S86-N88 PolarHBondContact O-N 3.46Å
89G50.3Low58Low71 Ų71122.1 Ų122.173%0.73265%0.653SS**  trans-71.3145.1-162.900000115.4
90H44.3Very low57.7Low188 Ų188118.1 Ų118.187%0.8764%0.644SS**  178.2154.6108.5-99.3-70.9000109.3G92H90-G92 PolarHBondContact O-N 3.5Å
91D56.8Low57.6Low169 Ų169123.4 Ų123.490%0.90466%0.658SS**SBendtrans-42.1117.2-165.3-83.4-51.2000117.2
92G57Low57.6Low41 Ų41123.7 Ų123.742%0.42365%0.654SS.*  trans176.322.3172.600000113.5H90 T94 V96H90-G92 PolarHBondContact O-N 3.5Å; G92-T94 PolarHBondContact O-N 2.93Å; G92-V96 WeakPolarHBondContact O-CG2 3.29Å
93S56.9Low57.7Low78 Ų78123.5 Ų123.555%0.54566%0.656SS.*Hα-helixtrans-70.9-25.6-153.4-176.30000115.7Q97S93-Q97 WeakPolarHBondContact O-CB 3.25Å; S93-Q97 VanDerWaalsContact O-CG 3.26Å; S93-Q97 WeakPolarHBondContact O-CG 3.49Å; S93-Q97 PolarHBondContact O-N 3.39Å
94T57.2Low57.8Low114 Ų114122.2 Ų122.270%0.69965%0.65SS**Hα-helixtrans-83.1-43.3-175.731.40000112.6G92 Q98G92-T94 PolarHBondContact O-N 2.93Å; T94-Q98 WeakPolarHBondContact O-CB 3.37Å; T94-Q98 PolarHBondContact O-N 3.45Å
95D65.8Low58.6Low111 Ų111122.8 Ų122.859%0.59465%0.647SS**Hα-helixtrans-69.7-41.1179.8-173.666.6000112Q98 R99D95-Q98 PolarHBondContact O-N 2.97Å; D95-R99 VanDerWaalsContact O-CB 3.24Å; D95-R99 WeakPolarHBondContact O-CB 3.35Å; D95-R99 PolarHBondContact O-N 2.72Å
96V61.1Low58.9Low97 Ų97127.2 Ų127.259%0.58865%0.651SS**Hα-helixtrans-67.7-42.3179.4179.20000111.6G92 R99 A100G92-V96 WeakPolarHBondContact O-CG2 3.29Å; V96-R99 PolarHBondContact O-N 3.44Å; V96-A100 WeakPolarHBondContact O-CB 3.36Å; V96-A100 PolarHBondContact O-N 3.21Å
97Q59.9Low59.4Low126 Ų126129 Ų12959%0.58964%0.641SS**Hα-helixtrans-65.7-39.1174.8-76.9-165.3-3.600111.7S93 A100 R101S93-Q97 WeakPolarHBondContact O-CB 3.25Å; S93-Q97 VanDerWaalsContact O-CG 3.26Å; S93-Q97 WeakPolarHBondContact O-CG 3.49Å; S93-Q97 PolarHBondContact O-N 3.39Å; Q97-A100 PolarHBondContact O-N 2.98Å; Q97-R101 VanDerWaalsContact O-CB 3.29Å; Q97-R101 WeakPolarHBondContact O-CB 3.29Å; Q97-R101 PolarHBondContact O-N 3.25Å
98Q64.1Low59.8Low112 Ų112126.6 Ų126.652%0.52363%0.63SS.*Hα-helixtrans-69.6-34.7178.1-164.4160.2-800112T94 D95 R101 R102T94-Q98 WeakPolarHBondContact O-CB 3.37Å; T94-Q98 PolarHBondContact O-N 3.45Å; D95-Q98 PolarHBondContact O-N 2.97Å; Q98-R101 PolarHBondContact O-N 3.01Å; Q98-R102 WeakPolarHBondContact O-CB 3.41Å; Q98-R102 WeakPolarHBondContact O-CG 3.27Å; Q98-R102 PolarHBondContact O-N 2.93Å
99R68.6Low60.6Low187 Ų187123.7 Ų123.771%0.70661%0.612SS**Hα-helixtrans-68.6-41.9172.5-163.6173.4-163.2-169.14.8112.2D95 V96 R102 S103D95-R99 VanDerWaalsContact O-CB 3.24Å; D95-R99 WeakPolarHBondContact O-CB 3.35Å; D95-R99 PolarHBondContact O-N 2.72Å; V96-R99 PolarHBondContact O-N 3.44Å; R99-R102 PolarHBondContact O-N 2.87Å; R99-S103 WeakPolarHBondContact O-CB 3.17Å; R99-S103 PolarHBondContact O-N 3.44Å
100A62.9Low61.5Low49 Ų49121.9 Ų121.941%0.40559%0.593SS.*Hα-helixtrans-63.7-40.7173.100000111.7V96 Q97 S103 N104V96-A100 WeakPolarHBondContact O-CB 3.36Å; V96-A100 PolarHBondContact O-N 3.21Å; Q97-A100 PolarHBondContact O-N 2.98Å; A100-S103 PolarHBondContact O-N 3.44Å; A100-N104 WeakPolarHBondContact O-CB 3.42Å; A100-N104 PolarHBondContact O-N 3.45Å
101R65.4Low62.8Low201 Ų201117.1 Ų117.176%0.75857%0.573SS**Hα-helixtrans-65.9-42.6176.8-149.6175.3-165.9145.70.9112.1Q97 Q98 S103 R105Q97-R101 VanDerWaalsContact O-CB 3.29Å; Q97-R101 WeakPolarHBondContact O-CB 3.29Å; Q97-R101 PolarHBondContact O-N 3.25Å; Q98-R101 PolarHBondContact O-N 3.01Å; R101-S103 VanDerWaalsContact C-N 3.35Å; R101-R105 PolarHBondContact O-N 2.85Å; R101-R105 VanDerWaalsContact O-N 3.07Å
102R62.8Low63.5Low175 Ų175115.2 Ų115.266%0.6656%0.557SS**Hα-helixtrans-63.4-39.1172.8-80.4-179174.3178.2-0.2112Q98 R99 R106Q98-R102 WeakPolarHBondContact O-CB 3.41Å; Q98-R102 WeakPolarHBondContact O-CG 3.27Å; Q98-R102 PolarHBondContact O-N 2.93Å; R99-R102 PolarHBondContact O-N 2.87Å; R102-R106 PolarHBondContact O-N 3.41Å
103S61.7Low64.3Low66 Ų66118 Ų11846%0.46256%0.561SS.*Hα-helixtrans-67.9-44177.5-1710000112.5R99 A100 R101 R105 R106 R107R99-S103 WeakPolarHBondContact O-CB 3.17Å; R99-S103 PolarHBondContact O-N 3.44Å; A100-S103 PolarHBondContact O-N 3.44Å; R101-S103 VanDerWaalsContact C-N 3.35Å; S103-R105 VanDerWaalsContact C-N 3.35Å; S103-R105 PolarHBondContact O-N 2.85Å; S103-R106 PolarHBondContact O-N 3.08Å; S103-R107 PolarHBondContact O-N 3.5Å
104N64.9Low65.1Low70 Ų70118.3 Ų118.337%0.37456%0.559SS.*Hα-helixtrans-65.3-36.4177.2-89.2-20.6000112.9A100 R107 Q108A100-N104 WeakPolarHBondContact O-CB 3.42Å; A100-N104 PolarHBondContact O-N 3.45Å; N104-R107 PolarHBondContact O-N 2.76Å; N104-Q108 WeakPolarHBondContact O-CB 3.25Å; N104-Q108 WeakPolarHBondContact O-CG 3.39Å; N104-Q108 PolarHBondContact O-N 2.82Å
105R64.3Low65.8Low172 Ų172117.9 Ų117.965%0.64955%0.552SS**Hα-helixtrans-61.8-46.2174.1-174.6172.3176.4167.82.8111.9R101 S103 R107 Q108 E109R101-R105 PolarHBondContact O-N 2.85Å; R101-R105 VanDerWaalsContact O-N 3.07Å; S103-R105 VanDerWaalsContact C-N 3.35Å; S103-R105 PolarHBondContact O-N 2.85Å; R105-R107 VanDerWaalsContact C-N 3.35Å; R105-R107 PolarHBondContact O-N 2.9Å; R105-Q108 PolarHBondContact O-N 3.36Å; R105-E109 WeakPolarHBondContact CG-OE1 3.5Å; R105-E109 IonicContact NE-OE1 3.53Å; R105-E109 WeakPolarHBondContact O-CG 3.28Å; R105-E109 PolarHBondContact O-N 3.44Å
106R61.2Low66.4Low193 Ų193117.6 Ų117.673%0.72855%0.547SS*.Hα-helixtrans-63.9-37.2175.7-69.8-175.8-178.2-172.60.4112.6R102 S103 E109 G110R102-R106 PolarHBondContact O-N 3.41Å; S103-R106 PolarHBondContact O-N 3.08Å; R106-E109 PolarHBondContact O-N 3.25Å; R106-G110 PolarHBondContact O-N 2.92Å
107R60.5Low67.2Low146 Ų146118 Ų11855%0.55155%0.546SS*.Hα-helixtrans-67.1-41174.2-91.6-170.8171.3-154-1.6112.6S103 N104 R105 E109 G110 I111S103-R107 PolarHBondContact O-N 3.5Å; N104-R107 PolarHBondContact O-N 2.76Å; R105-R107 VanDerWaalsContact C-N 3.35Å; R105-R107 PolarHBondContact O-N 2.9Å; R107-E109 VanDerWaalsContact C-N 3.31Å; R107-G110 PolarHBondContact O-N 3.08Å; R107-I111 WeakPolarHBondContact O-CG1 3.32Å; R107-I111 PolarHBondContact O-N 2.8Å
108Q60.3Low68.1Low139 Ų139116.9 Ų116.965%0.6554%0.543SS*.Hα-helixtrans-63.5-38.7174.7-80.6-179.6-11.900111.6N104 R105 I111 K112N104-Q108 WeakPolarHBondContact O-CB 3.25Å; N104-Q108 WeakPolarHBondContact O-CG 3.39Å; N104-Q108 PolarHBondContact O-N 2.82Å; R105-Q108 PolarHBondContact O-N 3.36Å; Q108-I111 PolarHBondContact O-N 3.26Å; Q108-K112 VanDerWaalsContact O-CB 3.31Å; Q108-K112 WeakPolarHBondContact O-CB 3.46Å; Q108-K112 PolarHBondContact O-N 3.27Å
109E67.1Low68.8Low93 Ų93117.5 Ų117.544%0.43554%0.544SS..Hα-helixtrans-62.2-44.4173.2-72162.9-173.500111.3R105 R106 R107 K112 I113R105-E109 WeakPolarHBondContact CG-OE1 3.5Å; R105-E109 IonicContact NE-OE1 3.53Å; R105-E109 WeakPolarHBondContact O-CG 3.28Å; R105-E109 PolarHBondContact O-N 3.44Å; R106-E109 PolarHBondContact O-N 3.25Å; R107-E109 VanDerWaalsContact C-N 3.31Å; E109-K112 WeakPolarHBondContact O-CB 3.24Å; E109-K112 PolarHBondContact O-N 2.81Å; E109-I113 WeakPolarHBondContact O-CD1 3.49Å; E109-I113 VanDerWaalsContact O-CG1 3.29Å; E109-I113 WeakPolarHBondContact O-CG1 3.42Å; E109-I113 PolarHBondContact O-N 3.45Å
110G68.5Low69.6Low33 Ų33112 Ų11234%0.3453%0.532SS..Hα-helixtrans-63.2-41.2174.900000113.8R106 R107 K112 I113 V114R106-G110 PolarHBondContact O-N 2.92Å; R107-G110 PolarHBondContact O-N 3.08Å; G110-K112 VanDerWaalsContact C-N 3.35Å; G110-I113 PolarHBondContact O-N 2.81Å; G110-V114 WeakPolarHBondContact O-CG2 3.43Å; G110-V114 PolarHBondContact O-N 2.82Å; G110-V114 VanDerWaalsContact O-N 3.1Å
111I70.9Confident70.4Confident88 Ų88115.1 Ų115.145%0.45154%0.541SS..Hα-helixtrans-65.7-39.8176.1-71.6166.2000110.9R107 Q108 V114 L115R107-I111 WeakPolarHBondContact O-CG1 3.32Å; R107-I111 PolarHBondContact O-N 2.8Å; Q108-I111 PolarHBondContact O-N 3.26Å; I111-V114 PolarHBondContact O-N 2.91Å; I111-L115 HydrophobicContact CG2-CD1 3.69Å; I111-L115 WeakPolarHBondContact O-CB 3.26Å; I111-L115 WeakPolarHBondContact O-CD1 3.3Å; I111-L115 PolarHBondContact O-N 3.4Å
112K72.5Confident71.3Confident129 Ų129113 Ų11356%0.56153%0.533SS*.Hα-helixtrans-61.6-45.1176.6-172.6-175.6176-166.20111.6Q108 E109 G110 L115 E116Q108-K112 VanDerWaalsContact O-CB 3.31Å; Q108-K112 WeakPolarHBondContact O-CB 3.46Å; Q108-K112 PolarHBondContact O-N 3.27Å; E109-K112 WeakPolarHBondContact O-CB 3.24Å; E109-K112 PolarHBondContact O-N 2.81Å; G110-K112 VanDerWaalsContact C-N 3.35Å; K112-L115 PolarHBondContact O-N 3.03Å; K112-E116 WeakPolarHBondContact CE-OE1 3.42Å; K112-E116 IonicContact NZ-OE1 3.96Å; K112-E116 WeakPolarHBondContact O-CG 3.4Å; K112-E116 PolarHBondContact O-N 2.83Å
113I73.9Confident72.2Confident99 Ų99112.1 Ų112.151%0.50853%0.529SS..Hα-helixtrans-61.3-47.4177.4-66.5162.4000110.5E109 G110 L115 E116 D117E109-I113 WeakPolarHBondContact O-CD1 3.49Å; E109-I113 VanDerWaalsContact O-CG1 3.29Å; E109-I113 WeakPolarHBondContact O-CG1 3.42Å; E109-I113 PolarHBondContact O-N 3.45Å; G110-I113 PolarHBondContact O-N 2.81Å; I113-L115 VanDerWaalsContact C-N 3.29Å; I113-L115 PolarHBondContact O-N 3.44Å; I113-E116 PolarHBondContact O-N 3.22Å; I113-D117 PolarHBondContact O-N 2.83Å
114V72.4Confident73.1Confident84 Ų84114.3 Ų114.351%0.50953%0.532SS..Hα-helixtrans-61.5-38.5178.11730000111.6G110 I111 I118G110-V114 WeakPolarHBondContact O-CG2 3.43Å; G110-V114 PolarHBondContact O-N 2.82Å; G110-V114 VanDerWaalsContact O-N 3.1Å; I111-V114 PolarHBondContact O-N 2.91Å; V114-I118 HydrophobicContact CG1-CD1 3.84Å; V114-I118 WeakPolarHBondContact O-CD1 3.18Å; V114-I118 WeakPolarHBondContact O-CG1 3.35Å; V114-I118 PolarHBondContact O-N 3.26Å
115L72Confident74Confident106 Ų106114.9 Ų114.956%0.55554%0.539SS*.Hα-helixtrans-67.6-40.6175.7-93.1148.9000112.9I111 K112 I113 I118 F119I111-L115 HydrophobicContact CG2-CD1 3.69Å; I111-L115 WeakPolarHBondContact O-CB 3.26Å; I111-L115 WeakPolarHBondContact O-CD1 3.3Å; I111-L115 PolarHBondContact O-N 3.4Å; K112-L115 PolarHBondContact O-N 3.03Å; I113-L115 VanDerWaalsContact C-N 3.29Å; I113-L115 PolarHBondContact O-N 3.44Å; L115-I118 PolarHBondContact O-N 2.81Å; L115-F119 WeakPolarHBondContact O-CB 3.41Å; L115-F119 PolarHBondContact O-N 2.78Å
116E79.4Confident74.7Confident104 Ų104109.4 Ų109.449%0.48652%0.52SS..Hα-helixtrans-64.2-41.4175.5-75-179.3-177.500111.3K112 I113 F119 T120K112-E116 WeakPolarHBondContact CE-OE1 3.42Å; K112-E116 IonicContact NZ-OE1 3.96Å; K112-E116 WeakPolarHBondContact O-CG 3.4Å; K112-E116 PolarHBondContact O-N 2.83Å; I113-E116 PolarHBondContact O-N 3.22Å; E116-F119 PolarHBondContact O-N 3.3Å; E116-T120 WeakPolarHBondContact O-CB 3.31Å; E116-T120 VanDerWaalsContact O-CG2 3.27Å; E116-T120 WeakPolarHBondContact O-CG2 3.24Å; E116-T120 PolarHBondContact O-N 2.99Å; E116-T120 PolarHBondContact O-OG1 2.85Å
117D77.2Confident75.8Confident105 Ų105103.7 Ų103.756%0.56151%0.507SS*.Hα-helixtrans-63.9-41.3174.5-81.2-10000112.3I113 T120 L121I113-D117 PolarHBondContact O-N 2.83Å; D117-T120 WeakPolarHBondContact CA-OG1 3.45Å; D117-T120 PolarHBondContact O-OG1 3.48Å; D117-L121 VanDerWaalsContact O-CB 3.29Å; D117-L121 WeakPolarHBondContact O-CB 3.4Å; D117-L121 PolarHBondContact O-N 2.82Å
118I79.6Confident77.1Confident103 Ų103103.8 Ų103.853%0.52851%0.511SS..Hα-helixtrans-65.3-42.2175.5-69.9165000110.8V114 L115 L121 W122V114-I118 HydrophobicContact CG1-CD1 3.84Å; V114-I118 WeakPolarHBondContact O-CD1 3.18Å; V114-I118 WeakPolarHBondContact O-CG1 3.35Å; V114-I118 PolarHBondContact O-N 3.26Å; L115-I118 PolarHBondContact O-N 2.81Å; I118-L121 PolarHBondContact O-N 2.85Å; I118-W122 WeakPolarHBondContact O-CB 3.45Å; I118-W122 PolarHBondContact O-N 3.48Å
119F78.7Confident78.3Confident125 Ų125100.7 Ų100.755%0.54850%0.502SS..Hα-helixtrans-66.9-41-179.5-170.9-100.6000112L115 E116 W122 R123L115-F119 WeakPolarHBondContact O-CB 3.41Å; L115-F119 PolarHBondContact O-N 2.78Å; E116-F119 PolarHBondContact O-N 3.3Å; F119-W122 HydrophobicContact CE2-CE3 4.41Å; F119-W122 PolarHBondContact O-N 2.78Å; F119-R123 HydrophobicContact CE1-CG 4.49Å; F119-R123 WeakPolarHBondContact O-CB 3.36Å; F119-R123 PolarHBondContact O-N 3.36Å
120T84.8Confident79Confident73 Ų73102.8 Ų102.845%0.44851%0.506SS..Hα-helixtrans-65.7-43.1175.654.50000111.5E116 D117 W122 R123 Q124E116-T120 WeakPolarHBondContact O-CB 3.31Å; E116-T120 VanDerWaalsContact O-CG2 3.27Å; E116-T120 WeakPolarHBondContact O-CG2 3.24Å; E116-T120 PolarHBondContact O-N 2.99Å; E116-T120 PolarHBondContact O-OG1 2.85Å; D117-T120 WeakPolarHBondContact CA-OG1 3.45Å; D117-T120 PolarHBondContact O-OG1 3.48Å; T120-W122 VanDerWaalsContact C-N 3.34Å; T120-W122 PolarHBondContact O-N 2.9Å; T120-R123 WeakPolarHBondContact O-CB 3.4Å; T120-R123 PolarHBondContact O-N 2.89Å; T120-Q124 WeakPolarHBondContact O-CG 3.28Å; T120-Q124 PolarHBondContact O-N 3.15Å
121L80.9Confident79.7Confident113 Ų113103.4 Ų103.459%0.59251%0.507SS*.Hα-helixtrans-61-42.9175-16378.5000111.5D117 I118 Q124 V125D117-L121 VanDerWaalsContact O-CB 3.29Å; D117-L121 WeakPolarHBondContact O-CB 3.4Å; D117-L121 PolarHBondContact O-N 2.82Å; I118-L121 PolarHBondContact O-N 2.85Å; L121-Q124 PolarHBondContact O-N 3.32Å; L121-V125 WeakPolarHBondContact O-CG2 3.19Å; L121-V125 PolarHBondContact O-N 3.4Å
122W82.9Confident80.2Confident158 Ų158107 Ų10760%0.59852%0.519SS*.Hα-helixtrans-62.2-45.1176.7-172.670000111.9I118 F119 T120 Q124 V125 E126I118-W122 WeakPolarHBondContact O-CB 3.45Å; I118-W122 PolarHBondContact O-N 3.48Å; F119-W122 HydrophobicContact CE2-CE3 4.41Å; F119-W122 PolarHBondContact O-N 2.78Å; T120-W122 VanDerWaalsContact C-N 3.34Å; T120-W122 PolarHBondContact O-N 2.9Å; W122-Q124 VanDerWaalsContact C-N 3.33Å; W122-Q124 PolarHBondContact O-N 3.16Å; W122-V125 PolarHBondContact O-N 2.87Å; W122-E126 WeakPolarHBondContact O-CB 3.29Å; W122-E126 PolarHBondContact O-N 2.87Å
123R81.5Confident80.6Confident155 Ų155105.6 Ų105.659%0.58552%0.517SS*.Hα-helixtrans-58.3-40.8173.6-108-110.6-179.3-169.81.8112.7F119 T120 E126 T127F119-R123 HydrophobicContact CE1-CG 4.49Å; F119-R123 WeakPolarHBondContact O-CB 3.36Å; F119-R123 PolarHBondContact O-N 3.36Å; T120-R123 WeakPolarHBondContact O-CB 3.4Å; T120-R123 PolarHBondContact O-N 2.89Å; R123-E126 PolarHBondContact O-N 2.81Å; R123-T127 WeakPolarHBondContact O-CB 3.31Å; R123-T127 VanDerWaalsContact O-CG2 3.29Å; R123-T127 WeakPolarHBondContact O-CG2 3.42Å; R123-T127 PolarHBondContact O-N 3.31Å; R123-T127 PolarHBondContact O-OG1 3.39Å
124Q82.4Confident80.7Confident112 Ų112109.3 Ų109.352%0.52353%0.525SS..Hα-helixtrans-66.2-42.1177.2-74.8-166.1700112.3T120 L121 W122 T127 K128T120-Q124 WeakPolarHBondContact O-CG 3.28Å; T120-Q124 PolarHBondContact O-N 3.15Å; L121-Q124 PolarHBondContact O-N 3.32Å; W122-Q124 VanDerWaalsContact C-N 3.33Å; W122-Q124 PolarHBondContact O-N 3.16Å; Q124-T127 WeakPolarHBondContact CA-OG1 3.43Å; Q124-T127 PolarHBondContact O-OG1 2.84Å; Q124-K128 WeakPolarHBondContact O-CB 3.47Å; Q124-K128 WeakPolarHBondContact O-CG 3.36Å; Q124-K128 PolarHBondContact O-N 3.48Å; Q124-K128 VanDerWaalsContact O-N 3.11Å
125V82.7Confident80.8Confident83 Ų83112.7 Ų112.750%0.50353%0.533SS..Hα-helixtrans-65.7-44.4176.5173.70000110.2L121 W122 T127 K128 V129L121-V125 WeakPolarHBondContact O-CG2 3.19Å; L121-V125 PolarHBondContact O-N 3.4Å; W122-V125 PolarHBondContact O-N 2.87Å; V125-T127 PolarHBondContact O-N 3.03Å; V125-K128 PolarHBondContact O-N 3.42Å; V125-V129 HydrophobicContact CG1-CG2 4.27Å; V125-V129 VanDerWaalsContact O-CG2 3.3Å; V125-V129 WeakPolarHBondContact O-CG2 3.33Å; V125-V129 PolarHBondContact O-N 3.41Å
126E78.8Confident80.8Confident57 Ų57114 Ų11427%0.26654%0.537SS..Hα-helixtrans-61.9-43.7-179.3-163.1-170.7173.600112.1W122 R123 V129 R130W122-E126 WeakPolarHBondContact O-CB 3.29Å; W122-E126 PolarHBondContact O-N 2.87Å; R123-E126 PolarHBondContact O-N 2.81Å; E126-V129 PolarHBondContact O-N 2.84Å; E126-R130 WeakPolarHBondContact O-CB 3.28Å; E126-R130 VanDerWaalsContact O-CG 3.28Å; E126-R130 WeakPolarHBondContact O-CG 3.36Å; E126-R130 PolarHBondContact O-N 3.4Å; E126-R130 IonicContact OE1-CZ 3.2Å; E126-R130 IonicContact OE1-NE 3.05Å; E126-R130 PolarHBondContact OE1-NE 2.96Å; E126-R130 IonicContact OE1-NH2 2.65Å; E126-R130 PolarHBondContact OE1-NH2 3.43Å
127T85.6Confident80.2Confident73 Ų73116.5 Ų116.545%0.44855%0.547SS..Hα-helixtrans-64.4-41.6176.350.30000112.1R123 Q124 V125 R130 A131R123-T127 WeakPolarHBondContact O-CB 3.31Å; R123-T127 VanDerWaalsContact O-CG2 3.29Å; R123-T127 WeakPolarHBondContact O-CG2 3.42Å; R123-T127 PolarHBondContact O-N 3.31Å; R123-T127 PolarHBondContact O-OG1 3.39Å; Q124-T127 WeakPolarHBondContact CA-OG1 3.43Å; Q124-T127 PolarHBondContact O-OG1 2.84Å; V125-T127 PolarHBondContact O-N 3.03Å; T127-R130 PolarHBondContact O-N 2.85Å; T127-A131 WeakPolarHBondContact O-CB 3.49Å; T127-A131 PolarHBondContact O-N 3.48Å
128K86.1Confident79.3Confident147 Ų147115.8 Ų115.864%0.63955%0.546SS*.Hα-helixtrans-62-43.4174.1-76.7179.5179.3175.20112.2Q124 V125 A131 K132Q124-K128 WeakPolarHBondContact O-CB 3.47Å; Q124-K128 WeakPolarHBondContact O-CG 3.36Å; Q124-K128 PolarHBondContact O-N 3.48Å; Q124-K128 VanDerWaalsContact O-N 3.11Å; V125-K128 PolarHBondContact O-N 3.42Å; K128-A131 PolarHBondContact O-N 2.95Å; K128-K132 PolarHBondContact O-N 3.22Å
129V87.1Confident78.2Confident74 Ų74115.3 Ų115.345%0.44855%0.548SS..Hα-helixtrans-65.3-47.1177.3170.70000110.6V125 E126 A131 K132 I133V125-V129 HydrophobicContact CG1-CG2 4.27Å; V125-V129 VanDerWaalsContact O-CG2 3.3Å; V125-V129 WeakPolarHBondContact O-CG2 3.33Å; V125-V129 PolarHBondContact O-N 3.41Å; E126-V129 PolarHBondContact O-N 2.84Å; V129-A131 VanDerWaalsContact C-N 3.31Å; V129-A131 PolarHBondContact O-N 3.36Å; V129-K132 WeakPolarHBondContact O-CB 3.49Å; V129-K132 PolarHBondContact O-N 2.89Å; V129-K132 VanDerWaalsContact O-N 3.15Å; V129-I133 HydrophobicContact CG1-CD1 3.75Å; V129-I133 HydrophobicContact CG1-CG1 4.36Å; V129-I133 WeakPolarHBondContact O-CG1 3.41Å; V129-I133 PolarHBondContact O-N 3.38Å
130R80.8Confident77.2Confident138 Ų138114.4 Ų114.452%0.52155%0.553SS.*Hα-helixtrans-59.7-40.8175.8-74.3176.4-178.7-140.83.2111.8E126 T127 I133 R134E126-R130 WeakPolarHBondContact O-CB 3.28Å; E126-R130 VanDerWaalsContact O-CG 3.28Å; E126-R130 WeakPolarHBondContact O-CG 3.36Å; E126-R130 PolarHBondContact O-N 3.4Å; E126-R130 IonicContact OE1-CZ 3.2Å; E126-R130 IonicContact OE1-NE 3.05Å; E126-R130 PolarHBondContact OE1-NE 2.96Å; E126-R130 IonicContact OE1-NH2 2.65Å; E126-R130 PolarHBondContact OE1-NH2 3.43Å; T127-R130 PolarHBondContact O-N 2.85Å; R130-I133 PolarHBondContact O-N 2.84Å; R130-R134 WeakPolarHBondContact O-CB 3.34Å; R130-R134 VanDerWaalsContact O-CG 3.31Å; R130-R134 WeakPolarHBondContact O-CG 3.14Å; R130-R134 PolarHBondContact O-N 3.04Å
131A83Confident75.8Confident45 Ų45119.7 Ų119.737%0.37257%0.57SS.*Hα-helixtrans-64.3-41.9175.200000111.8T127 K128 V129 R134 K135T127-A131 WeakPolarHBondContact O-CB 3.49Å; T127-A131 PolarHBondContact O-N 3.48Å; K128-A131 PolarHBondContact O-N 2.95Å; V129-A131 VanDerWaalsContact C-N 3.31Å; V129-A131 PolarHBondContact O-N 3.36Å; A131-R134 PolarHBondContact O-N 2.84Å; A131-K135 WeakPolarHBondContact O-CB 3.5Å; A131-K135 WeakPolarHBondContact O-CG 3.35Å; A131-K135 PolarHBondContact O-N 2.93Å
132K82.1Confident74.6Confident163 Ų163119.8 Ų119.871%0.70958%0.575SS**Hα-helixtrans-62.2-44.5173.5-113.2175.9177.3178.30112.2K128 V129 K135 M136K128-K132 PolarHBondContact O-N 3.22Å; V129-K132 WeakPolarHBondContact O-CB 3.49Å; V129-K132 PolarHBondContact O-N 2.89Å; V129-K132 VanDerWaalsContact O-N 3.15Å; K132-K135 PolarHBondContact O-N 3.41Å; K132-M136 WeakPolarHBondContact O-CB 3.33Å; K132-M136 PolarHBondContact O-N 2.78Å
133I81Confident73.1Confident101 Ų101118 Ų11852%0.51858%0.577SS.*Hα-helixtrans-63.1-43.6176.6-68.3167.9000110.7V129 R130 M136 K137V129-I133 HydrophobicContact CG1-CD1 3.75Å; V129-I133 HydrophobicContact CG1-CG1 4.36Å; V129-I133 WeakPolarHBondContact O-CG1 3.41Å; V129-I133 PolarHBondContact O-N 3.38Å; R130-I133 PolarHBondContact O-N 2.84Å; I133-M136 PolarHBondContact O-N 3.19Å; I133-K137 VanDerWaalsContact O-CB 3.24Å; I133-K137 WeakPolarHBondContact O-CB 3.33Å; I133-K137 PolarHBondContact O-N 3.24Å
134R76.3Confident71.9Confident177 Ų177122.1 Ų122.167%0.66859%0.592SS**Hα-helixtrans-63-45.2176.1-75.2177-177.5-174.8-0.3111.5R130 A131 K137 V138R130-R134 WeakPolarHBondContact O-CB 3.34Å; R130-R134 VanDerWaalsContact O-CG 3.31Å; R130-R134 WeakPolarHBondContact O-CG 3.14Å; R130-R134 PolarHBondContact O-N 3.04Å; A131-R134 PolarHBondContact O-N 2.84Å; R134-K137 PolarHBondContact O-N 2.93Å; R134-V138 WeakPolarHBondContact O-CB 3.49Å; R134-V138 VanDerWaalsContact O-CG2 3.24Å; R134-V138 WeakPolarHBondContact O-CG2 3.33Å; R134-V138 PolarHBondContact O-N 3.47Å
135K74.6Confident70.7Confident154 Ų154124 Ų12467%0.6760%0.601SS**Hα-helixtrans-59.7-48.4174.9-76.2-179.6177.9-1720111.2A131 K132 K137 V138 T139A131-K135 WeakPolarHBondContact O-CB 3.5Å; A131-K135 WeakPolarHBondContact O-CG 3.35Å; A131-K135 PolarHBondContact O-N 2.93Å; K132-K135 PolarHBondContact O-N 3.41Å; K135-K137 VanDerWaalsContact C-N 3.35Å; K135-K137 PolarHBondContact O-N 3.46Å; K135-V138 PolarHBondContact O-N 3.17Å; K135-T139 WeakPolarHBondContact O-CG2 3.41Å; K135-T139 PolarHBondContact O-N 2.72Å; K135-T139 PolarHBondContact O-OG1 3.44Å
136M71.3Confident69.3Low133 Ų133126 Ų12666%0.65561%0.609SS**Hα-helixtrans-60.3-43.8176.7-164.8129.589.200111.6K132 I133 V138 T139 T140K132-M136 WeakPolarHBondContact O-CB 3.33Å; K132-M136 PolarHBondContact O-N 2.78Å; I133-M136 PolarHBondContact O-N 3.19Å; M136-V138 PolarHBondContact O-N 2.89Å; M136-T139 VanDerWaalsContact CA-OG1 3.29Å; M136-T139 WeakPolarHBondContact CA-OG1 3.48Å; M136-T139 PolarHBondContact O-N 2.65Å; M136-T139 PolarHBondContact O-OG1 2.92Å; M136-T140 WeakPolarHBondContact O-CB 3.27Å; M136-T140 PolarHBondContact O-N 3.25Å; M136-T140 PolarHBondContact O-OG1 3.4Å
137K66.1Low68.2Low157 Ų157131.1 Ų131.168%0.68363%0.63SS**Hα-helixtrans-64.6-38.3176.7-170.4176-176.9178.10112.4I133 R134 K135 K141I133-K137 VanDerWaalsContact O-CB 3.24Å; I133-K137 WeakPolarHBondContact O-CB 3.33Å; I133-K137 PolarHBondContact O-N 3.24Å; R134-K137 PolarHBondContact O-N 2.93Å; K135-K137 VanDerWaalsContact C-N 3.35Å; K135-K137 PolarHBondContact O-N 3.46Å; K137-K141 WeakPolarHBondContact O-CB 3.38Å; K137-K141 PolarHBondContact O-N 3.4Å
138V59.9Low66.9Low91 Ų91135 Ų13555%0.55265%0.646SS**Hα-helixtrans-68.5-44.2175.71690000110.7R134 K135 M136 T140 K141 V142R134-V138 WeakPolarHBondContact O-CB 3.49Å; R134-V138 VanDerWaalsContact O-CG2 3.24Å; R134-V138 WeakPolarHBondContact O-CG2 3.33Å; R134-V138 PolarHBondContact O-N 3.47Å; K135-V138 PolarHBondContact O-N 3.17Å; M136-V138 PolarHBondContact O-N 2.89Å; V138-T140 VanDerWaalsContact C-N 3.32Å; V138-T140 PolarHBondContact O-N 3.02Å; V138-K141 WeakPolarHBondContact O-CA 3.46Å; V138-K141 WeakPolarHBondContact O-CB 3.48Å; V138-K141 PolarHBondContact O-N 2.89Å; V138-V142 WeakPolarHBondContact O-CG2 3.45Å; V138-V142 PolarHBondContact O-N 3.4Å
139T56.4Low65.4Low93 Ų93134.2 Ų134.257%0.57165%0.649SS**Hα-helixtrans-65.8-34.8175.152.40000112K135 M136 K141 V142K135-T139 WeakPolarHBondContact O-CG2 3.41Å; K135-T139 PolarHBondContact O-N 2.72Å; K135-T139 PolarHBondContact O-OG1 3.44Å; M136-T139 VanDerWaalsContact CA-OG1 3.29Å; M136-T139 WeakPolarHBondContact CA-OG1 3.48Å; M136-T139 PolarHBondContact O-N 2.65Å; M136-T139 PolarHBondContact O-OG1 2.92Å; T139-K141 VanDerWaalsContact C-N 3.28Å; T139-K141 PolarHBondContact O-N 3.46Å; T139-V142 PolarHBondContact O-N 3.05Å
140T57Low63.6Low105 Ų105134.3 Ų134.364%0.64467%0.665SS**Hα-helixtrans-69.3-26.8171.4-55.10000112M136 V138M136-T140 WeakPolarHBondContact O-CB 3.27Å; M136-T140 PolarHBondContact O-N 3.25Å; M136-T140 PolarHBondContact O-OG1 3.4Å; V138-T140 VanDerWaalsContact C-N 3.32Å; V138-T140 PolarHBondContact O-N 3.02Å
141K54.6Low62.5Low185 Ų185137 Ų13780%0.80468%0.681SS**Hα-helixtrans-77.5-20.2177.5-133.9-172.8178.9-166.90113.5K137 V138 T139K137-K141 WeakPolarHBondContact O-CB 3.38Å; K137-K141 PolarHBondContact O-N 3.4Å; V138-K141 WeakPolarHBondContact O-CA 3.46Å; V138-K141 WeakPolarHBondContact O-CB 3.48Å; V138-K141 PolarHBondContact O-N 2.89Å; T139-K141 VanDerWaalsContact C-N 3.28Å; T139-K141 PolarHBondContact O-N 3.46Å
142V55.6Low61.4Low115 Ų115146.3 Ų146.370%0.69771%0.706SS**SBendtrans-96.2-2.7-173.6172.60000114V138 T139V138-V142 WeakPolarHBondContact O-CG2 3.45Å; V138-V142 PolarHBondContact O-N 3.4Å; T139-V142 PolarHBondContact O-N 3.05Å
143N52.8Low60.3Low119 Ų119143.9 Ų143.964%0.63670%0.696SS**  trans-127.360.9179.1-128.71.1000113.8
144R55.9Low59.6Low242 Ų242143.1 Ų143.191%0.91370%0.696SS**  trans-118.960.4156.5-90.7-171.7-179.6170.60.6109
145H57.2Low59.4Low152 Ų152138.4 Ų138.470%0.70470%0.695SS**  trans-136.133.5159.4-141.7-45.7000112K147H145-K147 VanDerWaalsContact C-N 3.28Å; H145-K147 PolarHBondContact O-N 3.26Å
146D53.9Low59.4Low126 Ų126138.8 Ų138.867%0.67470%0.697SS**  trans-64.6101.2155.9-67.7-25.6000106I148D146-I148 PolarHBondContact O-N 3.44Å
147K55.8Low59.6Low163 Ų163137.6 Ų137.671%0.70969%0.689SS**  trans-55.296.8160-78176176.2176.50104.7H145 N149H145-K147 VanDerWaalsContact C-N 3.28Å; H145-K147 PolarHBondContact O-N 3.26Å; K147-N149 PolarHBondContact O-N 2.85Å
148I57.7Low60.1Low154 Ų154134.8 Ų134.879%0.7968%0.679SS**  trans-64.484.7166.2-62.8172.6000103.6D146 G150D146-I148 PolarHBondContact O-N 3.44Å; I148-G150 PolarHBondContact O-N 3Å
149N54.5Low61.3Low131 Ų131134.7 Ų134.770%0.70167%0.672SS**  trans-51115.6165.2-71.2-15000104.2K147 K151K147-N149 PolarHBondContact O-N 2.85Å; N149-K151 PolarHBondContact O-N 3.5Å
150G49.6Very low62.7Low76 Ų76135.9 Ų135.978%0.78467%0.673SS**  trans-5784.1-167.200000111.7I148 R152I148-G150 PolarHBondContact O-N 3Å; G150-R152 PolarHBondContact O-N 3.26Å; G150-R152 VanDerWaalsContact O-N 3.11Å
151K57.1Low64.1Low194 Ų194136.2 Ų136.284%0.84367%0.666SS**  trans-71.1105.6163.7-74.4-171.2177.4-1770104.9N149 K153N149-K151 PolarHBondContact O-N 3.5Å; K151-K153 PolarHBondContact O-N 3.43Å
152R60.5Low65.6Low241 Ų241133.6 Ų133.691%0.90966%0.656SS**PPolyproline II helixtrans-46.5119.3166-94.1179173165.3-2.2106.9G150 T154G150-R152 PolarHBondContact O-N 3.26Å; G150-R152 VanDerWaalsContact O-N 3.11Å; R152-T154 PolarHBondContact O-N 3.11Å
153K58.8Low67.1Low113 Ų113135.5 Ų135.549%0.49165%0.651SS.*PPolyproline II helixtrans-52.2129.5168.8-68179.7178.7-178.30107K151 Q158K151-K153 PolarHBondContact O-N 3.43Å; K153-Q158 HydrophobicContact CB-CG 3.54Å; K153-Q158 HydrophobicContact CD-CG 3.85Å; K153-Q158 HydrophobicContact CG-CG 4.34Å
154T66.6Low68.9Low85 Ų85132.5 Ų132.552%0.52164%0.643SS.*PPolyproline II helixtrans-61.1147.4171.9570000108.2R152 K156 E157 Q158R152-T154 PolarHBondContact O-N 3.11Å; T154-K156 PolarHBondContact O-N 2.97Å; T154-E157 PolarHBondContact O-N 3.01Å; T154-Q158 PolarHBondContact O-N 3.02Å
155A71.4Confident70.5Confident78 Ų78125.1 Ų125.165%0.64562%0.619SS**Hα-helixtrans-52.1-34.3-176.900000112.5Q158 E159A155-Q158 PolarHBondContact O-N 2.91Å; A155-E159 WeakPolarHBondContact O-CB 3.49Å; A155-E159 PolarHBondContact O-N 2.88Å
156K74.8Confident72Confident162 Ų162120 Ų12070%0.70460%0.603SS**Hα-helixtrans-63.9-40.8176.3-67.7-177.2177.1178.70113.6T154 E159 M160T154-K156 PolarHBondContact O-N 2.97Å; K156-E159 PolarHBondContact O-N 2.87Å; K156-M160 WeakPolarHBondContact O-CG 3.48Å; K156-M160 PolarHBondContact O-N 2.86Å
157E75.4Confident73.7Confident107 Ų107119.2 Ų119.250%0.560%0.598SS.*Hα-helixtrans-70.6-36.6178.7-76.3-177156.800112.5T154 M160 F161T154-E157 PolarHBondContact O-N 3.01Å; E157-M160 HydrophobicContact CG-CE 4.19Å; E157-F161 WeakPolarHBondContact O-CB 3.29Å; E157-F161 PolarHBondContact O-N 2.97Å
158Q77.8Confident75.2Confident99 Ų99119.8 Ų119.846%0.46360%0.595SS.*Hα-helixtrans-65.3-42.4173.6-69.6-171.3-30.500111.2K153 T154 A155 F161 Q162K153-Q158 HydrophobicContact CB-CG 3.54Å; K153-Q158 HydrophobicContact CD-CG 3.85Å; K153-Q158 HydrophobicContact CG-CG 4.34Å; T154-Q158 PolarHBondContact O-N 3.02Å; A155-Q158 PolarHBondContact O-N 2.91Å; Q158-F161 PolarHBondContact O-N 3.18Å; Q158-Q162 WeakPolarHBondContact O-CG 3.34Å; Q158-Q162 PolarHBondContact O-N 2.99Å
159E84Confident76.5Confident88 Ų88120.4 Ų120.441%0.41159%0.588SS.*Hα-helixtrans-63.8-44.9177.5-168.7-175.217400111.9A155 K156 F161 Q162 R163A155-E159 WeakPolarHBondContact O-CB 3.49Å; A155-E159 PolarHBondContact O-N 2.88Å; K156-E159 PolarHBondContact O-N 2.87Å; E159-F161 VanDerWaalsContact C-N 3.31Å; E159-F161 PolarHBondContact O-N 3.14Å; E159-Q162 PolarHBondContact O-N 3.35Å; E159-R163 WeakPolarHBondContact O-CB 3.47Å; E159-R163 WeakPolarHBondContact O-CG 3.45Å; E159-R163 PolarHBondContact O-N 2.64Å; E159-R163 IonicContact OE1-CZ 3.25Å; E159-R163 VanDerWaalsContact OE1-CZ 3.25Å; E159-R163 IonicContact OE1-NE 3.25Å; E159-R163 PolarHBondContact OE1-NE 3.22Å; E159-R163 IonicContact OE1-NH2 2.65Å; E159-R163 PolarHBondContact OE1-NH2 3.29Å
160M85.4Confident78Confident119 Ų119122.7 Ų122.759%0.58659%0.587SS**Hα-helixtrans-60.9-40.4175-73.9-171.5-67.800112K156 E157 R163 A164K156-M160 WeakPolarHBondContact O-CG 3.48Å; K156-M160 PolarHBondContact O-N 2.86Å; E157-M160 HydrophobicContact CG-CE 4.19Å; M160-R163 PolarHBondContact O-N 3.43Å; M160-A164 WeakPolarHBondContact O-CB 3.47Å; M160-A164 PolarHBondContact O-N 2.92Å
161F86.3Confident79.5Confident112 Ų112122 Ų12249%0.49157%0.573SS.*Hα-helixtrans-65.8-41.7176.6-174-106000112.3E157 Q158 E159 A164 Q165E157-F161 WeakPolarHBondContact O-CB 3.29Å; E157-F161 PolarHBondContact O-N 2.97Å; Q158-F161 PolarHBondContact O-N 3.18Å; E159-F161 VanDerWaalsContact C-N 3.31Å; E159-F161 PolarHBondContact O-N 3.14Å; F161-A164 PolarHBondContact O-N 3.4Å; F161-Q165 HydrophobicContact CE1-CG 4.44Å; F161-Q165 VanDerWaalsContact CZ-NE2 3.3Å; F161-Q165 WeakPolarHBondContact O-CG 3.35Å; F161-Q165 PolarHBondContact O-N 3.41Å
162Q87.2Confident80.6Confident129 Ų129117.5 Ų117.560%0.60356%0.555SS**Hα-helixtrans-64.4-42.8174.5-73.6-179.5600111.9Q158 E159 A164 Q165 A166Q158-Q162 WeakPolarHBondContact O-CG 3.34Å; Q158-Q162 PolarHBondContact O-N 2.99Å; E159-Q162 PolarHBondContact O-N 3.35Å; Q162-A164 PolarHBondContact O-N 2.95Å; Q162-Q165 PolarHBondContact O-N 2.99Å; Q162-A166 WeakPolarHBondContact O-CB 3.33Å; Q162-A166 PolarHBondContact O-N 3.38Å
163R87.5Confident81.7Confident155 Ų155110.6 Ų110.659%0.58554%0.537SS*.Hα-helixtrans-62-42.2175.1-73.5178.4-177.2-160.21.8111.8E159 M160 Q165 A166 L167E159-R163 WeakPolarHBondContact O-CB 3.47Å; E159-R163 WeakPolarHBondContact O-CG 3.45Å; E159-R163 PolarHBondContact O-N 2.64Å; E159-R163 IonicContact OE1-CZ 3.25Å; E159-R163 VanDerWaalsContact OE1-CZ 3.25Å; E159-R163 IonicContact OE1-NE 3.25Å; E159-R163 PolarHBondContact OE1-NE 3.22Å; E159-R163 IonicContact OE1-NH2 2.65Å; E159-R163 PolarHBondContact OE1-NH2 3.29Å; M160-R163 PolarHBondContact O-N 3.43Å; R163-Q165 VanDerWaalsContact C-N 3.34Å; R163-Q165 PolarHBondContact O-N 3.03Å; R163-A166 PolarHBondContact O-N 2.9Å; R163-L167 WeakPolarHBondContact O-CG 3.31Å; R163-L167 PolarHBondContact O-N 3.1Å
164A89.9Confident82.5Confident57 Ų57112.4 Ų112.447%0.47154%0.541SS..Hα-helixtrans-62.3-40.8175.500000112M160 F161 Q162 L167 R168M160-A164 WeakPolarHBondContact O-CB 3.47Å; M160-A164 PolarHBondContact O-N 2.92Å; F161-A164 PolarHBondContact O-N 3.4Å; Q162-A164 PolarHBondContact O-N 2.95Å; A164-L167 PolarHBondContact O-N 3.43Å; A164-R168 PolarHBondContact O-N 3.01Å
165Q90.3Very high82.6Confident87 Ų87116.2 Ų116.241%0.40755%0.547SS..Hα-helixtrans-65.2-40.6173.6-74.1-171.1-0.800112.6F161 Q162 R163 R168 R169F161-Q165 HydrophobicContact CE1-CG 4.44Å; F161-Q165 VanDerWaalsContact CZ-NE2 3.3Å; F161-Q165 WeakPolarHBondContact O-CG 3.35Å; F161-Q165 PolarHBondContact O-N 3.41Å; Q162-Q165 PolarHBondContact O-N 2.99Å; R163-Q165 VanDerWaalsContact C-N 3.34Å; R163-Q165 PolarHBondContact O-N 3.03Å; Q165-R168 WeakPolarHBondContact O-CB 3.5Å; Q165-R168 PolarHBondContact O-N 2.95Å; Q165-R169 PolarHBondContact O-N 3.21Å
166A88.1Confident82.4Confident45 Ų45121 Ų12137%0.37255%0.549SS..Hα-helixtrans-64.8-40.8177.400000112.1Q162 R163 R168 R169 R170Q162-A166 WeakPolarHBondContact O-CB 3.33Å; Q162-A166 PolarHBondContact O-N 3.38Å; R163-A166 PolarHBondContact O-N 2.9Å; A166-R168 VanDerWaalsContact C-N 3.32Å; A166-R168 PolarHBondContact O-N 3.28Å; A166-R169 PolarHBondContact O-N 3.35Å; A166-R170 WeakPolarHBondContact O-CG 3.18Å; A166-R170 PolarHBondContact O-N 2.98Å
167L89.7Confident82.1Confident109 Ų109118.2 Ų118.257%0.57155%0.548SS*.Hα-helixtrans-62.3-40.7173.9-74.1171.2000111.8R163 A164 R170 A171R163-L167 WeakPolarHBondContact O-CG 3.31Å; R163-L167 PolarHBondContact O-N 3.1Å; A164-L167 PolarHBondContact O-N 3.43Å; L167-R170 PolarHBondContact O-N 2.88Å; L167-A171 PolarHBondContact O-N 3.04Å
168R86.9Confident81.6Confident174 Ų174120 Ų12066%0.65755%0.554SS**Hα-helixtrans-62.2-45.2176.5-171.2176.8174.1167.13.5112A164 Q165 A166 A171 E172A164-R168 PolarHBondContact O-N 3.01Å; Q165-R168 WeakPolarHBondContact O-CB 3.5Å; Q165-R168 PolarHBondContact O-N 2.95Å; A166-R168 VanDerWaalsContact C-N 3.32Å; A166-R168 PolarHBondContact O-N 3.28Å; R168-A171 PolarHBondContact O-N 2.89Å; R168-E172 IonicContact NE-OE1 3.45Å; R168-E172 PolarHBondContact NE-OE1 2.97Å; R168-E172 WeakPolarHBondContact O-CG 3.43Å; R168-E172 PolarHBondContact O-N 2.96Å
169R85.7Confident80.7Confident167 Ų167117.9 Ų117.963%0.6355%0.546SS*.Hα-helixtrans-60.9-44.4174.9-71.4-176.8-178.1173.21.4111.9Q165 A166 A171 E172 D173Q165-R169 PolarHBondContact O-N 3.21Å; A166-R169 PolarHBondContact O-N 3.35Å; R169-A171 VanDerWaalsContact C-N 3.31Å; R169-A171 PolarHBondContact O-N 3.3Å; R169-E172 PolarHBondContact O-N 3.3Å; R169-D173 WeakPolarHBondContact O-CB 3.5Å; R169-D173 VanDerWaalsContact O-CG 3.25Å; R169-D173 PolarHBondContact O-N 2.91Å
170R84.9Confident79.4Confident180 Ų180118.1 Ų118.168%0.67955%0.553SS**Hα-helixtrans-60.9-37.9176-75-179.8-176.9164.81.1113.1A166 L167 D173 Y174A166-R170 WeakPolarHBondContact O-CG 3.18Å; A166-R170 PolarHBondContact O-N 2.98Å; L167-R170 PolarHBondContact O-N 2.88Å; R170-D173 PolarHBondContact O-N 3.03Å; R170-Y174 WeakPolarHBondContact O-CB 3.26Å; R170-Y174 PolarHBondContact O-N 3.46Å
171A82.1Confident78.1Confident60 Ų60117.3 Ų117.350%0.49656%0.557SS.*Hα-helixtrans-67.7-40.7176.100000111.7L167 R168 R169 Y174 Y175L167-A171 PolarHBondContact O-N 3.04Å; R168-A171 PolarHBondContact O-N 2.89Å; R169-A171 VanDerWaalsContact C-N 3.31Å; R169-A171 PolarHBondContact O-N 3.3Å; A171-Y174 PolarHBondContact O-N 3.48Å; A171-Y175 PolarHBondContact O-N 3.4Å
172E80.3Confident76.6Confident101 Ų101117.8 Ų117.847%0.47257%0.574SS.*Hα-helixtrans-64.2-41.1174.4-72.2172.3-165.300111.6R168 R169 Y175 R176R168-E172 IonicContact NE-OE1 3.45Å; R168-E172 PolarHBondContact NE-OE1 2.97Å; R168-E172 WeakPolarHBondContact O-CG 3.43Å; R168-E172 PolarHBondContact O-N 2.96Å; R169-E172 PolarHBondContact O-N 3.3Å; E172-Y175 PolarHBondContact O-N 3.41Å; E172-R176 VanDerWaalsContact O-CG 3.26Å; E172-R176 WeakPolarHBondContact O-CG 3.33Å; E172-R176 PolarHBondContact O-N 3.42Å
173D82.3Confident75.1Confident96 Ų96114.6 Ų114.651%0.51357%0.57SS.*Hα-helixtrans-66.4-43.1175.9-68.8-26.2000111.8R169 R170 Y175 R176 C177R169-D173 WeakPolarHBondContact O-CB 3.5Å; R169-D173 VanDerWaalsContact O-CG 3.25Å; R169-D173 PolarHBondContact O-N 2.91Å; R170-D173 PolarHBondContact O-N 3.03Å; D173-Y175 VanDerWaalsContact C-N 3.28Å; D173-Y175 PolarHBondContact O-N 2.88Å; D173-R176 WeakPolarHBondContact O-CB 3.29Å; D173-R176 PolarHBondContact O-N 3.39Å; D173-R176 VanDerWaalsContact O-N 3.16Å; D173-C177 WeakPolarHBondContact O-CB 3.24Å; D173-C177 PolarHBondContact O-N 3.31Å; D173-C177 PolarHBondContact O-SG 3.45Å
174Y75.2Confident73.7Confident150 Ų150113.7 Ų113.759%0.58857%0.566SS**Hα-helixtrans-57.1-43.3173.3175.7-99.9000111.5R170 A171 C177 K178R170-Y174 WeakPolarHBondContact O-CB 3.26Å; R170-Y174 PolarHBondContact O-N 3.46Å; A171-Y174 PolarHBondContact O-N 3.48Å; Y174-C177 PolarHBondContact O-N 3.45Å; Y174-K178 HydrophobicContact CD1-CG 4.43Å; Y174-K178 HydrophobicContact CE1-CG 4.09Å; Y174-K178 HydrophobicContact CE2-CG 4.32Å; Y174-K178 VanDerWaalsContact CZ-CE 3.41Å; Y174-K178 WeakPolarHBondContact O-CG 3.2Å; Y174-K178 PolarHBondContact O-N 2.96Å; Y174-K178 WeakPolarHBondContact OH-CE 3.44Å
175Y70.6Confident71.9Confident165 Ų165119.7 Ų119.765%0.64758%0.582SS**Hα-helixtrans-65.9-41.4176.1-166.6-100.7000111.9A171 E172 D173 C177 K178 I179A171-Y175 PolarHBondContact O-N 3.4Å; E172-Y175 PolarHBondContact O-N 3.41Å; D173-Y175 VanDerWaalsContact C-N 3.28Å; D173-Y175 PolarHBondContact O-N 2.88Å; Y175-C177 VanDerWaalsContact C-N 3.3Å; Y175-C177 PolarHBondContact O-N 2.92Å; Y175-K178 PolarHBondContact O-N 3.3Å; Y175-I179 HydrophobicContact CD1-CD1 3.84Å; Y175-I179 HydrophobicContact CE1-CD1 3.7Å; Y175-I179 HydrophobicContact CE1-CG1 4.37Å; Y175-I179 WeakPolarHBondContact O-CG1 3.44Å; Y175-I179 PolarHBondContact O-N 2.97Å
176R66.8Low69.9Low180 Ų180120.4 Ų120.468%0.67959%0.594SS**Hα-helixtrans-61.3-34.9174.5-72.9-111.4-173.6-179.22113.3E172 D173 R184E172-R176 VanDerWaalsContact O-CG 3.26Å; E172-R176 WeakPolarHBondContact O-CG 3.33Å; E172-R176 PolarHBondContact O-N 3.42Å; D173-R176 WeakPolarHBondContact O-CB 3.29Å; D173-R176 PolarHBondContact O-N 3.39Å; D173-R176 VanDerWaalsContact O-N 3.16Å; R176-R184 PolarHBondContact O-NH2 2.88Å
177C68.3Low68Low103 Ų103126.8 Ų126.870%0.69662%0.621SS**Hα-helixtrans-79.6-26.3178.4-69.40000113.2D173 Y174 Y175D173-C177 WeakPolarHBondContact O-CB 3.24Å; D173-C177 PolarHBondContact O-N 3.31Å; D173-C177 PolarHBondContact O-SG 3.45Å; Y174-C177 PolarHBondContact O-N 3.45Å; Y175-C177 VanDerWaalsContact C-N 3.3Å; Y175-C177 PolarHBondContact O-N 2.92Å
178K64.7Low65.9Low143 Ų143127 Ų12762%0.62263%0.631SS**Hα-helixtrans-77.9-18.8174.6-78.1-77.5-170.7176.20113.9Y174 Y175Y174-K178 HydrophobicContact CD1-CG 4.43Å; Y174-K178 HydrophobicContact CE1-CG 4.09Å; Y174-K178 HydrophobicContact CE2-CG 4.32Å; Y174-K178 VanDerWaalsContact CZ-CE 3.41Å; Y174-K178 WeakPolarHBondContact O-CG 3.2Å; Y174-K178 PolarHBondContact O-N 2.96Å; Y174-K178 WeakPolarHBondContact OH-CE 3.44Å; Y175-K178 PolarHBondContact O-N 3.3Å
179I58.9Low63.8Low56 Ų56124.9 Ų124.929%0.28763%0.632SS.*SBendtrans-78.8120.6173.8-62.8163.7000108.9Y175 A183 R184Y175-I179 HydrophobicContact CD1-CD1 3.84Å; Y175-I179 HydrophobicContact CE1-CD1 3.7Å; Y175-I179 HydrophobicContact CE1-CG1 4.37Å; Y175-I179 WeakPolarHBondContact O-CG1 3.44Å; Y175-I179 PolarHBondContact O-N 2.97Å; I179-A183 HydrophobicContact CG2-CB 3.9Å; I179-R184 HydrophobicContact CG2-CG 4.08Å
180T57.5Low61.6Low93 Ų93127.9 Ų127.957%0.57164%0.643SS**  trans-54.3139.4173.231.70000110.9S182 A183 R184T180-S182 PolarHBondContact O-N 3.45Å; T180-A183 PolarHBondContact O-N 3.45Å; T180-R184 PolarHBondContact O-N 3.29Å
181P57.1Low59.1Low101 Ų101121.9 Ų121.966%0.65663%0.629SS**G310 helixtrans-52.8-33.5-179.4-2733.9000113.7A183 R184P181-A183 VanDerWaalsContact C-N 3.34Å; P181-A183 PolarHBondContact O-N 3.33Å; P181-R184 WeakPolarHBondContact O-CB 3.29Å; P181-R184 PolarHBondContact O-N 2.87Å
182S55.1Low57.1Low122 Ų122124 Ų12485%0.85364%0.635SS**G310 helixtrans-68.2-25.1177175.80000114.3T180T180-S182 PolarHBondContact O-N 3.45Å
183A54.8Low55.1Low62 Ų62128.4 Ų128.451%0.51265%0.649SS.*G310 helixtrans-88.5-5.3174.900000113I179 T180 P181 K185I179-A183 HydrophobicContact CG2-CB 3.9Å; T180-A183 PolarHBondContact O-N 3.45Å; P181-A183 VanDerWaalsContact C-N 3.34Å; P181-A183 PolarHBondContact O-N 3.33Å; A183-K185 PolarHBondContact O-N 3.25Å
184R58.5Low53Low136 Ų136129.9 Ų129.951%0.51366%0.657SS.*  trans-75.878.6169.2-60.1178.9-176.6172.8-2.2108.2R176 I179 T180 P181 P186R176-R184 PolarHBondContact O-NH2 2.88Å; I179-R184 HydrophobicContact CG2-CG 4.08Å; T180-R184 PolarHBondContact O-N 3.29Å; P181-R184 WeakPolarHBondContact O-CB 3.29Å; P181-R184 PolarHBondContact O-N 2.87Å; R184-P186 VanDerWaalsContact O-CD 3.29Å; R184-P186 WeakPolarHBondContact O-CD 3.49Å; R184-P186 VanDerWaalsContact O-N 3.11Å
185K52.9Low51.4Low183 Ų183130.1 Ų130.180%0.79667%0.668SS**  trans-53.4120.6160.7-76.7-175.6177.2-177.60106.9A183 L187A183-K185 PolarHBondContact O-N 3.25Å; K185-L187 PolarHBondContact O-N 2.9Å; K185-L187 VanDerWaalsContact O-N 3.08Å
186P48.2Very low50Low103 Ų103127.7 Ų127.767%0.66967%0.67SS**  trans-66.2115.8166.828-28.9000105.2R184 C188R184-P186 VanDerWaalsContact O-CD 3.29Å; R184-P186 WeakPolarHBondContact O-CD 3.49Å; R184-P186 VanDerWaalsContact O-N 3.11Å; P186-C188 HydrophobicContact CB-CB 4.07Å; P186-C188 PolarHBondContact O-N 3.31Å
187L48.3Very low48.8Very low179 Ų179125 Ų12594%0.93767%0.668SS**  trans-70.159155.8-74.1167.7000107.6K185K185-L187 PolarHBondContact O-N 2.9Å; K185-L187 VanDerWaalsContact O-N 3.08Å
188C45Very low47.4Very low114 Ų114126.4 Ų126.477%0.7768%0.676SS**  trans-101.871.9164.8-75.40000106.5P186P186-C188 HydrophobicContact CB-CB 4.07Å; P186-C188 PolarHBondContact O-N 3.31Å
189N42Very low46.5Very low128 Ų128123.5 Ų123.568%0.68469%0.686SS**  trans-133.6109130.4-152.6-9.1000106.6C191N189-C191 PolarHBondContact ND2-SG 3.03Å; N189-C191 PolarHBondContact O-N 2.91Å
190R40.5Very low45.7Very low230 Ų230125 Ų12587%0.86870%0.702SS**  trans-69.166161.5-172.5179.5-177.5-174.8-0.1106.3T192R190-T192 VanDerWaalsContact C-N 3.29Å; R190-T192 PolarHBondContact O-N 3.02Å
191C31.9Very low45Very low55 Ų55129.2 Ų129.237%0.37272%0.715SS.*  trans-71.896.3162.8-73.90000105.6N189 Y193N189-C191 PolarHBondContact ND2-SG 3.03Å; N189-C191 PolarHBondContact O-N 2.91Å; C191-Y193 HydrophobicContact CB-CD2 3.85Å; C191-Y193 HydrophobicContact CB-CE2 3.43Å; C191-Y193 VanDerWaalsContact CB-CE2 3.43Å; C191-Y193 PolarHBondContact O-N 3.42Å
192T40.3Very low44.3Very low103 Ų103131.4 Ų131.463%0.63272%0.715SS**  trans-59.786.9154.943.50000107.4R190 N194R190-T192 VanDerWaalsContact C-N 3.29Å; R190-T192 PolarHBondContact O-N 3.02Å; T192-N194 PolarHBondContact O-N 3.31Å
193Y37.2Very low43.7Very low194 Ų194134.1 Ų134.176%0.76171%0.711SS**  trans-70.193157.3-65.6-75.2000105.6C191 L195C191-Y193 HydrophobicContact CB-CD2 3.85Å; C191-Y193 HydrophobicContact CB-CE2 3.43Å; C191-Y193 VanDerWaalsContact CB-CE2 3.43Å; C191-Y193 PolarHBondContact O-N 3.42Å; Y193-L195 PolarHBondContact O-N 3.31Å
194N39.3Very low42.7Very low128 Ų128140.1 Ų140.168%0.68472%0.722SS**  trans-58.597161.4-71.7-45.7000106.4T192 V196T192-N194 PolarHBondContact O-N 3.31Å; N194-V196 HydrophobicContact CB-CG2 4.41Å; N194-V196 PolarHBondContact O-N 2.81Å
195L41.5Very low41.7Very low155 Ų155143.5 Ų143.581%0.81274%0.736SS**  trans-65.388158.4-106.3122.8000106Y193 L197Y193-L195 PolarHBondContact O-N 3.31Å; L195-L197 VanDerWaalsContact C-N 3.26Å; L195-L197 PolarHBondContact O-N 3.02Å
196V40.4Very low40.9Very low114 Ų114140.5 Ų140.569%0.69174%0.738SS**  trans-66.296.5161.3178.40000105.3N194N194-V196 HydrophobicContact CB-CG2 4.41Å; N194-V196 PolarHBondContact O-N 2.81Å
197L41.8Very low40.4Very low124 Ų124144.6 Ų144.665%0.64975%0.748SS**  trans-59130.2159.9-80.9157.6000107L195 G199L195-L197 VanDerWaalsContact C-N 3.26Å; L195-L197 PolarHBondContact O-N 3.02Å; L197-G199 PolarHBondContact O-N 3.46Å
198P39.1Very low40.1Very low131 Ų131144.3 Ų144.385%0.85177%0.771SS**THydrogen-bonded Turntrans-67.5109.2175.628.3-30.2000107.4
199G47.2Very low39.9Very low82 Ų82145.8 Ų145.885%0.84577%0.771SS**THydrogen-bonded Turntrans126.717.2170.400000118.3L197L197-G199 PolarHBondContact O-N 3.46Å
200S41.3Very low39.8Very low89 Ų89146.7 Ų146.762%0.62278%0.776SS**  trans-111.498.6168.965.50000111.3K202S200-K202 PolarHBondContact O-N 2.87Å
201E43.5Very low39.8Very low181 Ų181142.1 Ų142.185%0.84677%0.77SS**  trans-52.4127.4167.7-74.1-176.4147.500110.6K203E201-K203 PolarHBondContact O-N 2.92Å
202K42.3Very low40.2Very low147 Ų147147.2 Ų147.264%0.63979%0.794SS**  trans-86.8105172.7-65.4-174.5-179-178.20108.6S200 Y204S200-K202 PolarHBondContact O-N 2.87Å; K202-Y204 HydrophobicContact CB-CD2 4.41Å; K202-Y204 HydrophobicContact CB-CE2 3.9Å; K202-Y204 PolarHBondContact O-N 3.07Å
203K41.1Very low40.2Very low178 Ų178150 Ų15077%0.77480%0.804SS**  trans-77.4114.4161.5-70.6-169.5178.8-174.80108.3E201E201-K203 PolarHBondContact O-N 2.92Å
204Y34.9Very low40.4Very low188 Ų188147.1 Ų147.174%0.73781%0.807SS**  trans-86.1121.9170.8-68.1-88.1000108.6K202K202-Y204 HydrophobicContact CB-CD2 4.41Å; K202-Y204 HydrophobicContact CB-CE2 3.9Å; K202-Y204 PolarHBondContact O-N 3.07Å
205Y37.3Very low40.5Very low207 Ų207148.4 Ų148.481%0.81282%0.816SS**  trans-101.6115.7157.6-84-84.5000107.4
206S34.9Very low40.4Very low120 Ų120147.9 Ų147.984%0.83982%0.816SS**  trans-83.6122.2167.1-66.40000108.2
207H38.8Very low40.4Very low190 Ų190150.8 Ų150.888%0.8883%0.826SS**  trans-89.9119.2162.7-86.8-84.1000108.1
208A42.9Very low40.3Very low172 Ų172153.2 Ų153.2100%1.42184%0.842SS**  trans-103.60155.100000107.7

Retrieved 208 of 208 residues in 178.1 ms (Link to these results)