A0A087WRM8_MOUSE Loading...

RAB11 binding and LisH domain, coiled-coil and HEAT repeat containing

AlphaFold DB , UniProt , Accession A0A087WRM8, Species MOUSE (Mus musculus, Mouse), Gene Relch, Length 354 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
1M43.6Very low41.9Very low249 Ų249117.8 Ų117.8100%1.22787%0.865SS**  01500-79.3165.1159.800108.2
2A41.5Very low42.7Very low104 Ų104115.3 Ų115.386%0.8687%0.868SS**  trans-67.9166.7-177.800000112.3
3A41.4Very low43.2Very low85 Ų85115.5 Ų115.570%0.70287%0.865SS**  cis-154.3146.8-4.800000111.2
4M40.4Very low43.4Very low189 Ų189112.3 Ų112.393%0.93186%0.855SS**  trans30.2140.3133.8-64.5161.780.100123.1
5A43.8Very low43.9Very low95 Ų95113.8 Ų113.879%0.78585%0.853SS**  trans-71.6-171.7165.700000112.4
6P54.3Low44Very low128 Ų128116.3 Ų116.383%0.83185%0.851SS**  cis-121.1-167.2-1.831.9-8.7000112.6
7G39.6Very low44.9Very low75 Ų75117 Ų11777%0.77385%0.85SS**  cis129123.3-7.300000114.1
8G36.1Very low44.9Very low87 Ų87121.3 Ų121.390%0.89785%0.85SS**  trans95149.3-170.700000112.7
9G38.8Very low45.3Very low83 Ų83123.5 Ų123.586%0.85685%0.85SS**  cis152.7126.5-5.300000111.8
10G38.8Very low45.2Very low76 Ų76123.5 Ų123.578%0.78485%0.851SS**  trans111154.3161.200000118.5
11S42.2Very low45.3Very low125 Ų125124.5 Ų124.587%0.87485%0.847SS**  trans64.6100.4163.5-58.90000119.1
12G52.2Low45.6Very low87 Ų87117 Ų11790%0.89782%0.819SS**  trans-67.4138.5150.400000110
13S48.9Very low45.8Very low118 Ų118119.9 Ų119.983%0.82582%0.82SS**  trans-116.6128.2172.8-160.10000108.6
14G45.5Very low46.1Very low71 Ų71124.2 Ų124.273%0.73283%0.826SS**  trans-72.5135.5-176.400000111.6
15V50.8Low46.5Very low135 Ų135123.3 Ų123.382%0.81883%0.825SS**  trans-81.6119.9173.5-73.50000110.3
16N46Very low46.8Very low154 Ų154126.7 Ų126.782%0.82483%0.83SS**  trans-97.2113.3165.6-78.2-35.1000108.1F18N16-F18 PolarHBondContact O-N 2.79Å
17P59.5Low46.6Very low128 Ų128128.3 Ų128.383%0.83183%0.831SS**  trans-91.717.7-164.236.8-38.4000115.2
18F45.3Very low47Very low194 Ų194133.5 Ų133.585%0.85184%0.835SS**  trans-12933.1-168.7-152.6-99.5000114.8N16N16-F18 PolarHBondContact O-N 2.79Å
19L51.7Low47.3Very low163 Ų163135.9 Ų135.985%0.85383%0.833SS**  trans-142.587.1174.6-72.6177.6000111.9
20S44.7Very low47Very low124 Ų124136.5 Ų136.587%0.86783%0.83SS**  trans156.9141.9163-71.90000106.5
21D46.4Very low46.9Very low144 Ų144137.2 Ų137.277%0.7783%0.828SS**  cis-149.5177.40.1-161.1-7.4000108.5
22S48.8Very low46.6Very low91 Ų91138.4 Ų138.464%0.63683%0.83SS**  trans-41.5150.3163.9-39.20000114.8
23D45.9Very low45.9Very low165 Ų165141.4 Ų141.488%0.88282%0.821SS**  -164157.1118.5-98.6-27.9000111.1
24E48.5Very low45.4Very low176 Ų176143.9 Ų143.982%0.82283%0.825SS**  trans-89.7142.2-175.5-60.5164.212300111.2
25D48.4Very low45Very low171 Ų171150.2 Ų150.291%0.91483%0.827SS**  trans-139.298.6160-88-48.5000108.7
26D49.6Very low44.2Very low165 Ų165155.4 Ų155.488%0.88283%0.831SS**  trans-74.8127.8161.2-95-48.1000108.5
27D50.8Low43.6Very low163 Ų163152.8 Ų152.887%0.87283%0.832SS**  trans-139.7122161.9-127.6-29.8000112.3
28E47.8Very low42.3Very low183 Ų183149.9 Ų149.986%0.85582%0.824SS**  trans-96.9113.9-167.8179.1-162.5167.300110.6
29V42Very low41.7Very low138 Ų138148.7 Ų148.784%0.83683%0.826SS**  trans-135.392.8167.1-76.10000114.7
30A34.1Very low41Very low96 Ų96152.2 Ų152.279%0.79383%0.828SS**  trans39.3119.8136.600000120.5
31A35.2Very low40.5Very low91 Ų91154.8 Ų154.875%0.75283%0.831SS**  trans-64.6153.5168.900000114.6
32T35.9Very low39.8Very low150 Ų150151.3 Ų151.392%0.9283%0.829SS**  trans-113.3101.5150.945.80000109.5
33E39.3Very low39.3Very low150 Ų150152.4 Ų152.470%0.70184%0.844SS**  trans-100.5101.4-175.6-174.4-170.1168.500109.8
34D37Very low38.8Very low170 Ų170147.6 Ų147.691%0.90983%0.833SS**  trans-90.7109.5177.6-136.2-22.8000111.5
35R37.3Very low38.2Very low203 Ų203146.4 Ų146.477%0.76684%0.838SS**  trans-80.7130.9-173.9-75.1175.2154.5112.7-2.6112
36R34.5Very low37.6Very low244 Ų244141 Ų14192%0.92182%0.822SS**  -149.6135.7128.9-145.2162.8176.787.8-0.6115
37A32.7Very low37.2Very low100 Ų100141.6 Ų141.683%0.82682%0.824SS**  trans-63.8162.1176.200000112.8
38G31.9Very low36.5Very low66 Ų66140.8 Ų140.868%0.6882%0.82SS**  cis139.4160.42.500000111.5
39L33.2Very low36.6Very low169 Ų169137.7 Ų137.789%0.88582%0.816SS**  trans170.397.5170.5-96.5153.8000105.4
40R36.8Very low36.1Very low237 Ų237134.6 Ų134.689%0.89481%0.812SS**  51130.472.8-83-154.5175.2-133.9-1.6116.2
41L34.9Very low36.1Very low179 Ų179136.2 Ų136.294%0.93782%0.817SS**  trans97.7124.3178.1-58.6167.7000113.7
42G32.1Very low36.1Very low70 Ų70136.9 Ų136.972%0.72282%0.823SS**  cis166.8156.8-7.800000112.7
43A37Very low35.8Very low114 Ų114133.6 Ų133.694%0.94282%0.819SS**  trans63.7148.4178.300000116.4
44G35.1Very low35.7Very low65 Ų65131.9 Ų131.967%0.6782%0.824SS**  cis149157.91.500000110.3
45V37.4Very low35.4Very low151 Ų151131.4 Ų131.492%0.91582%0.82SS**  trans75.9123.4-170.7-168.10000113
46G34.7Very low35.4Very low57 Ų57127.2 Ų127.259%0.58882%0.822SS**  cis118.1137.5-3.100000113.4
47L40.8Very low35.8Very low177 Ų177121.1 Ų121.193%0.92781%0.814SS**  trans76.2143.3-177.7-44.6173.6000115.1
48D36.1Very low35.9Very low147 Ų147124.9 Ų124.979%0.78682%0.815SS**  cis-166.2149.6-26.9-168.348.5000107.1
49P50.7Low36.2Very low117 Ų117129.4 Ų129.476%0.7682%0.823SS**  trans-100.8125-173.134.4-26.4000114.9
50G32.4Very low36.8Very low73 Ų73126.9 Ų126.975%0.75382%0.817SS**  trans111.6128.2146.400000118.3
51S33.6Very low36.6Very low130 Ų130124.4 Ų124.491%0.90982%0.818SS**  trans-165.1147.5130.3-102.70000114.8
52A34Very low36.5Very low105 Ų105120.1 Ų120.187%0.86881%0.808SS**  trans-25141174.200000120
53G31.3Very low36.6Very low82 Ų82125.1 Ų125.185%0.84582%0.817SS**  trans-160.291.9161.300000110.3
54S36.1Very low36.3Very low114 Ų114123 Ų12380%0.79781%0.807SS**  trans-86.2177.9-176.2-165.70000112.6
55L31.9Very low36.1Very low159 Ų159125.8 Ų125.883%0.83282%0.816SS**  trans94.480.6164-47.6-178.3000118.9
56S36.8Very low35.9Very low115 Ų115124.1 Ų124.180%0.80481%0.811SS**  -85.5168.7123.1-67.20000108.6
57P43.1Very low35.8Very low117 Ų117126 Ų12676%0.7682%0.822SS**  cis-125.91722.441.9-29.3000113.5
58Q34.5Very low35.6Very low178 Ų178129 Ų12983%0.83282%0.821SS**  trans-162122.5142.8-74.8-146.4-3.200113.2
59D37.2Very low35.8Very low162 Ų162128.1 Ų128.187%0.86682%0.823SS**  trans-98.7151.2137.8-85.3-46.7000107.5
60P46.2Very low34.8Very low115 Ų115125.7 Ų125.775%0.74782%0.819SS**  -144.4168.9128.932.9-15.7000116.1
61M32.8Very low34.8Very low185 Ų185130.7 Ų130.791%0.91183%0.827SS**  trans-70164.3-168.3-70-165.9-6900118.3
62A33.5Very low34.6Very low89 Ų89128.2 Ų128.274%0.73682%0.815SS**  trans-32.6160.1157.900000118.8
63L33Very low34.6Very low175 Ų175129.5 Ų129.592%0.91681%0.812SS**  153.4137102.4-151.3143.9000113.6
64G30.2Very low34.6Very low71 Ų71133.5 Ų133.573%0.73281%0.808SS**  trans97.3151.4164.200000116.8
65S31.8Very low34.3Very low122 Ų122134.7 Ų134.785%0.85380%0.803SS**  cis-164-175.70-163.20000112.1
66S33.5Very low34.4Very low116 Ų116132.1 Ų132.181%0.81180%0.798SS**  trans77.4134.2179.9-71.90000117.4
67A32.8Very low34.1Very low98 Ų98131.4 Ų131.481%0.8180%0.799SS**  cis-156.3158.7-9.300000111.9
68R37.2Very low33.6Very low240 Ų240130.2 Ų130.291%0.90680%0.8SS**  trans-98.8167.5167.4-103.6-176.8173.6-165.1-1.1109.1
69P39.3Very low34.2Very low127 Ų127127.7 Ų127.783%0.82580%0.799SS**  cis-153.3167.839.541.4-20.2000120.2
70G29.2Very low34.2Very low66 Ų66124.4 Ų124.468%0.6879%0.794SS**  107.5114.8128.400000121.6
71L33.7Very low33.9Very low178 Ų178123.6 Ų123.693%0.93280%0.797SS**  trans53.7150.9137.8-55.2170.8000120.8
72A29Very low34.8Very low78 Ų78121 Ų12165%0.64579%0.794SS**  cis-174.5168.3-22.600000109.6
73V33.5Very low34.8Very low133 Ų133120.8 Ų120.881%0.80680%0.8SS**  trans80.1127.2146.2158.60000121.2
74E30.4Very low34.9Very low166 Ų166116.1 Ų116.178%0.77679%0.794SS**  trans64.2167.7154.3-63.8-85.4107.900119.9
75M31.2Very low35.5Very low138 Ų138119.2 Ų119.268%0.6880%0.804SS**  cis-178.6123-38.7171.362.712200108.6
76S33.1Very low35.7Very low106 Ų106116.3 Ų116.374%0.74179%0.794SS**  trans60.8152.1158.5-67.20000123.6
77A30.3Very low36.3Very low99 Ų99120.5 Ų120.582%0.81880%0.801SS**  trans85.5113.5148.200000121.7
78A33.7Very low36.8Very low93 Ų93121.2 Ų121.277%0.76980%0.795SS**  trans-85.4168.2146.900000110
79P46Very low37.3Very low125 Ų125115.5 Ų115.581%0.81279%0.789SS**  -154.3169.987.138.9-19.6000117.9
80A37.9Very low38Very low93 Ų93113.2 Ų113.277%0.76978%0.781SS**  trans60.1113.915800000119.4
81A38.9Very low39.5Very low97 Ų97121.9 Ų121.980%0.80279%0.793SS**  80.1156.464.100000114.5
82P51.6Low41.5Very low132 Ų132119.5 Ų119.586%0.85778%0.781SS**  cis-129.2-177.9-17.240.4-24.6000114
83G34Very low44.3Very low84 Ų84119.1 Ų119.187%0.86677%0.773SS**  trans116.6119.9155.300000116.1
84G34.9Very low47Very low77 Ų77116.6 Ų116.679%0.79476%0.755SS**  trans166.659-179.300000113.5G86G84-G86 PolarHBondContact O-N 2.84Å
85S42.9Very low49.8Very low135 Ų135111.5 Ų111.594%0.94473%0.733SS**  trans-66.4112.6177.6-43.60000110.6
86G36.4Very low52.7Low61 Ų61106.9 Ų106.963%0.62972%0.716SS**  trans-146.393.1175.500000110.3G84 T88G84-G86 PolarHBondContact O-N 2.84Å; G86-T88 PolarHBondContact O-N 2.82Å
87E45.9Very low55.5Low205 Ų205104.9 Ų104.996%0.95870%0.697SS**  trans-72.975.2179.2-69.3178.5125.200111.3
88T44Very low58.5Low112 Ų112100.2 Ų100.269%0.68766%0.658SS**SBendtrans-76.9144.7139.459.20000107.4G86 A90G86-T88 PolarHBondContact O-N 2.82Å; T88-A90 PolarHBondContact O-N 2.74Å
89P48.2Very low61.2Low120 Ų12096.4 Ų96.478%0.77963%0.626SS**  trans-56.4116.2176.224.4-33.3000107.6R91P89-R91 PolarHBondContact O-N 2.82Å
90A53.2Low63.5Low80 Ų8094.1 Ų94.166%0.66161%0.605SS**  trans-58.3106.8-167.200000109T88 L92T88-A90 PolarHBondContact O-N 2.74Å; A90-L92 VanDerWaalsContact C-N 3.3Å; A90-L92 PolarHBondContact O-N 2.87Å
91R59.7Low66.1Low248 Ų24890.9 Ų90.994%0.93657%0.574SS**  trans-62.799.2173.6-79.2-171.6166.5-173.4-4.9106.6P89 S93P89-R91 PolarHBondContact O-N 2.82Å; R91-S93 PolarHBondContact O-N 3.04Å; R91-S93 VanDerWaalsContact O-N 3.12Å
92L77.3Confident68.6Low127 Ų12787.2 Ų87.267%0.66554%0.541SS*.  trans-53120.5-178.4-63.1177000107.6A90 I97A90-L92 VanDerWaalsContact C-N 3.3Å; A90-L92 PolarHBondContact O-N 2.87Å; L92-I97 HydrophobicContact CB-CD1 4.03Å; L92-I97 HydrophobicContact CB-CG1 4.08Å
93S86.8Confident70.6Confident70 Ų7088.8 Ų88.849%0.4953%0.53SS..  trans-6814317962.90000108.9R91 D95 A96 I97R91-S93 PolarHBondContact O-N 3.04Å; R91-S93 VanDerWaalsContact O-N 3.12Å; S93-D95 PolarHBondContact O-N 2.98Å; S93-A96 WeakPolarHBondContact O-CA 3.37Å; S93-A96 WeakPolarHBondContact O-CB 3.41Å; S93-A96 PolarHBondContact O-N 3Å; S93-A96 VanDerWaalsContact OG-CB 3.28Å; S93-A96 WeakPolarHBondContact OG-CB 3.39Å; S93-A96 PolarHBondContact OG-N 3.26Å; S93-I97 PolarHBondContact O-N 2.93Å
94I89.6Confident73.4Confident81 Ų8188.4 Ų88.442%0.41551%0.508SS..Hα-helixtrans-64.9-27.5-175.9-62.7151000110.7I97 A98 L113 L117 L124I94-I97 PolarHBondContact O-N 3.41Å; I94-A98 WeakPolarHBondContact O-CB 3.37Å; I94-A98 PolarHBondContact O-N 3.19Å; I94-L113 HydrophobicContact CG2-CD1 4.13Å; I94-L113 HydrophobicContact CG2-CD2 4.39Å; I94-L117 HydrophobicContact CG2-CD1 3.99Å; I94-L117 HydrophobicContact CG2-CD2 4.27Å; I94-L124 HydrophobicContact CG2-CD1 3.99Å
95D90.3Very high76.1Confident59 Ų5989.2 Ų89.232%0.31649%0.492SS..Hα-helixtrans-67.2-35.4168-175.964.9000113.4S93 A99 L124 R126S93-D95 PolarHBondContact O-N 2.98Å; D95-A99 WeakPolarHBondContact O-CB 3.46Å; D95-A99 PolarHBondContact O-N 2.85Å; D95-L124 HydrophobicContact CB-CD2 4.11Å; D95-R126 IonicContact OD1-CZ 3.91Å; D95-R126 IonicContact OD1-NE 3.35Å; D95-R126 PolarHBondContact OD1-NE 3.45Å; D95-R126 IonicContact OD1-NH2 3.73Å; D95-R126 PolarHBondContact OD1-NH2 3.47Å; D95-R126 IonicContact OD2-CZ 2.68Å; D95-R126 IonicContact OD2-NE 3.6Å; D95-R126 IonicContact OD2-NH2 2.78Å; D95-R126 PolarHBondContact OD2-NH2 2.69Å
96A92.2Very high78.4Confident41 Ų4189.4 Ų89.434%0.33947%0.472SS..Hα-helixtrans-69.6-36.5175.400000111.8S93 Q100S93-A96 WeakPolarHBondContact O-CA 3.37Å; S93-A96 WeakPolarHBondContact O-CB 3.41Å; S93-A96 PolarHBondContact O-N 3Å; S93-A96 VanDerWaalsContact OG-CB 3.28Å; S93-A96 WeakPolarHBondContact OG-CB 3.39Å; S93-A96 PolarHBondContact OG-N 3.26Å; A96-Q100 WeakPolarHBondContact O-CB 3.47Å; A96-Q100 PolarHBondContact O-N 3.41Å
97I92.1Very high81.1Confident64 Ų6487.7 Ų87.733%0.32845%0.449SS..Hα-helixtrans-64.3-51.7172.1-63.7166000109.7L92 S93 I94 A99 Q100 L101 L113L92-I97 HydrophobicContact CB-CD1 4.03Å; L92-I97 HydrophobicContact CB-CG1 4.08Å; S93-I97 PolarHBondContact O-N 2.93Å; I94-I97 PolarHBondContact O-N 3.41Å; I97-A99 VanDerWaalsContact C-N 3.3Å; I97-A99 PolarHBondContact O-N 3.01Å; I97-Q100 WeakPolarHBondContact O-CA 3.47Å; I97-Q100 WeakPolarHBondContact O-CB 3.28Å; I97-Q100 PolarHBondContact O-N 3.02Å; I97-L101 HydrophobicContact CG2-CD1 3.99Å; I97-L101 HydrophobicContact CG2-CG 4.34Å; I97-L101 WeakPolarHBondContact O-CG 3.3Å; I97-L101 PolarHBondContact O-N 2.8Å; I97-L113 HydrophobicContact CG2-CD2 4.06Å
98A92.1Very high83.3Confident0 Ų084.6 Ų84.60%044%0.438CS..Hα-helixtrans-56.2-42.5175.600000112.7I94 Q100 L101 L102 L113 L124 L127I94-A98 WeakPolarHBondContact O-CB 3.37Å; I94-A98 PolarHBondContact O-N 3.19Å; A98-Q100 VanDerWaalsContact C-N 3.32Å; A98-Q100 PolarHBondContact O-N 2.75Å; A98-L101 PolarHBondContact O-N 3.18Å; A98-L102 WeakPolarHBondContact O-CG 3.5Å; A98-L102 PolarHBondContact O-N 2.8Å; A98-L102 VanDerWaalsContact O-N 3.1Å; A98-L113 HydrophobicContact CB-CD2 4.28Å; A98-L124 HydrophobicContact CB-CD1 3.6Å; A98-L127 HydrophobicContact CB-CD1 3.93Å; A98-L127 HydrophobicContact CB-CD2 3.82Å; A98-L127 HydrophobicContact CB-CG 3.83Å
99A91.8Very high85.8Confident13 Ų1382.4 Ų82.411%0.10742%0.424CS..Hα-helixtrans-64.1-35.2174.600000112.5D95 I97 R103D95-A99 WeakPolarHBondContact O-CB 3.46Å; D95-A99 PolarHBondContact O-N 2.85Å; I97-A99 VanDerWaalsContact C-N 3.3Å; I97-A99 PolarHBondContact O-N 3.01Å; A99-R103 WeakPolarHBondContact O-CB 3.2Å; A99-R103 VanDerWaalsContact O-CG 3.26Å; A99-R103 WeakPolarHBondContact O-CG 3.46Å; A99-R103 PolarHBondContact O-N 2.96Å; A99-R103 VanDerWaalsContact O-N 3.11Å
100Q93.4Very high87.9Confident77 Ų7776.7 Ų76.736%0.3639%0.387SS..Hα-helixtrans-70.3-47.2175.5-168.86318.800111.8A96 I97 A98 L102 R103 D104A96-Q100 WeakPolarHBondContact O-CB 3.47Å; A96-Q100 PolarHBondContact O-N 3.41Å; I97-Q100 WeakPolarHBondContact O-CA 3.47Å; I97-Q100 WeakPolarHBondContact O-CB 3.28Å; I97-Q100 PolarHBondContact O-N 3.02Å; A98-Q100 VanDerWaalsContact C-N 3.32Å; A98-Q100 PolarHBondContact O-N 2.75Å; Q100-L102 VanDerWaalsContact C-N 3.31Å; Q100-L102 PolarHBondContact O-N 3.18Å; Q100-R103 WeakPolarHBondContact O-CB 3.48Å; Q100-R103 PolarHBondContact O-N 3.07Å; Q100-R103 VanDerWaalsContact O-N 3.08Å; Q100-D104 PolarHBondContact NE2-OD1 3.47Å; Q100-D104 PolarHBondContact NE2-OD2 3.43Å; Q100-D104 WeakPolarHBondContact O-CB 3.44Å; Q100-D104 PolarHBondContact O-N 3.48Å
101L93.9Very high89.9Confident25 Ų2576.3 Ų76.313%0.13137%0.374CS..Hα-helixtrans-60.2-40.1179.8-63.7171.5000112I97 A98 Q105 Y106 T109 A110 L113I97-L101 HydrophobicContact CG2-CD1 3.99Å; I97-L101 HydrophobicContact CG2-CG 4.34Å; I97-L101 WeakPolarHBondContact O-CG 3.3Å; I97-L101 PolarHBondContact O-N 2.8Å; A98-L101 PolarHBondContact O-N 3.18Å; L101-Q105 PolarHBondContact O-N 3.03Å; L101-Q105 VanDerWaalsContact O-N 3.15Å; L101-Y106 HydrophobicContact CD2-CD2 4.19Å; L101-Y106 HydrophobicContact CD2-CG 4.37Å; L101-Y106 PolarHBondContact O-N 3.46Å; L101-T109 HydrophobicContact CD1-CG2 4.06Å; L101-T109 HydrophobicContact CD2-CG2 3.9Å; L101-A110 HydrophobicContact CB-CB 3.87Å; L101-A110 HydrophobicContact CD1-CB 4.45Å; L101-L113 HydrophobicContact CD1-CD2 3.9Å
102L91.4Very high91.6Very high20 Ų2070.4 Ų70.411%0.10536%0.357CS..Hα-helixtrans-70-35.8174.1-66.6-178.4000113A98 Q100 Q105 L107 A110 R126 L127 Y130A98-L102 WeakPolarHBondContact O-CG 3.5Å; A98-L102 PolarHBondContact O-N 2.8Å; A98-L102 VanDerWaalsContact O-N 3.1Å; Q100-L102 VanDerWaalsContact C-N 3.31Å; Q100-L102 PolarHBondContact O-N 3.18Å; L102-Q105 PolarHBondContact O-NE2 2.89Å; L102-L107 HydrophobicContact CD2-CD2 4.11Å; L102-A110 HydrophobicContact CD2-CB 3.97Å; L102-R126 HydrophobicContact CD1-CG 3.85Å; L102-L127 HydrophobicContact CD1-CD2 4.16Å; L102-L127 HydrophobicContact CD2-CD2 4.41Å; L102-L127 HydrophobicContact CG-CD2 4.21Å; L102-Y130 HydrophobicContact CD1-CD2 3.94Å; L102-Y130 HydrophobicContact CD1-CG 3.91Å; L102-Y130 HydrophobicContact CD2-CD1 3.52Å; L102-Y130 HydrophobicContact CD2-CD2 3.96Å; L102-Y130 HydrophobicContact CD2-CE1 3.73Å; L102-Y130 HydrophobicContact CD2-CE2 4.13Å; L102-Y130 HydrophobicContact CD2-CG 3.65Å; L102-Y130 HydrophobicContact CG-CD2 4.46Å; L102-Y130 HydrophobicContact CG-CG 4.42Å
103R92Very high92.4Very high166 Ų16665.6 Ų65.663%0.62633%0.332SS*.Hα-helixtrans-65.1-44.8174.7-82.7-171.9-63.6-127.11.7112.1A99 Q100 Q105A99-R103 WeakPolarHBondContact O-CB 3.2Å; A99-R103 VanDerWaalsContact O-CG 3.26Å; A99-R103 WeakPolarHBondContact O-CG 3.46Å; A99-R103 PolarHBondContact O-N 2.96Å; A99-R103 VanDerWaalsContact O-N 3.11Å; Q100-R103 WeakPolarHBondContact O-CB 3.48Å; Q100-R103 PolarHBondContact O-N 3.07Å; Q100-R103 VanDerWaalsContact O-N 3.08Å; R103-Q105 PolarHBondContact O-N 2.78Å
104D93.1Very high92.6Very high76 Ų7663.1 Ų63.141%0.40631%0.312SS..THydrogen-bonded Turntrans-85.92.7-174.8-61.9-5.4000112.7Q100 Y106Q100-D104 PolarHBondContact NE2-OD1 3.47Å; Q100-D104 PolarHBondContact NE2-OD2 3.43Å; Q100-D104 WeakPolarHBondContact O-CB 3.44Å; Q100-D104 PolarHBondContact O-N 3.48Å; D104-Y106 VanDerWaalsContact C-N 3.27Å; D104-Y106 HydrophobicContact CB-CD2 3.51Å; D104-Y106 HydrophobicContact CB-CE2 3.5Å; D104-Y106 PolarHBondContact O-N 2.88Å
105Q90.9Very high92.8Very high94 Ų9462.1 Ų62.144%0.43931%0.31SS..THydrogen-bonded Turntrans62.824.9179.3-52.9-73.6-100.200114.6L101 L102 R103 L107L101-Q105 PolarHBondContact O-N 3.03Å; L101-Q105 VanDerWaalsContact O-N 3.15Å; L102-Q105 PolarHBondContact O-NE2 2.89Å; R103-Q105 PolarHBondContact O-N 2.78Å; Q105-L107 PolarHBondContact O-N 3.06Å
106Y92.6Very high93Very high138 Ų13865.3 Ų65.354%0.54132%0.323SS..  trans-75.760.7168.5-64.5-62.6000110.9L101 D104 L108 T109 A110L101-Y106 HydrophobicContact CD2-CD2 4.19Å; L101-Y106 HydrophobicContact CD2-CG 4.37Å; L101-Y106 PolarHBondContact O-N 3.46Å; D104-Y106 VanDerWaalsContact C-N 3.27Å; D104-Y106 HydrophobicContact CB-CD2 3.51Å; D104-Y106 HydrophobicContact CB-CE2 3.5Å; D104-Y106 PolarHBondContact O-N 2.88Å; Y106-L108 VanDerWaalsContact C-N 3.3Å; Y106-L108 PolarHBondContact O-N 3.15Å; Y106-T109 PolarHBondContact O-N 3.47Å; Y106-A110 WeakPolarHBondContact O-CB 3.21Å; Y106-A110 PolarHBondContact O-N 3.16Å
107L92.4Very high93Very high26 Ų2664.1 Ų64.114%0.13631%0.311CS..Hα-helixtrans-62.4-35-172.7-64.9-159.8000113.5L102 Q105 A110 L111 Y130 F137 Q140L102-L107 HydrophobicContact CD2-CD2 4.11Å; Q105-L107 PolarHBondContact O-N 3.06Å; L107-A110 PolarHBondContact O-N 3.09Å; L107-L111 WeakPolarHBondContact O-CB 3.4Å; L107-L111 PolarHBondContact O-N 3.15Å; L107-Y130 HydrophobicContact CD1-CE1 4.29Å; L107-Y130 HydrophobicContact CD2-CE1 3.64Å; L107-F137 HydrophobicContact CD1-CD1 3.97Å; L107-F137 HydrophobicContact CD1-CE1 3.76Å; L107-Q140 VanDerWaalsContact CD1-OE1 3.23Å
108L93.3Very high93Very high140 Ų14065 Ų6573%0.73332%0.316SS*.Hα-helixtrans-66.5-47.1179.1-172.261.1000111Y106 A110 L111 E112Y106-L108 VanDerWaalsContact C-N 3.3Å; Y106-L108 PolarHBondContact O-N 3.15Å; L108-A110 VanDerWaalsContact C-N 3.33Å; L108-A110 PolarHBondContact O-N 3.47Å; L108-L111 WeakPolarHBondContact O-CB 3.34Å; L108-L111 PolarHBondContact O-N 2.81Å; L108-L111 VanDerWaalsContact O-N 3.15Å; L108-E112 WeakPolarHBondContact O-CB 3.5Å; L108-E112 PolarHBondContact O-N 2.95Å
109T94.9Very high93Very high65 Ų6573 Ų7340%0.39935%0.354SS..Hα-helixtrans-66.3-33.6174.5-45.20000112.2L101 Y106 L111 L113L101-T109 HydrophobicContact CD1-CG2 4.06Å; L101-T109 HydrophobicContact CD2-CG2 3.9Å; Y106-T109 PolarHBondContact O-N 3.47Å; T109-L111 VanDerWaalsContact C-N 3.32Å; T109-L113 WeakPolarHBondContact O-CB 3.45Å; T109-L113 PolarHBondContact O-N 3.46Å
110A93.1Very high92.8Very high0 Ų075.7 Ų75.70%037%0.371CS..Hα-helixtrans-67.7-32.717300000112.4L101 L102 Y106 L107 L108 H114 L127 F131L101-A110 HydrophobicContact CB-CB 3.87Å; L101-A110 HydrophobicContact CD1-CB 4.45Å; L102-A110 HydrophobicContact CD2-CB 3.97Å; Y106-A110 WeakPolarHBondContact O-CB 3.21Å; Y106-A110 PolarHBondContact O-N 3.16Å; L107-A110 PolarHBondContact O-N 3.09Å; L108-A110 VanDerWaalsContact C-N 3.33Å; L108-A110 PolarHBondContact O-N 3.47Å; A110-H114 WeakPolarHBondContact O-CB 3.31Å; A110-H114 PolarHBondContact O-N 3.14Å; A110-H114 VanDerWaalsContact O-N 3.1Å; A110-L127 HydrophobicContact CB-CD2 4.15Å; A110-F131 HydrophobicContact CB-CE2 4.24Å; A110-F131 HydrophobicContact CB-CZ 3.96Å; A110-F131 WeakPolarHBondContact O-CE2 3.44Å
111L94.2Very high92.5Very high73 Ų7375.5 Ų75.538%0.38239%0.39SS..Hα-helixtrans-74-44.6176.4-179.762.2000110.9L107 L108 T109 L113 H114 T115 F131L107-L111 WeakPolarHBondContact O-CB 3.4Å; L107-L111 PolarHBondContact O-N 3.15Å; L108-L111 WeakPolarHBondContact O-CB 3.34Å; L108-L111 PolarHBondContact O-N 2.81Å; L108-L111 VanDerWaalsContact O-N 3.15Å; T109-L111 VanDerWaalsContact C-N 3.32Å; L111-L113 PolarHBondContact O-N 3.24Å; L111-H114 CarbonylContact O-C 3.6Å; L111-H114 WeakPolarHBondContact O-CA 3.26Å; L111-H114 VanDerWaalsContact O-CB 3.29Å; L111-H114 WeakPolarHBondContact O-CB 3.48Å; L111-H114 PolarHBondContact O-N 3.21Å; L111-T115 PolarHBondContact O-N 3Å; L111-T115 PolarHBondContact O-OG1 2.71Å; L111-F131 VanDerWaalsContact CA-CZ 3.47Å; L111-F131 HydrophobicContact CB-CE1 3.74Å; L111-F131 HydrophobicContact CB-CE2 4.29Å; L111-F131 HydrophobicContact CB-CZ 3.6Å; L111-F131 HydrophobicContact CD1-CD1 3.82Å; L111-F131 HydrophobicContact CD1-CD2 4.4Å; L111-F131 HydrophobicContact CD1-CE1 3.86Å; L111-F131 HydrophobicContact CD1-CE2 4.4Å; L111-F131 HydrophobicContact CD1-CG 4.16Å; L111-F131 HydrophobicContact CD1-CZ 4.18Å; L111-F131 HydrophobicContact CG-CE1 4.29Å; L111-F131 HydrophobicContact CG-CZ 4.49Å; L111-F131 VanDerWaalsContact N-CZ 3.35Å
112E95.6Very high92.2Very high124 Ų12482.6 Ų82.658%0.57942%0.415SS*.Hα-helixtrans-57.3-46.7174.1-175.6173.3-15400111.4L108 H114 T115 E116L108-E112 WeakPolarHBondContact O-CB 3.5Å; L108-E112 PolarHBondContact O-N 2.95Å; E112-H114 VanDerWaalsContact C-N 3.27Å; E112-H114 PolarHBondContact O-N 2.83Å; E112-T115 WeakPolarHBondContact CA-OG1 3.49Å; E112-T115 PolarHBondContact O-N 3.31Å; E112-T115 PolarHBondContact O-OG1 3.31Å; E112-E116 WeakPolarHBondContact O-CB 3.37Å; E112-E116 PolarHBondContact O-N 2.65Å
113L93.8Very high92.1Very high25 Ų2585.7 Ų85.713%0.13143%0.429CS..Hα-helixtrans-62.4-32.9172.4-179.162.7000112.5I94 I97 A98 L101 T109 L111 L117 L127I94-L113 HydrophobicContact CG2-CD1 4.13Å; I94-L113 HydrophobicContact CG2-CD2 4.39Å; I97-L113 HydrophobicContact CG2-CD2 4.06Å; A98-L113 HydrophobicContact CB-CD2 4.28Å; L101-L113 HydrophobicContact CD1-CD2 3.9Å; T109-L113 WeakPolarHBondContact O-CB 3.45Å; T109-L113 PolarHBondContact O-N 3.46Å; L111-L113 PolarHBondContact O-N 3.24Å; L113-L117 HydrophobicContact CD1-CD1 4.31Å; L113-L117 HydrophobicContact CD1-CG 4.38Å; L113-L117 HydrophobicContact CG-CD1 4.2Å; L113-L117 WeakPolarHBondContact O-CB 3.26Å; L113-L117 WeakPolarHBondContact O-CD1 3.38Å; L113-L117 WeakPolarHBondContact O-CG 3.45Å; L113-L117 PolarHBondContact O-N 3.43Å; L113-L117 VanDerWaalsContact O-N 3.16Å; L113-L127 HydrophobicContact CD2-CD1 4.27Å; L113-L127 HydrophobicContact CG-CD1 4.16Å
114H92.1Very high92Very high19 Ų1979.2 Ų79.29%0.08841%0.407CS..Hα-helixtrans-68.6-43.2175.9-176.520.1000111.5A110 L111 E112 L118 L127 F131A110-H114 WeakPolarHBondContact O-CB 3.31Å; A110-H114 PolarHBondContact O-N 3.14Å; A110-H114 VanDerWaalsContact O-N 3.1Å; L111-H114 CarbonylContact O-C 3.6Å; L111-H114 WeakPolarHBondContact O-CA 3.26Å; L111-H114 VanDerWaalsContact O-CB 3.29Å; L111-H114 WeakPolarHBondContact O-CB 3.48Å; L111-H114 PolarHBondContact O-N 3.21Å; E112-H114 VanDerWaalsContact C-N 3.27Å; E112-H114 PolarHBondContact O-N 2.83Å; H114-L118 WeakPolarHBondContact O-CG 3.31Å; H114-L118 PolarHBondContact O-N 3.11Å; H114-L118 VanDerWaalsContact O-N 3.07Å; H114-L127 HydrophobicContact CB-CB 4.07Å; H114-L127 HydrophobicContact CB-CD1 4.05Å; H114-F131 HydrophobicContact CB-CD2 4.21Å; H114-F131 HydrophobicContact CB-CE2 4.19Å; H114-F131 AromaticContact CD2-CD2 3.57Å
115T94.7Very high91.8Very high60 Ų6078.9 Ų78.937%0.36841%0.409SS..Hα-helixtrans-69.5-43.8178.546.40000112L111 E112 L117 L118 E119L111-T115 PolarHBondContact O-N 3Å; L111-T115 PolarHBondContact O-OG1 2.71Å; E112-T115 WeakPolarHBondContact CA-OG1 3.49Å; E112-T115 PolarHBondContact O-N 3.31Å; E112-T115 PolarHBondContact O-OG1 3.31Å; T115-L117 VanDerWaalsContact C-N 3.27Å; T115-L117 PolarHBondContact O-N 2.82Å; T115-L118 PolarHBondContact O-N 3.33Å; T115-L118 VanDerWaalsContact O-N 3.11Å; T115-E119 WeakPolarHBondContact O-CG 3.47Å; T115-E119 PolarHBondContact O-N 2.84Å
116E94.1Very high91.8Very high125 Ų12579.7 Ų79.758%0.58441%0.408SS*.Hα-helixtrans-57.6-41.9175-173-166.9173.500111.3E112 E119 S120E112-E116 WeakPolarHBondContact O-CB 3.37Å; E112-E116 PolarHBondContact O-N 2.65Å; E116-E119 PolarHBondContact O-N 2.88Å; E116-S120 PolarHBondContact O-N 3.25Å
117L91.8Very high91.7Very high16 Ų1673.1 Ų73.18%0.08438%0.382CS..Hα-helixtrans-63.5-47.3175.3-76.2170.7000111.7I94 L113 T115 E119 S120 G121 R122 L124 L127I94-L117 HydrophobicContact CG2-CD1 3.99Å; I94-L117 HydrophobicContact CG2-CD2 4.27Å; L113-L117 HydrophobicContact CD1-CD1 4.31Å; L113-L117 HydrophobicContact CD1-CG 4.38Å; L113-L117 HydrophobicContact CG-CD1 4.2Å; L113-L117 WeakPolarHBondContact O-CB 3.26Å; L113-L117 WeakPolarHBondContact O-CD1 3.38Å; L113-L117 WeakPolarHBondContact O-CG 3.45Å; L113-L117 PolarHBondContact O-N 3.43Å; L113-L117 VanDerWaalsContact O-N 3.16Å; T115-L117 VanDerWaalsContact C-N 3.27Å; T115-L117 PolarHBondContact O-N 2.82Å; L117-E119 VanDerWaalsContact C-N 3.33Å; L117-E119 PolarHBondContact O-N 3.03Å; L117-S120 CarbonylContact O-C 3.56Å; L117-S120 WeakPolarHBondContact O-CA 3.44Å; L117-S120 WeakPolarHBondContact O-CB 3Å; L117-S120 PolarHBondContact O-N 3.09Å; L117-S120 VanDerWaalsContact O-N 3.07Å; L117-S120 PolarHBondContact O-OG 3.23Å; L117-G121 PolarHBondContact O-N 3.36Å; L117-R122 CarbonylContact C-O 3.49Å; L117-R122 WeakPolarHBondContact CB-O 3.49Å; L117-R122 HydrophobicContact CD2-CB 4.11Å; L117-R122 CarbonylContact O-C 3.52Å; L117-R122 PolarHBondContact O-N 3.31Å; L117-L124 HydrophobicContact CD1-CB 4.34Å; L117-L124 HydrophobicContact CD1-CD1 3.88Å; L117-L124 HydrophobicContact CD1-CG 3.82Å; L117-L127 HydrophobicContact CD1-CD1 4.21Å
118L91.9Very high91.8Very high84 Ų8476.2 Ų76.244%0.4439%0.392SS..Hα-helixtrans-59.5-42178.1-74.4172.5000112H114 T115 S120 G121 R122 E123H114-L118 WeakPolarHBondContact O-CG 3.31Å; H114-L118 PolarHBondContact O-N 3.11Å; H114-L118 VanDerWaalsContact O-N 3.07Å; T115-L118 PolarHBondContact O-N 3.33Å; T115-L118 VanDerWaalsContact O-N 3.11Å; L118-S120 VanDerWaalsContact C-N 3.31Å; L118-S120 PolarHBondContact O-N 2.88Å; L118-G121 PolarHBondContact O-N 3.43Å; L118-R122 PolarHBondContact N-O 3.38Å; L118-E123 HydrophobicContact CD2-CB 4.45Å; L118-E123 HydrophobicContact CD2-CG 4.37Å
119E91.6Very high91.7Very high168 Ų16873.7 Ų73.779%0.78538%0.379SS*.Hα-helixtrans-61.6-37.9173.7-72.1175.1-166.900112.2T115 E116 L117 G121T115-E119 WeakPolarHBondContact O-CG 3.47Å; T115-E119 PolarHBondContact O-N 2.84Å; E116-E119 PolarHBondContact O-N 2.88Å; L117-E119 VanDerWaalsContact C-N 3.33Å; L117-E119 PolarHBondContact O-N 3.03Å; E119-G121 PolarHBondContact O-N 2.88Å
120S88.3Confident91.4Very high69 Ų6972.4 Ų72.448%0.48337%0.367SS..THydrogen-bonded Turntrans-73.40.9172.982.70000114.5E116 L117 L118 R122E116-S120 PolarHBondContact O-N 3.25Å; L117-S120 CarbonylContact O-C 3.56Å; L117-S120 WeakPolarHBondContact O-CA 3.44Å; L117-S120 WeakPolarHBondContact O-CB 3Å; L117-S120 PolarHBondContact O-N 3.09Å; L117-S120 VanDerWaalsContact O-N 3.07Å; L117-S120 PolarHBondContact O-OG 3.23Å; L118-S120 VanDerWaalsContact C-N 3.31Å; L118-S120 PolarHBondContact O-N 2.88Å; S120-R122 VanDerWaalsContact C-N 3.31Å
121G87.6Confident91.3Very high73 Ų7374.1 Ų74.175%0.75338%0.375SS*.THydrogen-bonded Turntrans71.322.4-176.100000114L117 L118 E119L117-G121 PolarHBondContact O-N 3.36Å; L118-G121 PolarHBondContact O-N 3.43Å; E119-G121 PolarHBondContact O-N 2.88Å
122R87.1Confident91.1Very high173 Ų17374.7 Ų74.765%0.65339%0.385SS*.  trans-117.6148-180-61.5-178.8-178.7-136.2-1.4109.6L117 L118 S120L117-R122 CarbonylContact C-O 3.49Å; L117-R122 WeakPolarHBondContact CB-O 3.49Å; L117-R122 HydrophobicContact CD2-CB 4.11Å; L117-R122 CarbonylContact O-C 3.52Å; L117-R122 PolarHBondContact O-N 3.31Å; L118-R122 PolarHBondContact N-O 3.38Å; S120-R122 VanDerWaalsContact C-N 3.31Å
123E89.3Confident90.8Very high85 Ų8572.5 Ų72.540%0.39738%0.377SS..  trans-134.4133.9175.3-171.7177.4-12200110.3L118 R128L118-E123 HydrophobicContact CD2-CB 4.45Å; L118-E123 HydrophobicContact CD2-CG 4.37Å; E123-R128 HydrophobicContact CG-CB 4.18Å; E123-R128 VanDerWaalsContact OE1-CD 3.26Å; E123-R128 WeakPolarHBondContact OE1-CD 3.5Å; E123-R128 WeakPolarHBondContact OE1-CG 3.48Å; E123-R128 WeakPolarHBondContact OE2-CD 3.35Å; E123-R128 IonicContact OE2-CZ 2.65Å; E123-R128 IonicContact OE2-NE 2.98Å; E123-R128 IonicContact OE2-NH1 3.67Å; E123-R128 PolarHBondContact OE2-NH1 2.91Å
124L90.3Very high90.2Very high30 Ų3076 Ų7616%0.15740%0.401CS..  trans-94.2116.4165.8-80.5-175000109.3I94 D95 A98 L117 R126 L127 R128I94-L124 HydrophobicContact CG2-CD1 3.99Å; D95-L124 HydrophobicContact CB-CD2 4.11Å; A98-L124 HydrophobicContact CB-CD1 3.6Å; L117-L124 HydrophobicContact CD1-CB 4.34Å; L117-L124 HydrophobicContact CD1-CD1 3.88Å; L117-L124 HydrophobicContact CD1-CG 3.82Å; L124-R126 PolarHBondContact O-N 3.45Å; L124-R126 VanDerWaalsContact O-N 3.14Å; L124-L127 HydrophobicContact CB-CB 4.4Å; L124-L127 HydrophobicContact CB-CD1 4.26Å; L124-L127 HydrophobicContact CB-CG 4.27Å; L124-L127 HydrophobicContact CD1-CD1 4.04Å; L124-L127 HydrophobicContact CD1-CG 4.44Å; L124-L127 PolarHBondContact O-N 3.39Å; L124-R128 PolarHBondContact O-N 3.01Å; L124-R128 VanDerWaalsContact O-N 3.11Å
125P88.9Confident89.6Confident69 Ų6976 Ų7645%0.44841%0.407SS..Hα-helixtrans-53.4-37.9177.9-27.935.2000112.7L127 R128 D129P125-L127 PolarHBondContact O-N 2.89Å; P125-R128 PolarHBondContact O-N 3.19Å; P125-D129 WeakPolarHBondContact O-CB 3.33Å; P125-D129 PolarHBondContact O-N 3.14Å
126R90.3Very high88.9Confident112 Ų11275.1 Ų75.142%0.42340%0.4SS..Hα-helixtrans-56.5-44.5177.3-175.2-170.6-55.7-77.61.5113.3D95 L102 L124 Y130D95-R126 IonicContact OD1-CZ 3.91Å; D95-R126 IonicContact OD1-NE 3.35Å; D95-R126 PolarHBondContact OD1-NE 3.45Å; D95-R126 IonicContact OD1-NH2 3.73Å; D95-R126 PolarHBondContact OD1-NH2 3.47Å; D95-R126 IonicContact OD2-CZ 2.68Å; D95-R126 IonicContact OD2-NE 3.6Å; D95-R126 IonicContact OD2-NH2 2.78Å; D95-R126 PolarHBondContact OD2-NH2 2.69Å; L102-R126 HydrophobicContact CD1-CG 3.85Å; L124-R126 PolarHBondContact O-N 3.45Å; L124-R126 VanDerWaalsContact O-N 3.14Å; R126-Y130 VanDerWaalsContact O-CB 3.29Å; R126-Y130 WeakPolarHBondContact O-CB 3.25Å; R126-Y130 PolarHBondContact O-N 3.07Å
127L91.4Very high88.3Confident0 Ų073.4 Ų73.40%039%0.391CS..Hα-helixtrans-73.9-48.9-179.9-66.6175.5000109.7A98 L102 A110 L113 H114 L117 L124 P125 D129 Y130 F131A98-L127 HydrophobicContact CB-CD1 3.93Å; A98-L127 HydrophobicContact CB-CD2 3.82Å; A98-L127 HydrophobicContact CB-CG 3.83Å; L102-L127 HydrophobicContact CD1-CD2 4.16Å; L102-L127 HydrophobicContact CD2-CD2 4.41Å; L102-L127 HydrophobicContact CG-CD2 4.21Å; A110-L127 HydrophobicContact CB-CD2 4.15Å; L113-L127 HydrophobicContact CD2-CD1 4.27Å; L113-L127 HydrophobicContact CG-CD1 4.16Å; H114-L127 HydrophobicContact CB-CB 4.07Å; H114-L127 HydrophobicContact CB-CD1 4.05Å; L117-L127 HydrophobicContact CD1-CD1 4.21Å; L124-L127 HydrophobicContact CB-CB 4.4Å; L124-L127 HydrophobicContact CB-CD1 4.26Å; L124-L127 HydrophobicContact CB-CG 4.27Å; L124-L127 HydrophobicContact CD1-CD1 4.04Å; L124-L127 HydrophobicContact CD1-CG 4.44Å; L124-L127 PolarHBondContact O-N 3.39Å; P125-L127 PolarHBondContact O-N 2.89Å; L127-D129 PolarHBondContact O-N 3.45Å; L127-Y130 PolarHBondContact O-N 3.22Å; L127-Y130 VanDerWaalsContact O-N 3.12Å; L127-F131 HydrophobicContact CB-CD2 4.3Å; L127-F131 HydrophobicContact CB-CE2 4.4Å; L127-F131 HydrophobicContact CD2-CE2 4.14Å; L127-F131 WeakPolarHBondContact O-CD2 3.48Å; L127-F131 PolarHBondContact O-N 3.42Å
128R92.8Very high87.3Confident90 Ų9080.2 Ų80.234%0.3442%0.422SS..Hα-helixtrans-52.2-53.1176.1-176.6-160.257.7-147.24.9111.6E123 L124 P125 Y130 F131 S132E123-R128 HydrophobicContact CG-CB 4.18Å; E123-R128 VanDerWaalsContact OE1-CD 3.26Å; E123-R128 WeakPolarHBondContact OE1-CD 3.5Å; E123-R128 WeakPolarHBondContact OE1-CG 3.48Å; E123-R128 WeakPolarHBondContact OE2-CD 3.35Å; E123-R128 IonicContact OE2-CZ 2.65Å; E123-R128 IonicContact OE2-NE 2.98Å; E123-R128 IonicContact OE2-NH1 3.67Å; E123-R128 PolarHBondContact OE2-NH1 2.91Å; L124-R128 PolarHBondContact O-N 3.01Å; L124-R128 VanDerWaalsContact O-N 3.11Å; P125-R128 PolarHBondContact O-N 3.19Å; R128-Y130 VanDerWaalsContact C-N 3.25Å; R128-Y130 PolarHBondContact O-N 3.38Å; R128-F131 PolarHBondContact O-N 2.87Å; R128-S132 VanDerWaalsContact O-CB 3.22Å; R128-S132 WeakPolarHBondContact O-CB 3.41Å; R128-S132 PolarHBondContact O-N 3.33Å; R128-S132 PolarHBondContact O-OG 3.44Å
129D91.6Very high85.9Confident88 Ų8886.6 Ų86.647%0.47144%0.44SS..Hα-helixtrans-67.7-26.6-175.9-59.7-12.4000111.7P125 L127P125-D129 WeakPolarHBondContact O-CB 3.33Å; P125-D129 PolarHBondContact O-N 3.14Å; L127-D129 PolarHBondContact O-N 3.45Å
130Y89.8Confident84.4Confident38 Ų3881.6 Ų81.615%0.14942%0.417CS..Hα-helixtrans-75.1-48.2173.5-170.6-85.1000112.3L102 L107 R126 L127 R128 N133 N136 Q140L102-Y130 HydrophobicContact CD1-CD2 3.94Å; L102-Y130 HydrophobicContact CD1-CG 3.91Å; L102-Y130 HydrophobicContact CD2-CD1 3.52Å; L102-Y130 HydrophobicContact CD2-CD2 3.96Å; L102-Y130 HydrophobicContact CD2-CE1 3.73Å; L102-Y130 HydrophobicContact CD2-CE2 4.13Å; L102-Y130 HydrophobicContact CD2-CG 3.65Å; L102-Y130 HydrophobicContact CG-CD2 4.46Å; L102-Y130 HydrophobicContact CG-CG 4.42Å; L107-Y130 HydrophobicContact CD1-CE1 4.29Å; L107-Y130 HydrophobicContact CD2-CE1 3.64Å; R126-Y130 VanDerWaalsContact O-CB 3.29Å; R126-Y130 WeakPolarHBondContact O-CB 3.25Å; R126-Y130 PolarHBondContact O-N 3.07Å; L127-Y130 PolarHBondContact O-N 3.22Å; L127-Y130 VanDerWaalsContact O-N 3.12Å; R128-Y130 VanDerWaalsContact C-N 3.25Å; R128-Y130 PolarHBondContact O-N 3.38Å; Y130-N133 PolarHBondContact O-N 2.91Å; Y130-N136 HydrophobicContact CE1-CB 4.14Å; Y130-N136 HydrophobicContact CE2-CB 4.25Å; Y130-N136 PolarHBondContact O-ND2 3.01Å; Y130-Q140 PolarHBondContact OH-NE2 2.93Å
131F90.2Very high82.6Confident36 Ų3683.9 Ų83.916%0.15843%0.433CS..Hα-helixtrans-73-26.4179.7-72.9-68.6000113.2A110 L111 H114 L127 R128 N133 F137A110-F131 HydrophobicContact CB-CE2 4.24Å; A110-F131 HydrophobicContact CB-CZ 3.96Å; A110-F131 WeakPolarHBondContact O-CE2 3.44Å; L111-F131 VanDerWaalsContact CA-CZ 3.47Å; L111-F131 HydrophobicContact CB-CE1 3.74Å; L111-F131 HydrophobicContact CB-CE2 4.29Å; L111-F131 HydrophobicContact CB-CZ 3.6Å; L111-F131 HydrophobicContact CD1-CD1 3.82Å; L111-F131 HydrophobicContact CD1-CD2 4.4Å; L111-F131 HydrophobicContact CD1-CE1 3.86Å; L111-F131 HydrophobicContact CD1-CE2 4.4Å; L111-F131 HydrophobicContact CD1-CG 4.16Å; L111-F131 HydrophobicContact CD1-CZ 4.18Å; L111-F131 HydrophobicContact CG-CE1 4.29Å; L111-F131 HydrophobicContact CG-CZ 4.49Å; L111-F131 VanDerWaalsContact N-CZ 3.35Å; H114-F131 HydrophobicContact CB-CD2 4.21Å; H114-F131 HydrophobicContact CB-CE2 4.19Å; H114-F131 AromaticContact CD2-CD2 3.57Å; L127-F131 HydrophobicContact CB-CD2 4.3Å; L127-F131 HydrophobicContact CB-CE2 4.4Å; L127-F131 HydrophobicContact CD2-CE2 4.14Å; L127-F131 WeakPolarHBondContact O-CD2 3.48Å; L127-F131 PolarHBondContact O-N 3.42Å; R128-F131 PolarHBondContact O-N 2.87Å; F131-N133 PolarHBondContact O-N 3.28Å; F131-F137 AromaticContact CD1-CZ 3.75Å; F131-F137 HydrophobicContact CD1-CZ 3.75Å; F131-F137 HydrophobicContact CE1-CE1 4.43Å; F131-F137 HydrophobicContact CE1-CZ 4.06Å
132S89.4Confident80.8Confident85 Ų8583.2 Ų83.259%0.59443%0.426SS*.THydrogen-bonded Turntrans-71.6-10.8175.7-56.90000114.1R128 P134R128-S132 VanDerWaalsContact O-CB 3.22Å; R128-S132 WeakPolarHBondContact O-CB 3.41Å; R128-S132 PolarHBondContact O-N 3.33Å; R128-S132 PolarHBondContact O-OG 3.44Å; S132-P134 WeakPolarHBondContact O-CD 3.43Å
133N89.2Confident78.9Confident78 Ų7881 Ų8142%0.41743%0.432SS..  trans-107.9102.1-177.7-177.45000111.4Y130 F131 G135 N136Y130-N133 PolarHBondContact O-N 2.91Å; F131-N133 PolarHBondContact O-N 3.28Å; N133-G135 PolarHBondContact O-N 3.07Å; N133-G135 VanDerWaalsContact O-N 3.16Å; N133-G135 PolarHBondContact OD1-N 3.11Å; N133-N136 WeakPolarHBondContact O-CB 3.25Å; N133-N136 PolarHBondContact O-N 2.62Å; N133-N136 VanDerWaalsContact O-N 3.14Å
134P81.3Confident77Confident97 Ų9782.2 Ų82.263%0.6345%0.447SS*.G310 helixtrans-62.4-25.6-177.724.6-33.7000113.4S132 N136 F137S132-P134 WeakPolarHBondContact O-CD 3.43Å; P134-N136 PolarHBondContact O-N 3.19Å; P134-N136 VanDerWaalsContact O-N 3.13Å; P134-F137 PolarHBondContact O-N 3.44Å; P134-F137 VanDerWaalsContact O-N 3.15Å
135G81.2Confident75Confident21 Ų2187.3 Ų87.322%0.21648%0.482CS..G310 helixtrans-67.5-9.1177.900000114.9N133N133-G135 PolarHBondContact O-N 3.07Å; N133-G135 VanDerWaalsContact O-N 3.16Å; N133-G135 PolarHBondContact OD1-N 3.11Å
136N79.8Confident72.6Confident40 Ų4087.4 Ų87.421%0.21450%0.495CS..G310 helixtrans-72.6-29172.4-73.8-22.1000112.4Y130 N133 P134 Q140Y130-N136 HydrophobicContact CE1-CB 4.14Å; Y130-N136 HydrophobicContact CE2-CB 4.25Å; Y130-N136 PolarHBondContact O-ND2 3.01Å; N133-N136 WeakPolarHBondContact O-CB 3.25Å; N133-N136 PolarHBondContact O-N 2.62Å; N133-N136 VanDerWaalsContact O-N 3.14Å; P134-N136 PolarHBondContact O-N 3.19Å; P134-N136 VanDerWaalsContact O-N 3.13Å; N136-Q140 PolarHBondContact O-NE2 2.9Å
137F79.8Confident70.4Confident90 Ų9091.4 Ų91.440%0.39552%0.522SS..THydrogen-bonded Turntrans-84.9-33-176.7-59.4-85.1000112.6L107 F131 P134 R139 Q140L107-F137 HydrophobicContact CD1-CD1 3.97Å; L107-F137 HydrophobicContact CD1-CE1 3.76Å; F131-F137 AromaticContact CD1-CZ 3.75Å; F131-F137 HydrophobicContact CD1-CZ 3.75Å; F131-F137 HydrophobicContact CE1-CE1 4.43Å; F131-F137 HydrophobicContact CE1-CZ 4.06Å; P134-F137 PolarHBondContact O-N 3.44Å; P134-F137 VanDerWaalsContact O-N 3.15Å; F137-R139 PolarHBondContact O-N 3.47Å; F137-Q140 PolarHBondContact O-N 3Å; F137-Q140 VanDerWaalsContact O-N 3.16Å
138E70.8Confident67.7Low158 Ų15895.1 Ų95.174%0.73856%0.56SS**THydrogen-bonded Turntrans-60.2-19.4-178.5-62.1-176.4146.900113.9
139R63Low64.8Low219 Ų21995.5 Ų95.583%0.82658%0.582SS**THydrogen-bonded Turntrans-90.2-5.6-177.5-63.6179.9-179.2-99.8-3.3114.4F137F137-R139 PolarHBondContact O-N 3.47Å
140Q60.1Low62.8Low63 Ų6397.7 Ų97.729%0.29460%0.601SS.*  trans-112.23.3-166.1-66.3178.351.700114.8L107 Y130 N136 F137 G142L107-Q140 VanDerWaalsContact CD1-OE1 3.23Å; Y130-Q140 PolarHBondContact OH-NE2 2.93Å; N136-Q140 PolarHBondContact O-NE2 2.9Å; F137-Q140 PolarHBondContact O-N 3Å; F137-Q140 VanDerWaalsContact O-N 3.16Å; Q140-G142 PolarHBondContact O-N 3.32Å; Q140-G142 VanDerWaalsContact O-N 3.16Å
141S50.5Low60.2Low116 Ų11699.2 Ų99.281%0.81163%0.629SS**  trans-73.35.7170.853.20000114T143S141-T143 PolarHBondContact O-N 3.49Å
142G50.3Low57.7Low60 Ų60105.7 Ų105.762%0.61966%0.663SS**SBendtrans-84.3106.3170.700000111.8Q140Q140-G142 PolarHBondContact O-N 3.32Å; Q140-G142 VanDerWaalsContact O-N 3.16Å
143T46.3Very low55.3Low126 Ų126107.4 Ų107.477%0.77367%0.672SS**  trans6.4123.2161.9-40.80000117.9S141S141-T143 PolarHBondContact O-N 3.49Å
144P50.2Low52.8Low111 Ų111107.6 Ų107.672%0.72169%0.693SS**PPolyproline II helixtrans-55.5143.6172-22.932.8000112.6G146P144-G146 PolarHBondContact O-N 3.37Å
145P48.3Very low50.6Low136 Ų136107.1 Ų107.188%0.88370%0.696SS**PPolyproline II helixtrans-63.1121.2177.126-33.2000110.3
146G38.6Very low48.7Very low71 Ų71112.3 Ų112.373%0.73273%0.729SS**PPolyproline II helixtrans-76.5144.1-164.900000115.3P144P144-G146 PolarHBondContact O-N 3.37Å
147M42.8Very low46.6Very low197 Ų197117.8 Ų117.897%0.9776%0.757SS**  trans-75.8115.7153.8-152.473.273.700107.5
148G34.8Very low44.7Very low78 Ų78120.2 Ų120.280%0.80478%0.779SS**  trans-81.2149.8-165.600000115.6
149A33.8Very low43Very low97 Ų97116.4 Ų116.480%0.80278%0.783SS**  trans-134.4131.1157.600000108.9
150P47.7Very low41.6Very low134 Ų134110.1 Ų110.187%0.8779%0.786SS**  trans-90.9122.9-167.232.8-34000114.7
151G37.2Very low40.5Very low71 Ų71112.4 Ų112.473%0.73282%0.815SS**  68112.9127.800000121.2
152I36.8Very low39.8Very low172 Ų172111 Ų11188%0.88282%0.819SS**  trans-140.9122.6134-32.8171.9000108.5
153P38.8Very low39.1Very low121 Ų121111.8 Ų111.879%0.78683%0.827SS**  trans-98.7133.2-178.334.7-31000113.7
154G36.6Very low38.8Very low82 Ų82116.6 Ų116.685%0.84583%0.831SS**  trans77.4112143.600000119.4
155A35Very low38.2Very low86 Ų86118.6 Ų118.671%0.71183%0.831SS**  trans-156.590.7146.700000111I157A155-I157 HydrophobicContact CB-CG1 4.5Å
156S41.5Very low38.3Very low130 Ų130118 Ų11891%0.90983%0.827SS**  trans-73123.4158-65.50000108.4
157I34.9Very low38.3Very low156 Ų156119.7 Ų119.780%0.883%0.827SS**  trans-133.1135.4169.4-48.2179.6000109.6A155A155-I157 HydrophobicContact CB-CG1 4.5Å
158V41Very low38.5Very low140 Ų140116.4 Ų116.485%0.84882%0.819SS**  trans-96138.2-174.7160.80000111.6
159G34.4Very low38.7Very low79 Ų79118.9 Ų118.981%0.81482%0.818SS**  trans84.2165141.700000118.7
160G33.9Very low38.9Very low87 Ų87119.8 Ų119.890%0.89782%0.819SS**  trans137.4114.117000000113.3
161A37.8Very low38.3Very low110 Ų110117 Ų11791%0.90981%0.814SS**  trans-110152.9179.600000112.6
162G35.2Very low38.5Very low86 Ų86117.8 Ų117.889%0.88782%0.822SS**  trans94.9137.9147.300000118.3
163G34.7Very low38.6Very low77 Ų77113.1 Ų113.179%0.79482%0.817SS**  trans142.984.6148.700000120.2
164R40Very low38.6Very low227 Ų227115.2 Ų115.286%0.85782%0.816SS**  83.4104.5112.4-160175.8-174.6-177.20.2122.3
165E38.2Very low38.9Very low154 Ų154119.7 Ų119.772%0.7282%0.82SS**  trans70.2166.3135.8-57.1-89.295.700119.7
166P51.1Low39.5Very low124 Ų124122.2 Ų122.281%0.80582%0.822SS**  cis-129.2175.8-1.236.1-17000116.9
167S39Very low39.7Very low105 Ų105127.8 Ų127.873%0.73482%0.823SS**  trans-88.2158.9-178.1-48.10000116.4
168T46.3Very low40.1Very low129 Ų129125.8 Ų125.879%0.79183%0.829SS**  trans-137.5112.8149.947.90000107.9
169T39.4Very low40.3Very low129 Ų129122.9 Ų122.979%0.79183%0.828SS**  51.513184.9-154.80000113.5
170S37Very low41Very low117 Ų117124.9 Ų124.982%0.81883%0.829SS**  cis-173.3169.7-9.8167.30000108.6
171G36.3Very low41.8Very low74 Ų74128.8 Ų128.876%0.76383%0.828SS**  trans108.4114.814800000116.9
172G41.5Very low42.5Very low88 Ų88128.7 Ų128.791%0.90782%0.821SS**  trans-101.6171.3169.200000113.3
173G37.8Very low43Very low75 Ų75131 Ų13177%0.77382%0.817SS**  trans167.891.5175.700000109.6
174Q40.1Very low44Very low165 Ų165135.3 Ų135.377%0.77182%0.822SS**  74.8102.991-171.2164.5-27.600113.3
175L42.3Very low44.2Very low175 Ų175131.6 Ų131.692%0.91682%0.819SS**  trans-71.3126.1179.4-51.7173.9000110.5
176N47.1Very low45.1Very low140 Ų140129 Ų12975%0.74982%0.817SS**  trans-122.8130.7167.6-72.1-69.9000109.6
177R46.7Very low45.2Very low247 Ų247130.8 Ų130.893%0.93282%0.819SS**  trans-99.8148175.8-76.7-172.7178.4-147.60.6111.1
178A41.8Very low45.6Very low113 Ų113130 Ų13093%0.93481%0.807SS**  trans71.5142.9153.100000119.4
179G44.9Very low45.8Very low80 Ų80132.3 Ų132.383%0.82581%0.806SS**  trans150.583.6171.300000113.7
180S49Very low46.3Very low121 Ų121130.8 Ų130.885%0.84681%0.807SS**  trans-75.4144.3178.9-38.30000113.2
181I52.1Low47.1Very low168 Ų168134.5 Ų134.586%0.86280%0.803SS**  trans-144.6151.7135.763.4166.3000110.7
182S52.3Low48Very low109 Ų109140 Ų14076%0.76280%0.802SS**  trans-88137-179.5-51.30000112.9
183T46.4Very low48.5Very low133 Ų133140 Ų14082%0.81679%0.789SS**  trans-135.890.6140.951.10000108.5D185T183-D185 PolarHBondContact O-N 3.32Å
184L53.7Low49.3Very low169 Ų169142.2 Ų142.289%0.88578%0.783SS**  trans-70.787.6161.3-79172.4000107.6
185D46Very low50.1Low148 Ų148139.3 Ų139.379%0.79177%0.772SS**  trans-95.5126.1158.3-163.73.7000108.1T183T183-D185 PolarHBondContact O-N 3.32Å
186S56.1Low51.1Low99 Ų99133.1 Ų133.169%0.69275%0.751SS**  trans-103.898.6-166.9-60.40000110
187L52.4Low52Low162 Ų162131 Ų13185%0.84874%0.739SS**  trans-137.5109.7167.6-127.781.7000112.5
188D47.9Very low53.4Low90 Ų90125 Ų12548%0.48172%0.717SS.*  trans50.972.7155.4-149.54.8000119.7
189F50.3Low55.2Low176 Ų176124 Ų12477%0.77269%0.693SS**  trans-98.3-0.6160.5-127-86.9000113.5R191F189-R191 VanDerWaalsContact C-N 3.32Å; F189-R191 PolarHBondContact O-N 3.47Å
190A51Low57Low98 Ų98123.3 Ų123.381%0.8167%0.673SS**THydrogen-bonded Turntrans-87.34.5-172.500000114.1
191R54Low58.9Low194 Ų194121.8 Ų121.873%0.73266%0.655SS**THydrogen-bonded Turntrans-118.7-1.7-177.5-73.5-175.3164.8-178.5-4.4115.6F189F189-R191 VanDerWaalsContact C-N 3.32Å; F189-R191 PolarHBondContact O-N 3.47Å
192Y54.4Low60.6Low189 Ų189118.6 Ų118.674%0.74164%0.637SS**SBendtrans-12433.6-177.3-71.4-76.1000113.3
193S52.5Low62.5Low89 Ų89119.7 Ų119.762%0.62262%0.624SS**SBendtrans-131.7-0.9175.6-550000114.9
194D54.3Low64.7Low122 Ų122116.9 Ų116.965%0.65261%0.606SS**SBendtrans-90.8-38.4171.7-168.454.2000111.2G196 N197 R198D194-G196 PolarHBondContact O-N 3.02Å; D194-N197 PolarHBondContact O-N 3.23Å; D194-R198 PolarHBondContact O-N 3.21Å
195D57.4Low66.6Low103 Ų103111.5 Ų111.555%0.55159%0.586SS**Hα-helixtrans-69-29-175.5-159.641.8000113.7N197 R198 E199D195-N197 VanDerWaalsContact C-N 3.33Å; D195-N197 PolarHBondContact O-N 2.9Å; D195-R198 PolarHBondContact O-N 3.35Å; D195-E199 PolarHBondContact O-N 3.36Å
196G62.8Low68.9Low45 Ų45108.2 Ų108.246%0.46457%0.571SS.*Hα-helixtrans-64.6-35.3176.700000113.3D194 T200D194-G196 PolarHBondContact O-N 3.02Å; G196-T200 PolarHBondContact O-N 3.17Å; G196-T200 PolarHBondContact O-OG1 3.48Å
197N66.8Low70.8Confident95 Ų95108.6 Ų108.651%0.50857%0.565SS.*Hα-helixtrans-75.5-37.9174.9-160.891.3000110.9D194 D195 T200 D201D194-N197 PolarHBondContact O-N 3.23Å; D195-N197 VanDerWaalsContact C-N 3.33Å; D195-N197 PolarHBondContact O-N 2.9Å; N197-T200 WeakPolarHBondContact CA-OG1 3.28Å; N197-T200 PolarHBondContact O-N 3.37Å; N197-T200 PolarHBondContact O-OG1 3.34Å; N197-D201 PolarHBondContact ND2-OD1 3.12Å; N197-D201 PolarHBondContact ND2-OD2 2.78Å; N197-D201 WeakPolarHBondContact O-CB 3.44Å; N197-D201 PolarHBondContact O-N 2.81Å
198R76.1Confident72.8Confident121 Ų121105.7 Ų105.746%0.45755%0.547SS..Hα-helixtrans-60.5-45.1173.8-68.5-18054.175.720.7112.2D194 D195 T200 D201 E202D194-R198 PolarHBondContact O-N 3.21Å; D195-R198 PolarHBondContact O-N 3.35Å; R198-T200 VanDerWaalsContact C-N 3.29Å; R198-T200 PolarHBondContact O-N 2.83Å; R198-D201 PolarHBondContact O-N 3.22Å; R198-E202 IonicContact CZ-OE1 2.68Å; R198-E202 IonicContact NE-OE1 3.54Å; R198-E202 IonicContact NH2-OE1 2.85Å; R198-E202 PolarHBondContact NH2-OE1 2.85Å; R198-E202 VanDerWaalsContact O-CB 3.31Å; R198-E202 WeakPolarHBondContact O-CB 3.47Å; R198-E202 VanDerWaalsContact O-CG 3.28Å; R198-E202 WeakPolarHBondContact O-CG 3.39Å; R198-E202 PolarHBondContact O-N 2.96Å
199E79.1Confident75.1Confident94 Ų94107.3 Ų107.344%0.43955%0.55SS.*Hα-helixtrans-64.6-34.4178.9-159.4-164.1-158.800111.6D195 R203D195-E199 PolarHBondContact O-N 3.36Å; E199-R203 WeakPolarHBondContact O-CB 3.42Å; E199-R203 VanDerWaalsContact O-CG 3.23Å; E199-R203 WeakPolarHBondContact O-CG 3.42Å; E199-R203 PolarHBondContact O-N 3.37Å; E199-R203 VanDerWaalsContact O-N 3.1Å; E199-R203 IonicContact OE1-CZ 2.85Å; E199-R203 IonicContact OE1-NH1 3.5Å; E199-R203 IonicContact OE1-NH2 3.7Å; E199-R203 PolarHBondContact OE1-NH2 3.16Å; E199-R203 IonicContact OE2-CZ 3.93Å; E199-R203 IonicContact OE2-NH1 3.66Å; E199-R203 PolarHBondContact OE2-NH1 2.88Å; E199-R203 IonicContact OE2-NH2 3.33Å; E199-R203 PolarHBondContact OE2-NH2 2.97Å
200T82.8Confident77.3Confident65 Ų65104.1 Ų104.140%0.39954%0.538SS..Hα-helixtrans-70.5-42.3171.349.30000112.6G196 N197 R198 R203 V204G196-T200 PolarHBondContact O-N 3.17Å; G196-T200 PolarHBondContact O-OG1 3.48Å; N197-T200 WeakPolarHBondContact CA-OG1 3.28Å; N197-T200 PolarHBondContact O-N 3.37Å; N197-T200 PolarHBondContact O-OG1 3.34Å; R198-T200 VanDerWaalsContact C-N 3.29Å; R198-T200 PolarHBondContact O-N 2.83Å; T200-R203 PolarHBondContact O-N 2.94Å; T200-V204 WeakPolarHBondContact O-CB 3.47Å; T200-V204 VanDerWaalsContact O-CG2 3.28Å; T200-V204 WeakPolarHBondContact O-CG2 3.36Å; T200-V204 PolarHBondContact O-N 3.26Å
201D87.5Confident79.4Confident89 Ų89104 Ų10448%0.47652%0.523SS..Hα-helixtrans-66.9-38.6179.1-66.6-20.6000111.7N197 R198 V204 A205N197-D201 PolarHBondContact ND2-OD1 3.12Å; N197-D201 PolarHBondContact ND2-OD2 2.78Å; N197-D201 WeakPolarHBondContact O-CB 3.44Å; N197-D201 PolarHBondContact O-N 2.81Å; R198-D201 PolarHBondContact O-N 3.22Å; D201-V204 PolarHBondContact O-N 2.94Å; D201-A205 WeakPolarHBondContact O-CB 3.17Å; D201-A205 PolarHBondContact O-N 3.45Å
202E89Confident81.3Confident100 Ų100101.7 Ų101.747%0.46751%0.514SS..Hα-helixtrans-66.5-41.3174.5-73.3175.4-159.600111.1R198 A205 V206R198-E202 IonicContact CZ-OE1 2.68Å; R198-E202 IonicContact NE-OE1 3.54Å; R198-E202 IonicContact NH2-OE1 2.85Å; R198-E202 PolarHBondContact NH2-OE1 2.85Å; R198-E202 VanDerWaalsContact O-CB 3.31Å; R198-E202 WeakPolarHBondContact O-CB 3.47Å; R198-E202 VanDerWaalsContact O-CG 3.28Å; R198-E202 WeakPolarHBondContact O-CG 3.39Å; R198-E202 PolarHBondContact O-N 2.96Å; E202-A205 PolarHBondContact O-N 3.45Å; E202-V206 WeakPolarHBondContact O-CG2 3.35Å; E202-V206 PolarHBondContact O-N 3.41Å
203R91.6Very high83.3Confident133 Ų13398.3 Ų98.350%0.50250%0.504SS..Hα-helixtrans-62.9-42.7171-77.9174.9179.4126.88.8112.3E199 T200 V206 L207E199-R203 WeakPolarHBondContact O-CB 3.42Å; E199-R203 VanDerWaalsContact O-CG 3.23Å; E199-R203 WeakPolarHBondContact O-CG 3.42Å; E199-R203 PolarHBondContact O-N 3.37Å; E199-R203 VanDerWaalsContact O-N 3.1Å; E199-R203 IonicContact OE1-CZ 2.85Å; E199-R203 IonicContact OE1-NH1 3.5Å; E199-R203 IonicContact OE1-NH2 3.7Å; E199-R203 PolarHBondContact OE1-NH2 3.16Å; E199-R203 IonicContact OE2-CZ 3.93Å; E199-R203 IonicContact OE2-NH1 3.66Å; E199-R203 PolarHBondContact OE2-NH1 2.88Å; E199-R203 IonicContact OE2-NH2 3.33Å; E199-R203 PolarHBondContact OE2-NH2 2.97Å; T200-R203 PolarHBondContact O-N 2.94Å; R203-V206 PolarHBondContact O-N 3.03Å; R203-L207 WeakPolarHBondContact O-CB 3.49Å; R203-L207 VanDerWaalsContact O-CG 3.27Å; R203-L207 WeakPolarHBondContact O-CG 3.4Å; R203-L207 PolarHBondContact O-N 2.96Å
204V92.9Very high85.2Confident73 Ų7396.3 Ų96.344%0.44249%0.492SS..Hα-helixtrans-62.2-45.5175.7167.40000110.1T200 D201 V206 L207 E208T200-V204 WeakPolarHBondContact O-CB 3.47Å; T200-V204 VanDerWaalsContact O-CG2 3.28Å; T200-V204 WeakPolarHBondContact O-CG2 3.36Å; T200-V204 PolarHBondContact O-N 3.26Å; D201-V204 PolarHBondContact O-N 2.94Å; V204-V206 PolarHBondContact O-N 2.89Å; V204-L207 PolarHBondContact O-N 2.89Å; V204-E208 HydrophobicContact CG1-CG 4.29Å; V204-E208 WeakPolarHBondContact O-CB 3.26Å; V204-E208 WeakPolarHBondContact O-CG 3.42Å; V204-E208 PolarHBondContact O-N 3.47Å
205A93.9Very high87.1Confident56 Ų5696.6 Ų96.646%0.46349%0.488SS..Hα-helixtrans-62.2-39.5177.300000112.9D201 E202 F209D201-A205 WeakPolarHBondContact O-CB 3.17Å; D201-A205 PolarHBondContact O-N 3.45Å; E202-A205 PolarHBondContact O-N 3.45Å; A205-F209 WeakPolarHBondContact O-CB 3.45Å; A205-F209 PolarHBondContact O-N 2.9Å
206V94.5Very high88.8Confident79 Ų7997.9 Ų97.948%0.47949%0.49SS..Hα-helixtrans-65.2-47.7173.3170.60000110.9E202 R203 V204 E208 F209 E210E202-V206 WeakPolarHBondContact O-CG2 3.35Å; E202-V206 PolarHBondContact O-N 3.41Å; R203-V206 PolarHBondContact O-N 3.03Å; V204-V206 PolarHBondContact O-N 2.89Å; V206-E208 VanDerWaalsContact C-N 3.34Å; V206-E208 PolarHBondContact O-N 3.13Å; V206-F209 WeakPolarHBondContact O-CB 3.25Å; V206-F209 PolarHBondContact O-N 2.88Å; V206-F209 VanDerWaalsContact O-N 3.16Å; V206-E210 HydrophobicContact CG1-CG 4.47Å; V206-E210 WeakPolarHBondContact O-CG 3.41Å; V206-E210 PolarHBondContact O-N 3.16Å
207L95.6Very high90.2Very high108 Ų10899.1 Ų99.157%0.56549%0.489SS*.Hα-helixtrans-63.6-37.4177.8-72.3170.5000112.3R203 V204 L211R203-L207 WeakPolarHBondContact O-CB 3.49Å; R203-L207 VanDerWaalsContact O-CG 3.27Å; R203-L207 WeakPolarHBondContact O-CG 3.4Å; R203-L207 PolarHBondContact O-N 2.96Å; V204-L207 PolarHBondContact O-N 2.89Å; L207-L211 WeakPolarHBondContact O-CB 3.43Å; L207-L211 PolarHBondContact O-N 3.33Å
208E93.7Very high91.3Very high100 Ų10098.9 Ų98.947%0.46749%0.487SS..Hα-helixtrans-66.9-37.9172.8-78.8-172.6-171.300112.3V204 V206 R212V204-E208 HydrophobicContact CG1-CG 4.29Å; V204-E208 WeakPolarHBondContact O-CB 3.26Å; V204-E208 WeakPolarHBondContact O-CG 3.42Å; V204-E208 PolarHBondContact O-N 3.47Å; V206-E208 VanDerWaalsContact C-N 3.34Å; V206-E208 PolarHBondContact O-N 3.13Å; E208-R212 WeakPolarHBondContact O-CB 3.37Å; E208-R212 PolarHBondContact O-N 2.98Å; E208-R212 PolarHBondContact O-NH1 2.92Å; E208-R212 VanDerWaalsContact O-NH1 3.17Å
209F96.3Very high91.9Very high125 Ų12598.7 Ų98.755%0.54849%0.491SS..Hα-helixtrans-66.6-46.3174.4175.7-99000111.3A205 V206 R212 K213A205-F209 WeakPolarHBondContact O-CB 3.45Å; A205-F209 PolarHBondContact O-N 2.9Å; V206-F209 WeakPolarHBondContact O-CB 3.25Å; V206-F209 PolarHBondContact O-N 2.88Å; V206-F209 VanDerWaalsContact O-N 3.16Å; F209-R212 PolarHBondContact O-N 3.26Å; F209-K213 HydrophobicContact CE1-CD 4.29Å; F209-K213 VanDerWaalsContact O-CB 3.3Å; F209-K213 WeakPolarHBondContact O-CB 3.37Å; F209-K213 PolarHBondContact O-N 3.35Å
210E96.2Very high92.4Very high109 Ų10996.5 Ų96.551%0.50949%0.489SS..Hα-helixtrans-62.1-43.7174.8-73.1-178.7-172.100111.7V206 R212 K213 A214V206-E210 HydrophobicContact CG1-CG 4.47Å; V206-E210 WeakPolarHBondContact O-CG 3.41Å; V206-E210 PolarHBondContact O-N 3.16Å; E210-R212 PolarHBondContact O-N 2.82Å; E210-K213 PolarHBondContact O-N 3.2Å; E210-A214 VanDerWaalsContact O-CB 3.26Å; E210-A214 WeakPolarHBondContact O-CB 3.26Å; E210-A214 PolarHBondContact O-N 3.04Å
211L95.4Very high92.8Very high95 Ų9598.8 Ų98.850%0.49750%0.498SS..Hα-helixtrans-61.3-43.2174.6-178.967.2000111.7L207 A214 K215L207-L211 WeakPolarHBondContact O-CB 3.43Å; L207-L211 PolarHBondContact O-N 3.33Å; L211-A214 PolarHBondContact O-N 2.85Å; L211-K215 HydrophobicContact CG-CD 4.34Å; L211-K215 WeakPolarHBondContact O-CB 3.38Å; L211-K215 VanDerWaalsContact O-CG 3.27Å; L211-K215 WeakPolarHBondContact O-CG 3.18Å; L211-K215 PolarHBondContact O-N 2.84Å
212R94.5Very high92.6Very high145 Ų14599.1 Ų99.155%0.54749%0.493SS..Hα-helixtrans-64.5-44.9176.8-175.7-179.3-69.397.5-6111E208 F209 E210 K215 E216E208-R212 WeakPolarHBondContact O-CB 3.37Å; E208-R212 PolarHBondContact O-N 2.98Å; E208-R212 PolarHBondContact O-NH1 2.92Å; E208-R212 VanDerWaalsContact O-NH1 3.17Å; F209-R212 PolarHBondContact O-N 3.26Å; E210-R212 PolarHBondContact O-N 2.82Å; R212-K215 PolarHBondContact O-N 3.49Å; R212-E216 WeakPolarHBondContact O-CB 3.29Å; R212-E216 PolarHBondContact O-N 3.02Å
213K97.3Very high92.2Very high119 Ų11995.1 Ų95.152%0.51748%0.477SS..Hα-helixtrans-65.5-37.8176.6-173.8178.7180-1770112.3F209 E210 T217F209-K213 HydrophobicContact CE1-CD 4.29Å; F209-K213 VanDerWaalsContact O-CB 3.3Å; F209-K213 WeakPolarHBondContact O-CB 3.37Å; F209-K213 PolarHBondContact O-N 3.35Å; E210-K213 PolarHBondContact O-N 3.2Å; K213-T217 WeakPolarHBondContact O-CB 3.28Å; K213-T217 PolarHBondContact O-N 2.91Å; K213-T217 PolarHBondContact O-OG1 3.11Å
214A92.6Very high91.8Very high46 Ų4693.4 Ų93.438%0.3848%0.478SS..Hα-helixtrans-65.8-46173.800000111.1E210 L211 T217 I218E210-A214 VanDerWaalsContact O-CB 3.26Å; E210-A214 WeakPolarHBondContact O-CB 3.26Å; E210-A214 PolarHBondContact O-N 3.04Å; L211-A214 PolarHBondContact O-N 2.85Å; A214-T217 PolarHBondContact O-N 2.69Å; A214-I218 WeakPolarHBondContact O-CB 3.46Å; A214-I218 VanDerWaalsContact O-CG1 3.26Å; A214-I218 WeakPolarHBondContact O-CG1 3.26Å; A214-I218 PolarHBondContact O-N 3.4Å
215K92.2Very high91.1Very high129 Ų12995.7 Ų95.756%0.56149%0.487SS*.Hα-helixtrans-59.6-45.9174.2-75.4175.7177.6-174.50112.2L211 R212 T217 I218 Q219L211-K215 HydrophobicContact CG-CD 4.34Å; L211-K215 WeakPolarHBondContact O-CB 3.38Å; L211-K215 VanDerWaalsContact O-CG 3.27Å; L211-K215 WeakPolarHBondContact O-CG 3.18Å; L211-K215 PolarHBondContact O-N 2.84Å; R212-K215 PolarHBondContact O-N 3.49Å; K215-T217 PolarHBondContact O-N 2.61Å; K215-I218 PolarHBondContact O-N 2.93Å; K215-Q219 WeakPolarHBondContact O-CB 3.34Å; K215-Q219 PolarHBondContact O-N 3.08Å
216E94Very high90.3Very high130 Ų13093.3 Ų93.361%0.60747%0.467SS*.Hα-helixtrans-60.1-43.8174.7-177.8-178.9-167.600111.7R212 Q219 A220R212-E216 WeakPolarHBondContact O-CB 3.29Å; R212-E216 PolarHBondContact O-N 3.02Å; E216-Q219 PolarHBondContact O-N 3.46Å; E216-A220 WeakPolarHBondContact O-CB 3.43Å; E216-A220 PolarHBondContact O-N 3.48Å
217T93.3Very high89.4Confident71 Ų7195.8 Ų95.844%0.43647%0.471SS..Hα-helixtrans-63.2-44.8177-56.40000111.3K213 A214 K215 A220 L221K213-T217 WeakPolarHBondContact O-CB 3.28Å; K213-T217 PolarHBondContact O-N 2.91Å; K213-T217 PolarHBondContact O-OG1 3.11Å; A214-T217 PolarHBondContact O-N 2.69Å; K215-T217 PolarHBondContact O-N 2.61Å; T217-A220 PolarHBondContact O-N 2.85Å; T217-L221 HydrophobicContact CG2-CD1 4.06Å; T217-L221 HydrophobicContact CG2-CG 4.49Å; T217-L221 WeakPolarHBondContact O-CB 3.39Å; T217-L221 VanDerWaalsContact O-CG 3.25Å; T217-L221 WeakPolarHBondContact O-CG 3.11Å; T217-L221 PolarHBondContact O-N 3.02Å
218I89.6Confident88.2Confident90 Ų9093.4 Ų93.446%0.46247%0.466SS..Hα-helixtrans-61.5-43.8175.6-70.2163.5000110.6A214 K215 L221 R222A214-I218 WeakPolarHBondContact O-CB 3.46Å; A214-I218 VanDerWaalsContact O-CG1 3.26Å; A214-I218 WeakPolarHBondContact O-CG1 3.26Å; A214-I218 PolarHBondContact O-N 3.4Å; K215-I218 PolarHBondContact O-N 2.93Å; I218-L221 PolarHBondContact O-N 3.28Å; I218-R222 HydrophobicContact CG2-CG 4.43Å; I218-R222 WeakPolarHBondContact O-CB 3.49Å; I218-R222 VanDerWaalsContact O-CG 3.3Å; I218-R222 WeakPolarHBondContact O-CG 3.38Å; I218-R222 PolarHBondContact O-N 2.98Å
219Q87.9Confident86.9Confident116 Ų11690.5 Ų90.554%0.54246%0.46SS..Hα-helixtrans-64.8-42.8178.1-170.8172.217.500111.9K215 E216 R222 A223 N297K215-Q219 WeakPolarHBondContact O-CB 3.34Å; K215-Q219 PolarHBondContact O-N 3.08Å; E216-Q219 PolarHBondContact O-N 3.46Å; Q219-R222 PolarHBondContact O-N 3.22Å; Q219-A223 WeakPolarHBondContact O-CB 3.38Å; Q219-A223 PolarHBondContact O-N 3.39Å; Q219-N297 WeakPolarHBondContact CG-OD1 3.33Å; Q219-N297 PolarHBondContact NE2-OD1 3.16Å
220A89.3Confident85.3Confident49 Ų4990.1 Ų90.141%0.40546%0.46SS..Hα-helixtrans-64-41.3175.300000112.3E216 T217 A223 N224E216-A220 WeakPolarHBondContact O-CB 3.43Å; E216-A220 PolarHBondContact O-N 3.48Å; T217-A220 PolarHBondContact O-N 2.85Å; A220-A223 PolarHBondContact O-N 3.32Å; A220-N224 WeakPolarHBondContact O-CB 3.43Å; A220-N224 PolarHBondContact O-N 3.05Å; A220-N224 PolarHBondContact O-ND2 2.95Å; A220-N224 VanDerWaalsContact O-ND2 3.1Å
221L90.7Very high83.4Confident113 Ų11392.9 Ų92.959%0.59247%0.472SS*.Hα-helixtrans-64.7-44.4174.8-71.9171.3000111.7T217 I218 N224 L225T217-L221 HydrophobicContact CG2-CD1 4.06Å; T217-L221 HydrophobicContact CG2-CG 4.49Å; T217-L221 WeakPolarHBondContact O-CB 3.39Å; T217-L221 VanDerWaalsContact O-CG 3.25Å; T217-L221 WeakPolarHBondContact O-CG 3.11Å; T217-L221 PolarHBondContact O-N 3.02Å; I218-L221 PolarHBondContact O-N 3.28Å; L221-N224 PolarHBondContact O-N 3.31Å; L221-L225 WeakPolarHBondContact O-CB 3.31Å; L221-L225 PolarHBondContact O-N 3.46Å
222R84.3Confident81Confident96 Ų9696.8 Ų96.836%0.36249%0.488SS..Hα-helixtrans-60-45.2173.7-76.4174.1169.1-153-11.8111.8I218 Q219 N224 L225 T226 D292I218-R222 HydrophobicContact CG2-CG 4.43Å; I218-R222 WeakPolarHBondContact O-CB 3.49Å; I218-R222 VanDerWaalsContact O-CG 3.3Å; I218-R222 WeakPolarHBondContact O-CG 3.38Å; I218-R222 PolarHBondContact O-N 2.98Å; Q219-R222 PolarHBondContact O-N 3.22Å; R222-N224 PolarHBondContact O-N 3.33Å; R222-L225 PolarHBondContact O-N 2.95Å; R222-T226 WeakPolarHBondContact O-CB 3.45Å; R222-T226 PolarHBondContact O-N 2.82Å; R222-T226 PolarHBondContact O-OG1 2.87Å; R222-D292 PolarHBondContact NH1-O 3.37Å
223A80.3Confident78.6Confident16 Ų1692.2 Ų92.213%0.13248%0.476CS..Hα-helixtrans-63.3-39.4177.500000112.6Q219 A220 K227 N297Q219-A223 WeakPolarHBondContact O-CB 3.38Å; Q219-A223 PolarHBondContact O-N 3.39Å; A220-A223 PolarHBondContact O-N 3.32Å; A223-K227 VanDerWaalsContact O-CG 3.31Å; A223-K227 WeakPolarHBondContact O-CG 3.32Å; A223-K227 PolarHBondContact O-N 3.47Å; A223-N297 HydrophobicContact CB-CB 3.84Å
224N82.9Confident76Confident97 Ų9792 Ų9252%0.51949%0.487SS..Hα-helixtrans-69-38.3174.4-73.5-36.6000112.3A220 L221 R222 K227 A228A220-N224 WeakPolarHBondContact O-CB 3.43Å; A220-N224 PolarHBondContact O-N 3.05Å; A220-N224 PolarHBondContact O-ND2 2.95Å; A220-N224 VanDerWaalsContact O-ND2 3.1Å; L221-N224 PolarHBondContact O-N 3.31Å; R222-N224 PolarHBondContact O-N 3.33Å; N224-K227 PolarHBondContact O-N 3.22Å; N224-A228 WeakPolarHBondContact O-CB 3.21Å; N224-A228 PolarHBondContact O-N 3.36Å
225L77.9Confident74Confident121 Ų12197.8 Ų97.863%0.63451%0.511SS*.Hα-helixtrans-66.5-40.6175.2-173.266.7000111.9L221 R222 A228 A229L221-L225 WeakPolarHBondContact O-CB 3.31Å; L221-L225 PolarHBondContact O-N 3.46Å; R222-L225 PolarHBondContact O-N 2.95Å; L225-A228 PolarHBondContact O-N 2.85Å; L225-A229 PolarHBondContact O-N 3.08Å
226T77.4Confident71.6Confident6 Ų6100.4 Ų100.44%0.03753%0.525CS..Hα-helixtrans-57.9-52.8173-54.30000110.1R222 A228 A229 E230 G295 L296 N297R222-T226 WeakPolarHBondContact O-CB 3.45Å; R222-T226 PolarHBondContact O-N 2.82Å; R222-T226 PolarHBondContact O-OG1 2.87Å; T226-A228 VanDerWaalsContact C-N 3.29Å; T226-A228 PolarHBondContact O-N 3.13Å; T226-A229 WeakPolarHBondContact O-CB 3.33Å; T226-A229 PolarHBondContact O-N 3.01Å; T226-A229 VanDerWaalsContact O-N 3.08Å; T226-E230 WeakPolarHBondContact CG2-OE1 3.39Å; T226-E230 WeakPolarHBondContact O-CG 3.39Å; T226-E230 PolarHBondContact O-N 3.03Å; T226-G295 PolarHBondContact OG1-O 3.15Å; T226-G295 VanDerWaalsContact OG1-O 3.13Å; T226-L296 HydrophobicContact CG2-CD2 3.87Å; T226-N297 PolarHBondContact OG1-N 3.14Å
227K75.5Confident69.5Low131 Ų131102.9 Ų102.957%0.5754%0.536SS*.Hα-helixtrans-60.1-36.3178.3-73.7173.7179.3-178.80113.4A223 N224 E230 H231A223-K227 VanDerWaalsContact O-CG 3.31Å; A223-K227 WeakPolarHBondContact O-CG 3.32Å; A223-K227 PolarHBondContact O-N 3.47Å; N224-K227 PolarHBondContact O-N 3.22Å; K227-E230 PolarHBondContact O-N 3.4Å; K227-H231 WeakPolarHBondContact O-CB 3.48Å; K227-H231 PolarHBondContact O-N 2.9Å; K227-H231 VanDerWaalsContact O-N 3.17Å
228A70.9Confident67.1Low57 Ų57110.6 Ų110.647%0.47156%0.557SS.*Hα-helixtrans-65.8-41.5175.100000111.6N224 L225 T226 E230 H231N224-A228 WeakPolarHBondContact O-CB 3.21Å; N224-A228 PolarHBondContact O-N 3.36Å; L225-A228 PolarHBondContact O-N 2.85Å; T226-A228 VanDerWaalsContact C-N 3.29Å; T226-A228 PolarHBondContact O-N 3.13Å; A228-E230 VanDerWaalsContact C-N 3.31Å; A228-E230 PolarHBondContact O-N 2.83Å; A228-H231 PolarHBondContact O-N 3.46Å
229A66.9Low65.2Low40 Ų40115.9 Ų115.933%0.33158%0.577SS.*Hα-helixtrans-69.3-25175.300000113.7L225 T226 L254L225-A229 PolarHBondContact O-N 3.08Å; T226-A229 WeakPolarHBondContact O-CB 3.33Å; T226-A229 PolarHBondContact O-N 3.01Å; T226-A229 VanDerWaalsContact O-N 3.08Å; A229-L254 HydrophobicContact CB-CD1 4.02Å
230E61.8Low62.8Low116 Ų116114.8 Ų114.854%0.54258%0.575SS.*Hα-helixtrans-78.4-27.2174.2-71.9170.1173.300113.1T226 K227 A228T226-E230 WeakPolarHBondContact CG2-OE1 3.39Å; T226-E230 WeakPolarHBondContact O-CG 3.39Å; T226-E230 PolarHBondContact O-N 3.03Å; K227-E230 PolarHBondContact O-N 3.4Å; A228-E230 VanDerWaalsContact C-N 3.31Å; A228-E230 PolarHBondContact O-N 2.83Å
231H55.8Low60.9Low168 Ų168122 Ų12278%0.77859%0.593SS**THydrogen-bonded Turntrans-90.7-3.3-170.5-165.4-75000114.9K227 A228 V233K227-H231 WeakPolarHBondContact O-CB 3.48Å; K227-H231 PolarHBondContact O-N 2.9Å; K227-H231 VanDerWaalsContact O-N 3.17Å; A228-H231 PolarHBondContact O-N 3.46Å; H231-V233 VanDerWaalsContact C-N 3.26Å; H231-V233 PolarHBondContact O-N 2.82Å
232E45.3Very low58.7Low176 Ų176125.7 Ų125.782%0.82260%0.604SS**THydrogen-bonded Turntrans-78.8-1.4176.9-70-152.8143.600114.6
233V45.1Very low56.7Low50 Ų50125.4 Ų125.430%0.30362%0.617SS.*SBendtrans-114.7114.9178.3-174.80000111.3H231 L235H231-V233 VanDerWaalsContact C-N 3.26Å; H231-V233 PolarHBondContact O-N 2.82Å; V233-L235 PolarHBondContact O-N 2.85Å; V233-L235 VanDerWaalsContact O-N 3.09Å
234P42.3Very low54.9Low114 Ų114126.4 Ų126.474%0.7462%0.623SS**  trans-62.9108.8166.2-21.834.1000110.5Q236P234-Q236 PolarHBondContact O-N 3.33Å
235L49.7Very low53.3Low168 Ų168126.5 Ų126.588%0.8863%0.629SS**  trans-55.299.5178-76.2161000111.7V233V233-L235 PolarHBondContact O-N 2.85Å; V233-L235 VanDerWaalsContact O-N 3.09Å
236Q42.1Very low52.2Low184 Ų184126.9 Ų126.986%0.8663%0.628SS**  trans-102.381.7165.9-94.9178-1400110.1P234 R238P234-Q236 PolarHBondContact O-N 3.33Å; Q236-R238 PolarHBondContact O-N 2.8Å
237E50.7Low51.1Low182 Ų182133.2 Ų133.285%0.8566%0.66SS**  trans-48.3117153.2-65-172.714900108.7
238R43.2Very low50Low232 Ų232135.4 Ų135.488%0.87567%0.672SS**  trans-173.7107.3134.6-76.6-131.1174.9174.10.2113.1Q236 N240Q236-R238 PolarHBondContact O-N 2.8Å; R238-N240 PolarHBondContact O-N 3.4Å
239K49.8Very low49.7Very low201 Ų201136.4 Ų136.487%0.87467%0.667SS**  trans27.675.3132.6-58.2-179.5179.9179.80117.9
240N36.2Very low50.1Low94 Ų94140 Ų14050%0.50369%0.687SS.*  trans-161.990.8148.4-160.227000114.8R238 K242 S243 S244R238-N240 PolarHBondContact O-N 3.4Å; N240-K242 PolarHBondContact O-N 3.46Å; N240-S243 PolarHBondContact O-N 2.97Å; N240-S244 PolarHBondContact O-N 3.01Å
241Y50.5Low51.1Low201 Ų201140 Ų14079%0.78869%0.689SS**THydrogen-bonded Turntrans-67.920.6-179.7-51.8-78000116.2
242K45Very low52.6Low189 Ų189135.1 Ų135.182%0.82267%0.666SS**THydrogen-bonded Turntrans-126.1-5.5174.6-66.2-166.7175.3-172.10113.7N240N240-K242 PolarHBondContact O-N 3.46Å
243S41.3Very low54.5Low91 Ų91131.6 Ų131.664%0.63666%0.659SS**SBendtrans-160.350.2179.2-46.70000110.8N240N240-S243 PolarHBondContact O-N 2.97Å
244S41.9Very low56.5Low37 Ų37130.9 Ų130.926%0.25965%0.653SS.*  trans-83.1126.8170.4-1650000109.4N240 E246 I247N240-S244 PolarHBondContact O-N 3.01Å; S244-E246 PolarHBondContact O-N 2.9Å; S244-E246 VanDerWaalsContact OG-CB 3.28Å; S244-E246 WeakPolarHBondContact OG-CB 3.35Å; S244-E246 PolarHBondContact OG-N 3.15Å; S244-I247 PolarHBondContact O-N 3.1Å
245P50.9Low58.8Low98 Ų98129 Ų12964%0.63663%0.634SS**G310 helixtrans-63.5-18.4171.928.4-34.4000112.3I247 Q248 E249P245-I247 PolarHBondContact O-N 2.99Å; P245-Q248 WeakPolarHBondContact O-CA 3.47Å; P245-Q248 VanDerWaalsContact O-CB 3.26Å; P245-Q248 WeakPolarHBondContact O-CB 3.45Å; P245-Q248 PolarHBondContact O-N 3.48Å; P245-E249 PolarHBondContact O-N 3.14Å
246E53.8Low60.7Low129 Ų129125.5 Ų125.560%0.60361%0.612SS**G310 helixtrans-63.8-24.4177-158.5169.8-162.900113.2S244 Q248 E249S244-E246 PolarHBondContact O-N 2.9Å; S244-E246 VanDerWaalsContact OG-CB 3.28Å; S244-E246 WeakPolarHBondContact OG-CB 3.35Å; S244-E246 PolarHBondContact OG-N 3.15Å; E246-Q248 PolarHBondContact O-N 2.88Å; E246-E249 WeakPolarHBondContact O-CB 3.48Å; E246-E249 PolarHBondContact O-N 3.16Å
247I55.1Low63.1Low140 Ų140119.5 Ų119.572%0.71858%0.581SS**G310 helixtrans-73.4-15.8172.1-60.1168.5000111.1S244 P245S244-I247 PolarHBondContact O-N 3.1Å; P245-I247 PolarHBondContact O-N 2.99Å
248Q51.5Low65.1Low176 Ų176111.5 Ų111.582%0.82255%0.546SS*.G310 helixtrans-96.9-1.2173.3-101.3167.5-1.900113P245 E246P245-Q248 WeakPolarHBondContact O-CA 3.47Å; P245-Q248 VanDerWaalsContact O-CB 3.26Å; P245-Q248 WeakPolarHBondContact O-CB 3.45Å; P245-Q248 PolarHBondContact O-N 3.48Å; E246-Q248 PolarHBondContact O-N 2.88Å
249E65.6Low67.5Low79 Ų79104.5 Ų104.537%0.36953%0.526SS..SBendtrans-70.7131.1169.3-71.5-177.8-156.100109.6P245 E246 I251P245-E249 PolarHBondContact O-N 3.14Å; E246-E249 WeakPolarHBondContact O-CB 3.48Å; E246-E249 PolarHBondContact O-N 3.16Å; E249-I251 PolarHBondContact O-N 3.01Å
250P74.3Confident69.7Low116 Ų11695.9 Ų95.975%0.75349%0.489SS*.PPolyproline II helixtrans-65.6130.2174.127.7-33000109.3K252P250-K252 PolarHBondContact O-N 2.65Å; P250-K252 VanDerWaalsContact O-N 3.16Å
251I82.6Confident72.5Confident114 Ų11491.8 Ų91.859%0.58547%0.467SS*.PPolyproline II helixtrans-49.5122.1179.1-56.9172.7000109.3E249 E255 K256 L259E249-I251 PolarHBondContact O-N 3.01Å; I251-E255 HydrophobicContact CG2-CB 3.88Å; I251-K256 HydrophobicContact CG2-CB 4.07Å; I251-L259 HydrophobicContact CG2-CD1 4.39Å
252K86.8Confident74.6Confident66 Ų6682.6 Ų82.629%0.28743%0.432SS..PPolyproline II helixtrans-66.4149.5-177.2-56.8-178.2-163.5116.20109.6P250 L254 E255 K256P250-K252 PolarHBondContact O-N 2.65Å; P250-K252 VanDerWaalsContact O-N 3.16Å; K252-L254 PolarHBondContact O-N 2.82Å; K252-L254 VanDerWaalsContact O-N 3.13Å; K252-E255 HydrophobicContact CB-CB 4.32Å; K252-E255 HydrophobicContact CB-CG 3.96Å; K252-E255 WeakPolarHBondContact CB-OE2 3.29Å; K252-E255 VanDerWaalsContact CD-OE1 3.25Å; K252-E255 WeakPolarHBondContact CD-OE1 3.48Å; K252-E255 WeakPolarHBondContact CE-OE1 3.46Å; K252-E255 WeakPolarHBondContact CG-OE2 3.21Å; K252-E255 PolarHBondContact N-OE2 3.26Å; K252-E255 IonicContact NZ-OE1 2.62Å; K252-E255 PolarHBondContact NZ-OE1 3.04Å; K252-E255 WeakPolarHBondContact O-CA 3.29Å; K252-E255 WeakPolarHBondContact O-CB 3.32Å; K252-E255 PolarHBondContact O-N 3.07Å; K252-K256 PolarHBondContact O-N 3.36Å
253P86.9Confident77.1Confident103 Ų10376 Ų7667%0.66941%0.407SS*.Hα-helixtrans-54.4-38.4-178.2-29.336.1000114.1K256 R257P253-K256 PolarHBondContact O-N 2.8Å; P253-R257 WeakPolarHBondContact O-CG 3.35Å; P253-R257 PolarHBondContact O-N 2.9Å
254L86.8Confident79.7Confident34 Ų3471.9 Ų71.918%0.17838%0.378CS..Hα-helixtrans-71.2-35.1177.1-56.6176.3000112.5A229 K252 R257 A258 V294 L296A229-L254 HydrophobicContact CB-CD1 4.02Å; K252-L254 PolarHBondContact O-N 2.82Å; K252-L254 VanDerWaalsContact O-N 3.13Å; L254-R257 PolarHBondContact O-N 3.12Å; L254-A258 WeakPolarHBondContact O-CB 3.46Å; L254-A258 PolarHBondContact O-N 3.41Å; L254-V294 WeakPolarHBondContact CD2-O 3.33Å; L254-L296 HydrophobicContact CB-CD2 3.92Å; L254-L296 HydrophobicContact CB-CG 4.33Å; L254-L296 HydrophobicContact CD1-CD2 4.02Å
255E89.3Confident82.2Confident75 Ų7571.7 Ų71.735%0.3537%0.373SS..Hα-helixtrans-66.6-43.7173.8-65.3163.6-177.500110.2I251 K252 R257 A258 L259I251-E255 HydrophobicContact CG2-CB 3.88Å; K252-E255 HydrophobicContact CB-CB 4.32Å; K252-E255 HydrophobicContact CB-CG 3.96Å; K252-E255 WeakPolarHBondContact CB-OE2 3.29Å; K252-E255 VanDerWaalsContact CD-OE1 3.25Å; K252-E255 WeakPolarHBondContact CD-OE1 3.48Å; K252-E255 WeakPolarHBondContact CE-OE1 3.46Å; K252-E255 WeakPolarHBondContact CG-OE2 3.21Å; K252-E255 PolarHBondContact N-OE2 3.26Å; K252-E255 IonicContact NZ-OE1 2.62Å; K252-E255 PolarHBondContact NZ-OE1 3.04Å; K252-E255 WeakPolarHBondContact O-CA 3.29Å; K252-E255 WeakPolarHBondContact O-CB 3.32Å; K252-E255 PolarHBondContact O-N 3.07Å; E255-R257 PolarHBondContact O-N 3.37Å; E255-A258 PolarHBondContact O-N 2.81Å; E255-L259 WeakPolarHBondContact O-CB 3.17Å; E255-L259 VanDerWaalsContact O-CG 3.26Å; E255-L259 WeakPolarHBondContact O-CG 3.22Å; E255-L259 PolarHBondContact O-N 2.99Å
256K91.1Very high84.4Confident94 Ų9470.2 Ų70.241%0.40936%0.357SS..Hα-helixtrans-56.5-48.8172.8-170.5-161.2170.9-152.20110.5I251 K252 P253 A258 L259 N260 N283I251-K256 HydrophobicContact CG2-CB 4.07Å; K252-K256 PolarHBondContact O-N 3.36Å; P253-K256 PolarHBondContact O-N 2.8Å; K256-A258 PolarHBondContact O-N 2.86Å; K256-L259 PolarHBondContact O-N 3.13Å; K256-N260 VanDerWaalsContact O-CB 3.25Å; K256-N260 WeakPolarHBondContact O-CB 3.36Å; K256-N260 VanDerWaalsContact O-CG 3.29Å; K256-N260 PolarHBondContact O-N 2.65Å; K256-N260 PolarHBondContact O-OD1 3.36Å; K256-N283 PolarHBondContact NZ-OD1 3.4Å
257R92.6Very high86.5Confident59 Ų5965.1 Ų65.122%0.22333%0.333CS..Hα-helixtrans-61.8-41.4178.4-69.4177.487.2174.57.1112.4P253 L254 E255 F261 Q286 D293 V294P253-R257 WeakPolarHBondContact O-CG 3.35Å; P253-R257 PolarHBondContact O-N 2.9Å; L254-R257 PolarHBondContact O-N 3.12Å; E255-R257 PolarHBondContact O-N 3.37Å; R257-F261 WeakPolarHBondContact O-CB 3.47Å; R257-F261 PolarHBondContact O-N 2.97Å; R257-Q286 PolarHBondContact O-NE2 3.49Å; R257-D293 IonicContact CZ-OD2 3.29Å; R257-D293 PolarHBondContact NH1-O 3.23Å; R257-D293 PolarHBondContact NH2-O 2.86Å; R257-D293 IonicContact NH2-OD1 2.68Å; R257-D293 PolarHBondContact NH2-OD1 3.17Å; R257-D293 IonicContact NH2-OD2 3.38Å; R257-D293 PolarHBondContact NH2-OD2 3.16Å; R257-V294 HydrophobicContact CB-CG1 4.17Å
258A92.4Very high88.4Confident14 Ų1462.6 Ų62.612%0.11632%0.321CS..Hα-helixtrans-63.4-45.1176.500000112.3L254 E255 K256 F261 L262 W291 V294 L296L254-A258 WeakPolarHBondContact O-CB 3.46Å; L254-A258 PolarHBondContact O-N 3.41Å; E255-A258 PolarHBondContact O-N 2.81Å; K256-A258 PolarHBondContact O-N 2.86Å; A258-F261 PolarHBondContact O-N 3.13Å; A258-L262 WeakPolarHBondContact O-CG 3.43Å; A258-L262 PolarHBondContact O-N 2.89Å; A258-L262 VanDerWaalsContact O-N 3.14Å; A258-W291 HydrophobicContact CB-CH2 3.99Å; A258-W291 HydrophobicContact CB-CZ3 4.38Å; A258-V294 HydrophobicContact CB-CG1 3.72Å; A258-L296 HydrophobicContact CB-CD1 4.06Å
259L93.9Very high90.5Very high85 Ų8559.5 Ų59.545%0.44531%0.305SS..Hα-helixtrans-64.8-47176.9-70.2170.2000111.3I251 E255 K256 F261 L262 V263I251-L259 HydrophobicContact CG2-CD1 4.39Å; E255-L259 WeakPolarHBondContact O-CB 3.17Å; E255-L259 VanDerWaalsContact O-CG 3.26Å; E255-L259 WeakPolarHBondContact O-CG 3.22Å; E255-L259 PolarHBondContact O-N 2.99Å; K256-L259 PolarHBondContact O-N 3.13Å; L259-F261 VanDerWaalsContact C-N 3.31Å; L259-F261 PolarHBondContact O-N 3.07Å; L259-L262 PolarHBondContact O-N 3.37Å; L259-V263 WeakPolarHBondContact O-CB 3.46Å; L259-V263 VanDerWaalsContact O-CG2 3.31Å; L259-V263 WeakPolarHBondContact O-CG2 3.31Å; L259-V263 PolarHBondContact O-N 3.5Å
260N94.8Very high92Very high19 Ų1959.1 Ų59.110%0.10231%0.305CS..Hα-helixtrans-53.2-48.3174.7-84.26.7000111.2K256 L262 V263 N264 F279 N283 F288K256-N260 VanDerWaalsContact O-CB 3.25Å; K256-N260 WeakPolarHBondContact O-CB 3.36Å; K256-N260 VanDerWaalsContact O-CG 3.29Å; K256-N260 PolarHBondContact O-N 2.65Å; K256-N260 PolarHBondContact O-OD1 3.36Å; N260-L262 PolarHBondContact O-N 3.1Å; N260-V263 PolarHBondContact O-N 2.96Å; N260-N264 PolarHBondContact O-N 3.45Å; N260-F279 HydrophobicContact CB-CE1 4.29Å; N260-F279 HydrophobicContact CB-CZ 4.12Å; N260-F279 WeakPolarHBondContact O-CE1 3.48Å; N260-N283 PolarHBondContact ND2-OD1 2.84Å; N260-F288 HydrophobicContact CB-CE1 3.98Å; N260-F288 HydrophobicContact CB-CZ 4.34Å
261F95.7Very high93.1Very high9 Ų959.5 Ų59.54%0.03930%0.301CS..Hα-helixtrans-57.5-49.6177.9-172.9-74.7000111.6R257 A258 L259 V263 N264 E265 F288 W291 V294 K300R257-F261 WeakPolarHBondContact O-CB 3.47Å; R257-F261 PolarHBondContact O-N 2.97Å; A258-F261 PolarHBondContact O-N 3.13Å; L259-F261 VanDerWaalsContact C-N 3.31Å; L259-F261 PolarHBondContact O-N 3.07Å; F261-V263 PolarHBondContact O-N 3.34Å; F261-N264 PolarHBondContact O-N 3.27Å; F261-E265 PolarHBondContact O-N 2.97Å; F261-F288 WeakPolarHBondContact CE2-O 3.27Å; F261-W291 HydrophobicContact CB-CE3 4.4Å; F261-W291 HydrophobicContact CB-CZ3 4.33Å; F261-W291 AromaticContact CD1-CE3 3.78Å; F261-W291 HydrophobicContact CD1-CE3 3.78Å; F261-W291 HydrophobicContact CD1-CZ3 4.21Å; F261-W291 HydrophobicContact CD2-CE3 4.36Å; F261-W291 HydrophobicContact CE1-CE3 4.25Å; F261-W291 HydrophobicContact CE2-CB 4.33Å; F261-W291 AromaticContact CG-CE3 3.89Å; F261-W291 HydrophobicContact CG-CE3 3.89Å; F261-W291 HydrophobicContact CG-CZ3 4.28Å; F261-W291 HydrophobicContact CZ-CB 4.32Å; F261-V294 HydrophobicContact CB-CG2 3.96Å; F261-V294 HydrophobicContact CD2-CG2 4.22Å; F261-V294 HydrophobicContact CG-CG2 4.27Å; F261-K300 HydrophobicContact CE1-CD 4.28Å
262L95.1Very high93.8Very high8 Ų860 Ų604%0.04230%0.296CS..Hα-helixtrans-67.3-35.1-178.3-69.9169.9000113A258 L259 N260 F266 P301 L307A258-L262 WeakPolarHBondContact O-CG 3.43Å; A258-L262 PolarHBondContact O-N 2.89Å; A258-L262 VanDerWaalsContact O-N 3.14Å; L259-L262 PolarHBondContact O-N 3.37Å; N260-L262 PolarHBondContact O-N 3.1Å; L262-F266 VanDerWaalsContact O-CB 3.31Å; L262-F266 WeakPolarHBondContact O-CB 3.37Å; L262-F266 PolarHBondContact O-N 2.86Å; L262-P301 HydrophobicContact CD1-CG 4.03Å; L262-P301 HydrophobicContact CD2-CG 4.25Å; L262-L307 HydrophobicContact CD1-CD1 3.78Å
263V96.3Very high94.3Very high49 Ų4963.2 Ų63.230%0.29731%0.31SS..Hα-helixtrans-65.5-46.9173168.60000110.4L259 N260 F261 E265 F266 L267 F279 L304L259-V263 WeakPolarHBondContact O-CB 3.46Å; L259-V263 VanDerWaalsContact O-CG2 3.31Å; L259-V263 WeakPolarHBondContact O-CG2 3.31Å; L259-V263 PolarHBondContact O-N 3.5Å; N260-V263 PolarHBondContact O-N 2.96Å; F261-V263 PolarHBondContact O-N 3.34Å; V263-E265 PolarHBondContact O-N 2.85Å; V263-F266 WeakPolarHBondContact O-CB 3.39Å; V263-F266 PolarHBondContact O-N 3.39Å; V263-L267 HydrophobicContact CG1-CD1 4.2Å; V263-L267 HydrophobicContact CG1-CG 4.47Å; V263-L267 WeakPolarHBondContact O-CG 3.48Å; V263-L267 PolarHBondContact O-N 3.47Å; V263-F279 HydrophobicContact CB-CE1 4.48Å; V263-F279 HydrophobicContact CB-CZ 4.37Å; V263-F279 HydrophobicContact CG1-CE1 4.23Å; V263-F279 HydrophobicContact CG1-CE2 4.41Å; V263-F279 HydrophobicContact CG1-CZ 4.06Å; V263-L304 HydrophobicContact CG2-CD2 4.11Å
264N96.1Very high94.8Very high6 Ų664.6 Ų64.63%0.03231%0.311CS..Hα-helixtrans-64.3-42.4-179.6-160.930.1000112N260 F261 F266 L267 L268 S276 F279 S280 F288N260-N264 PolarHBondContact O-N 3.45Å; F261-N264 PolarHBondContact O-N 3.27Å; N264-F266 VanDerWaalsContact C-N 3.33Å; N264-F266 PolarHBondContact O-N 2.87Å; N264-L267 PolarHBondContact O-N 3.39Å; N264-L268 WeakPolarHBondContact O-CG 3.26Å; N264-L268 PolarHBondContact O-N 2.91Å; N264-S276 WeakPolarHBondContact OD1-CA 3.45Å; N264-S276 VanDerWaalsContact OD1-CB 3.25Å; N264-S276 WeakPolarHBondContact OD1-CB 3.43Å; N264-S276 PolarHBondContact OD1-O 2.9Å; N264-S276 PolarHBondContact OD1-OG 3.29Å; N264-F279 HydrophobicContact CB-CD1 4.01Å; N264-F279 HydrophobicContact CB-CE1 4.09Å; N264-S280 PolarHBondContact ND2-OG 3.34Å; N264-F288 HydrophobicContact CB-CD1 3.51Å; N264-F288 HydrophobicContact CB-CE1 3.88Å; N264-F288 HydrophobicContact CB-CG 4.31Å; N264-F288 VanDerWaalsContact ND2-CB 3.26Å; N264-F288 WeakPolarHBondContact ND2-CB 3.3Å; N264-F288 WeakPolarHBondContact ND2-CD1 3.47Å; N264-F288 VanDerWaalsContact ND2-CG 3.28Å; N264-F288 WeakPolarHBondContact ND2-CG 3.26Å
265E95.3Very high95.3Very high33 Ų3366.8 Ų66.815%0.15433%0.326CS..Hα-helixtrans-59.9-43.5173.3-172.8-169.2112.600111.7F261 V263 L267 L268 K269 K300 D303F261-E265 PolarHBondContact O-N 2.97Å; V263-E265 PolarHBondContact O-N 2.85Å; E265-L267 VanDerWaalsContact C-N 3.34Å; E265-L267 PolarHBondContact O-N 3.39Å; E265-L268 PolarHBondContact O-N 3.3Å; E265-K269 HydrophobicContact CG-CD 4.14Å; E265-K269 HydrophobicContact CG-CG 4.45Å; E265-K269 WeakPolarHBondContact O-CB 3.37Å; E265-K269 WeakPolarHBondContact O-CG 3.38Å; E265-K269 PolarHBondContact O-N 3.48Å; E265-K269 WeakPolarHBondContact OE1-CE 3.4Å; E265-K269 IonicContact OE1-NZ 2.71Å; E265-K269 PolarHBondContact OE1-NZ 3.32Å; E265-K300 WeakPolarHBondContact OE2-CE 3.39Å; E265-K300 IonicContact OE2-NZ 2.65Å; E265-K300 PolarHBondContact OE2-NZ 2.94Å; E265-D303 WeakPolarHBondContact OE1-CB 3.36Å
266F96.8Very high95.7Very high67 Ų6763.5 Ų63.529%0.29431%0.311SS..Hα-helixtrans-60.8-42.4176.3173.3-88.8000111.8L262 V263 N264 K269 N270 L304L262-F266 VanDerWaalsContact O-CB 3.31Å; L262-F266 WeakPolarHBondContact O-CB 3.37Å; L262-F266 PolarHBondContact O-N 2.86Å; V263-F266 WeakPolarHBondContact O-CB 3.39Å; V263-F266 PolarHBondContact O-N 3.39Å; N264-F266 VanDerWaalsContact C-N 3.33Å; N264-F266 PolarHBondContact O-N 2.87Å; F266-K269 PolarHBondContact O-N 2.99Å; F266-N270 VanDerWaalsContact CD2-ND2 3.34Å; F266-N270 WeakPolarHBondContact CD2-ND2 3.39Å; F266-N270 WeakPolarHBondContact CE2-ND2 3.3Å; F266-N270 WeakPolarHBondContact CZ-ND2 3.41Å; F266-N270 WeakPolarHBondContact O-CB 3.4Å; F266-N270 PolarHBondContact O-N 3.47Å; F266-N270 PolarHBondContact O-ND2 2.87Å; F266-L304 HydrophobicContact CB-CB 4.19Å; F266-L304 HydrophobicContact CB-CD2 4.1Å; F266-L304 HydrophobicContact CD2-CB 4.36Å; F266-L304 HydrophobicContact CG-CD2 4.15Å
267L97.2Very high95.9Very high22 Ų2263.4 Ų63.412%0.11531%0.314CS..Hα-helixtrans-60.1-47176.2-69.6172.2000111.1V263 N264 E265 N270 N271 Y272 T275 F279V263-L267 HydrophobicContact CG1-CD1 4.2Å; V263-L267 HydrophobicContact CG1-CG 4.47Å; V263-L267 WeakPolarHBondContact O-CG 3.48Å; V263-L267 PolarHBondContact O-N 3.47Å; N264-L267 PolarHBondContact O-N 3.39Å; E265-L267 VanDerWaalsContact C-N 3.34Å; E265-L267 PolarHBondContact O-N 3.39Å; L267-N270 CarbonylContact O-C 2.95Å; L267-N270 PolarHBondContact O-N 3.11Å; L267-N271 PolarHBondContact O-N 2.71Å; L267-Y272 HydrophobicContact CD2-CD2 3.95Å; L267-Y272 HydrophobicContact CD2-CG 4.17Å; L267-Y272 WeakPolarHBondContact O-CB 3.48Å; L267-Y272 PolarHBondContact O-N 3.46Å; L267-T275 HydrophobicContact CD1-CG2 4.08Å; L267-T275 HydrophobicContact CD2-CG2 4.07Å; L267-F279 HydrophobicContact CD1-CB 4.29Å; L267-F279 HydrophobicContact CD1-CG 4.41Å
268L96Very high96.1Very high86 Ų8663.8 Ų63.845%0.4532%0.323SS..Hα-helixtrans-63-46.5177.2-70172.3000112.4N264 E265 N270 N271 S276N264-L268 WeakPolarHBondContact O-CG 3.26Å; N264-L268 PolarHBondContact O-N 2.91Å; E265-L268 PolarHBondContact O-N 3.3Å; L268-N270 VanDerWaalsContact C-N 3.26Å; L268-N270 PolarHBondContact O-N 3.1Å; L268-N271 PolarHBondContact O-N 2.9Å; L268-N271 VanDerWaalsContact O-N 3.11Å; L268-S276 VanDerWaalsContact CD2-OG 3.29Å; L268-S276 WeakPolarHBondContact CD2-OG 3.35Å; L268-S276 WeakPolarHBondContact CG-OG 3.41Å
269K95.6Very high96.3Very high112 Ų11265 Ų6549%0.48733%0.326SS..Hα-helixtrans-58.6-34.7176.9-82177.2166.1172.90113.1E265 F266 D303E265-K269 HydrophobicContact CG-CD 4.14Å; E265-K269 HydrophobicContact CG-CG 4.45Å; E265-K269 WeakPolarHBondContact O-CB 3.37Å; E265-K269 WeakPolarHBondContact O-CG 3.38Å; E265-K269 PolarHBondContact O-N 3.48Å; E265-K269 WeakPolarHBondContact OE1-CE 3.4Å; E265-K269 IonicContact OE1-NZ 2.71Å; E265-K269 PolarHBondContact OE1-NZ 3.32Å; F266-K269 PolarHBondContact O-N 2.99Å; K269-D303 VanDerWaalsContact NZ-CB 3.33Å; K269-D303 IonicContact NZ-OD2 2.8Å; K269-D303 PolarHBondContact NZ-OD2 3.39Å
270N96.7Very high96.4Very high71 Ų7162.3 Ų62.338%0.3831%0.314SS..THydrogen-bonded Turntrans-95.115.1179.7-67.5-88.2000113.4F266 L267 L268 Y272F266-N270 VanDerWaalsContact CD2-ND2 3.34Å; F266-N270 WeakPolarHBondContact CD2-ND2 3.39Å; F266-N270 WeakPolarHBondContact CE2-ND2 3.3Å; F266-N270 WeakPolarHBondContact CZ-ND2 3.41Å; F266-N270 WeakPolarHBondContact O-CB 3.4Å; F266-N270 PolarHBondContact O-N 3.47Å; F266-N270 PolarHBondContact O-ND2 2.87Å; L267-N270 CarbonylContact O-C 2.95Å; L267-N270 PolarHBondContact O-N 3.11Å; L268-N270 VanDerWaalsContact C-N 3.26Å; L268-N270 PolarHBondContact O-N 3.1Å; N270-Y272 VanDerWaalsContact C-N 3.28Å; N270-Y272 HydrophobicContact CB-CD2 3.66Å; N270-Y272 HydrophobicContact CB-CE2 3.54Å; N270-Y272 PolarHBondContact O-N 2.88Å
271N96.8Very high96.4Very high123 Ų12367.1 Ų67.166%0.65834%0.34SS*.THydrogen-bonded Turntrans66.115.6177.9-56.7-80000116.1L267 L268 K273L267-N271 PolarHBondContact O-N 2.71Å; L268-N271 PolarHBondContact O-N 2.9Å; L268-N271 VanDerWaalsContact O-N 3.11Å; N271-K273 PolarHBondContact O-N 3.4Å
272Y97.4Very high96.4Very high126 Ų12673.4 Ų73.449%0.49437%0.369SS..  trans-77.950.9172.9-58-61.1000112.1L267 N270 L274 T275 S276L267-Y272 HydrophobicContact CD2-CD2 3.95Å; L267-Y272 HydrophobicContact CD2-CG 4.17Å; L267-Y272 WeakPolarHBondContact O-CB 3.48Å; L267-Y272 PolarHBondContact O-N 3.46Å; N270-Y272 VanDerWaalsContact C-N 3.28Å; N270-Y272 HydrophobicContact CB-CD2 3.66Å; N270-Y272 HydrophobicContact CB-CE2 3.54Å; N270-Y272 PolarHBondContact O-N 2.88Å; Y272-L274 PolarHBondContact O-N 3.4Å; Y272-T275 PolarHBondContact O-N 3.32Å; Y272-S276 PolarHBondContact O-N 2.98Å
273K97.5Very high96.3Very high132 Ų13273.7 Ų73.757%0.57437%0.371SS*.Hα-helixtrans-59.2-42.5-171-63.9-176.9-178.6-179.10113.3N271 S276 I277N271-K273 PolarHBondContact O-N 3.4Å; K273-S276 WeakPolarHBondContact O-CB 3.4Å; K273-S276 PolarHBondContact O-N 3.36Å; K273-I277 WeakPolarHBondContact O-CG1 3.25Å; K273-I277 PolarHBondContact O-N 3.44Å
274L97.4Very high96Very high133 Ų13378.4 Ų78.470%0.69639%0.394SS*.Hα-helixtrans-66.3-42.5179-175.561.6000111.5Y272 S276 I277 T278Y272-L274 PolarHBondContact O-N 3.4Å; L274-S276 VanDerWaalsContact C-N 3.32Å; L274-S276 PolarHBondContact O-N 3.33Å; L274-I277 PolarHBondContact O-N 2.72Å; L274-T278 PolarHBondContact O-N 2.98Å; L274-T278 PolarHBondContact O-OG1 3.32Å
275T97.6Very high95.6Very high79 Ų7983.2 Ų83.249%0.48542%0.42SS..Hα-helixtrans-63.2-38.9174.8-47.50000111.6L267 Y272 F279L267-T275 HydrophobicContact CD1-CG2 4.08Å; L267-T275 HydrophobicContact CD2-CG2 4.07Å; Y272-T275 PolarHBondContact O-N 3.32Å; T275-F279 WeakPolarHBondContact O-CB 3.41Å; T275-F279 PolarHBondContact O-N 2.71Å
276S96.9Very high95.4Very high6 Ų682.3 Ų82.34%0.04242%0.416CS..Hα-helixtrans-62.7-42.5173.9167.90000112.5N264 L268 Y272 K273 L274 F279 S280N264-S276 WeakPolarHBondContact OD1-CA 3.45Å; N264-S276 VanDerWaalsContact OD1-CB 3.25Å; N264-S276 WeakPolarHBondContact OD1-CB 3.43Å; N264-S276 PolarHBondContact OD1-O 2.9Å; N264-S276 PolarHBondContact OD1-OG 3.29Å; L268-S276 VanDerWaalsContact CD2-OG 3.29Å; L268-S276 WeakPolarHBondContact CD2-OG 3.35Å; L268-S276 WeakPolarHBondContact CG-OG 3.41Å; Y272-S276 PolarHBondContact O-N 2.98Å; K273-S276 WeakPolarHBondContact O-CB 3.4Å; K273-S276 PolarHBondContact O-N 3.36Å; L274-S276 VanDerWaalsContact C-N 3.32Å; L274-S276 PolarHBondContact O-N 3.33Å; S276-F279 PolarHBondContact O-N 2.91Å; S276-S280 WeakPolarHBondContact O-CB 3.44Å; S276-S280 PolarHBondContact O-N 3.33Å; S276-S280 PolarHBondContact O-OG 2.88Å
277I95.8Very high95.2Very high93 Ų9382.4 Ų82.448%0.47742%0.42SS..Hα-helixtrans-60.8-55.2174.7-67.9162.8000109.9K273 L274 F279 S280 D281K273-I277 WeakPolarHBondContact O-CG1 3.25Å; K273-I277 PolarHBondContact O-N 3.44Å; L274-I277 PolarHBondContact O-N 2.72Å; I277-F279 VanDerWaalsContact C-N 3.31Å; I277-F279 PolarHBondContact O-N 2.86Å; I277-S280 PolarHBondContact O-N 3.26Å; I277-S280 VanDerWaalsContact O-N 3.08Å; I277-D281 PolarHBondContact O-N 3.35Å
278T97Very high94.9Very high66 Ų6682.8 Ų82.841%0.40542%0.42SS..Hα-helixtrans-59.4-40.7179.4-54.40000112.5L274 S280 D281 E282L274-T278 PolarHBondContact O-N 2.98Å; L274-T278 PolarHBondContact O-OG1 3.32Å; T278-S280 VanDerWaalsContact C-N 3.32Å; T278-S280 PolarHBondContact O-N 3.49Å; T278-D281 PolarHBondContact O-N 3.08Å; T278-E282 WeakPolarHBondContact O-CB 3.48Å; T278-E282 WeakPolarHBondContact O-CG 3.5Å; T278-E282 PolarHBondContact O-N 3.41Å
279F96.8Very high94.5Very high39 Ų3987.3 Ų87.317%0.17144%0.439CS..Hα-helixtrans-65.5-34.5177-179.9-100.9000112.9N260 V263 N264 L267 T275 S276 I277 N283 F288N260-F279 HydrophobicContact CB-CE1 4.29Å; N260-F279 HydrophobicContact CB-CZ 4.12Å; N260-F279 WeakPolarHBondContact O-CE1 3.48Å; V263-F279 HydrophobicContact CB-CE1 4.48Å; V263-F279 HydrophobicContact CB-CZ 4.37Å; V263-F279 HydrophobicContact CG1-CE1 4.23Å; V263-F279 HydrophobicContact CG1-CE2 4.41Å; V263-F279 HydrophobicContact CG1-CZ 4.06Å; N264-F279 HydrophobicContact CB-CD1 4.01Å; N264-F279 HydrophobicContact CB-CE1 4.09Å; L267-F279 HydrophobicContact CD1-CB 4.29Å; L267-F279 HydrophobicContact CD1-CG 4.41Å; T275-F279 WeakPolarHBondContact O-CB 3.41Å; T275-F279 PolarHBondContact O-N 2.71Å; S276-F279 PolarHBondContact O-N 2.91Å; I277-F279 VanDerWaalsContact C-N 3.31Å; I277-F279 PolarHBondContact O-N 2.86Å; F279-N283 PolarHBondContact O-N 3.3Å; F279-N283 PolarHBondContact O-ND2 3.34Å; F279-F288 HydrophobicContact CD1-CE1 4.34Å; F279-F288 HydrophobicContact CD1-CZ 4.38Å; F279-F288 AromaticContact CE1-CE1 3.84Å; F279-F288 HydrophobicContact CE1-CE1 3.84Å; F279-F288 HydrophobicContact CE1-CZ 4.05Å
280S95.4Very high94.3Very high29 Ų2986.9 Ų86.920%0.20344%0.442CS..Hα-helixtrans-73-42175.5-51.60000110.9N264 S276 I277 T278 E282 N283N264-S280 PolarHBondContact ND2-OG 3.34Å; S276-S280 WeakPolarHBondContact O-CB 3.44Å; S276-S280 PolarHBondContact O-N 3.33Å; S276-S280 PolarHBondContact O-OG 2.88Å; I277-S280 PolarHBondContact O-N 3.26Å; I277-S280 VanDerWaalsContact O-N 3.08Å; T278-S280 VanDerWaalsContact C-N 3.32Å; T278-S280 PolarHBondContact O-N 3.49Å; S280-E282 VanDerWaalsContact C-N 3.26Å; S280-E282 PolarHBondContact O-N 2.85Å; S280-N283 CarbonylContact O-C 3.26Å; S280-N283 VanDerWaalsContact O-C 3.26Å; S280-N283 PolarHBondContact O-N 3.45Å
281D95.3Very high94Very high121 Ų12184.5 Ų84.565%0.64743%0.428SS*.Hα-helixtrans-62.7-30.4174.8-69.2-19.4000112.5I277 T278 N283I277-D281 PolarHBondContact O-N 3.35Å; T278-D281 PolarHBondContact O-N 3.08Å; D281-N283 VanDerWaalsContact C-N 3.3Å
282E95.8Very high93.6Very high140 Ų14083.9 Ų83.965%0.65442%0.424SS*.THydrogen-bonded Turntrans-76.6-10.8174.4-77.4178.2-177.400114.1T278 S280T278-E282 WeakPolarHBondContact O-CB 3.48Å; T278-E282 WeakPolarHBondContact O-CG 3.5Å; T278-E282 PolarHBondContact O-N 3.41Å; S280-E282 VanDerWaalsContact C-N 3.26Å; S280-E282 PolarHBondContact O-N 2.85Å
283N93Very high93.2Very high14 Ų1479.7 Ų79.78%0.07541%0.41CS..THydrogen-bonded Turntrans-132.455.9-179.9-62.4-98.6000109.3K256 N260 F279 S280 D281 D285 Q286 F288K256-N283 PolarHBondContact NZ-OD1 3.4Å; N260-N283 PolarHBondContact ND2-OD1 2.84Å; F279-N283 PolarHBondContact O-N 3.3Å; F279-N283 PolarHBondContact O-ND2 3.34Å; S280-N283 CarbonylContact O-C 3.26Å; S280-N283 VanDerWaalsContact O-C 3.26Å; S280-N283 PolarHBondContact O-N 3.45Å; D281-N283 VanDerWaalsContact C-N 3.3Å; N283-D285 PolarHBondContact O-N 2.78Å; N283-D285 VanDerWaalsContact O-N 3.13Å; N283-Q286 PolarHBondContact O-N 3.34Å; N283-Q286 VanDerWaalsContact O-N 3.13Å; N283-F288 HydrophobicContact CB-CE2 4.04Å; N283-F288 HydrophobicContact CB-CZ 3.84Å
284D89.9Confident92.7Very high148 Ų14873.4 Ų73.479%0.79138%0.383SS*.THydrogen-bonded Turntrans-65.7-10-176.270.9-36000114.4Q286D284-Q286 VanDerWaalsContact C-N 3.3Å
285D88.1Confident92Very high108 Ų10867.9 Ų67.958%0.57836%0.358SS*.THydrogen-bonded Turntrans-80-4.8173.372.2-51.5000114.2N283N283-D285 PolarHBondContact O-N 2.78Å; N283-D285 VanDerWaalsContact O-N 3.13Å
286Q91.3Very high91.2Very high13 Ų1365.7 Ų65.76%0.06134%0.343CS..SBendtrans-127.1132.3-176.2179.5173.3-3.300113.1R257 N283 D284 F288 D293R257-Q286 PolarHBondContact O-NE2 3.49Å; N283-Q286 PolarHBondContact O-N 3.34Å; N283-Q286 VanDerWaalsContact O-N 3.13Å; D284-Q286 VanDerWaalsContact C-N 3.3Å; Q286-F288 HydrophobicContact CB-CE2 4.18Å; Q286-F288 HydrophobicContact CB-CZ 4.33Å; Q286-F288 HydrophobicContact CG-CE1 4.48Å; Q286-F288 HydrophobicContact CG-CE2 4.32Å; Q286-F288 HydrophobicContact CG-CZ 4.27Å; Q286-F288 VanDerWaalsContact O-CD2 3.31Å; Q286-F288 WeakPolarHBondContact O-CD2 3.26Å; Q286-F288 WeakPolarHBondContact O-CE2 3.37Å; Q286-D293 WeakPolarHBondContact CA-OD2 3.44Å
287D91Very high90.4Very high69 Ų6969.1 Ų69.137%0.36936%0.361SS..  trans-83.8119.8169-172.8-25.3000110.1E289 L290 D293D287-E289 WeakPolarHBondContact OD1-CB 3.16Å; D287-E289 PolarHBondContact OD1-N 2.88Å; D287-L290 PolarHBondContact OD1-N 2.91Å; D287-D293 HydrophobicContact CB-CB 3.92Å; D287-D293 PolarHBondContact N-OD2 2.93Å
288F91.2Very high89.8Confident30 Ų3068.3 Ų68.313%0.13236%0.357CS..SBendtrans-92.2-8.8-178.7-69.8-84.9000114.4N260 F261 N264 F279 N283 Q286N260-F288 HydrophobicContact CB-CE1 3.98Å; N260-F288 HydrophobicContact CB-CZ 4.34Å; F261-F288 WeakPolarHBondContact CE2-O 3.27Å; N264-F288 HydrophobicContact CB-CD1 3.51Å; N264-F288 HydrophobicContact CB-CE1 3.88Å; N264-F288 HydrophobicContact CB-CG 4.31Å; N264-F288 VanDerWaalsContact ND2-CB 3.26Å; N264-F288 WeakPolarHBondContact ND2-CB 3.3Å; N264-F288 WeakPolarHBondContact ND2-CD1 3.47Å; N264-F288 VanDerWaalsContact ND2-CG 3.28Å; N264-F288 WeakPolarHBondContact ND2-CG 3.26Å; F279-F288 HydrophobicContact CD1-CE1 4.34Å; F279-F288 HydrophobicContact CD1-CZ 4.38Å; F279-F288 AromaticContact CE1-CE1 3.84Å; F279-F288 HydrophobicContact CE1-CE1 3.84Å; F279-F288 HydrophobicContact CE1-CZ 4.05Å; N283-F288 HydrophobicContact CB-CE2 4.04Å; N283-F288 HydrophobicContact CB-CZ 3.84Å; Q286-F288 HydrophobicContact CB-CE2 4.18Å; Q286-F288 HydrophobicContact CB-CZ 4.33Å; Q286-F288 HydrophobicContact CG-CE1 4.48Å; Q286-F288 HydrophobicContact CG-CE2 4.32Å; Q286-F288 HydrophobicContact CG-CZ 4.27Å; Q286-F288 VanDerWaalsContact O-CD2 3.31Å; Q286-F288 WeakPolarHBondContact O-CD2 3.26Å; Q286-F288 WeakPolarHBondContact O-CE2 3.37Å
289E88.8Confident89.2Confident181 Ų18170.8 Ų70.885%0.84637%0.374SS*.SBendtrans-81.6-27.8174.9-59.7-169.4-172.400111.1D287D287-E289 WeakPolarHBondContact OD1-CB 3.16Å; D287-E289 PolarHBondContact OD1-N 2.88Å
290L89.6Confident88.9Confident103 Ų10373.6 Ų73.654%0.53939%0.386SS..  trans-116.3108.6-171.8-62.1177.4000112.7D287 D292 D293D287-L290 PolarHBondContact OD1-N 2.91Å; L290-D292 PolarHBondContact O-N 2.85Å; L290-D292 VanDerWaalsContact O-N 3.16Å; L290-D293 WeakPolarHBondContact O-CB 3.12Å; L290-D293 PolarHBondContact O-N 2.94Å
291W91.1Very high88.6Confident22 Ų2274 Ų748%0.08339%0.389CS..G310 helixtrans-54.5-35.4174.1170.9-100.1000112.9A258 F261 D293 V294 L296 I298 K300 P301A258-W291 HydrophobicContact CB-CH2 3.99Å; A258-W291 HydrophobicContact CB-CZ3 4.38Å; F261-W291 HydrophobicContact CB-CE3 4.4Å; F261-W291 HydrophobicContact CB-CZ3 4.33Å; F261-W291 AromaticContact CD1-CE3 3.78Å; F261-W291 HydrophobicContact CD1-CE3 3.78Å; F261-W291 HydrophobicContact CD1-CZ3 4.21Å; F261-W291 HydrophobicContact CD2-CE3 4.36Å; F261-W291 HydrophobicContact CE1-CE3 4.25Å; F261-W291 HydrophobicContact CE2-CB 4.33Å; F261-W291 AromaticContact CG-CE3 3.89Å; F261-W291 HydrophobicContact CG-CE3 3.89Å; F261-W291 HydrophobicContact CG-CZ3 4.28Å; F261-W291 HydrophobicContact CZ-CB 4.32Å; W291-D293 PolarHBondContact O-N 3.15Å; W291-V294 HydrophobicContact CD2-CG2 4.34Å; W291-V294 HydrophobicContact CE3-CB 4.45Å; W291-V294 HydrophobicContact CE3-CG2 3.81Å; W291-V294 HydrophobicContact CH2-CB 4.49Å; W291-V294 HydrophobicContact CH2-CG1 4.07Å; W291-V294 HydrophobicContact CH2-CG2 4.41Å; W291-V294 HydrophobicContact CZ2-CG1 4.39Å; W291-V294 HydrophobicContact CZ3-CB 4.4Å; W291-V294 HydrophobicContact CZ3-CG1 4.32Å; W291-V294 HydrophobicContact CZ3-CG2 3.86Å; W291-V294 VanDerWaalsContact O-CB 3.26Å; W291-V294 WeakPolarHBondContact O-CB 3.48Å; W291-V294 WeakPolarHBondContact O-CG2 3.44Å; W291-V294 PolarHBondContact O-N 2.87Å; W291-L296 HydrophobicContact CZ2-CD1 4.43Å; W291-I298 HydrophobicContact CZ2-CD1 4.38Å; W291-I298 HydrophobicContact CZ2-CG1 4.07Å; W291-I298 PolarHBondContact NE1-O 2.83Å; W291-K300 HydrophobicContact CB-CB 4.32Å; W291-K300 HydrophobicContact CB-CD 4.22Å; W291-K300 HydrophobicContact CB-CG 4.45Å; W291-K300 HydrophobicContact CD2-CB 3.86Å; W291-K300 HydrophobicContact CD2-CG 3.93Å; W291-K300 HydrophobicContact CE3-CB 4.45Å; W291-K300 HydrophobicContact CE3-CG 4.03Å; W291-K300 HydrophobicContact CG-CB 3.72Å; W291-K300 HydrophobicContact CG-CD 4.38Å; W291-K300 HydrophobicContact CG-CG 4.08Å; W291-P301 HydrophobicContact CH2-CG 3.86Å; W291-P301 VanDerWaalsContact CZ2-CD 3.42Å; W291-P301 HydrophobicContact CZ2-CG 4.38Å; W291-P301 HydrophobicContact CZ3-CG 4.28Å
292D87.9Confident88.3Confident110 Ų11071.5 Ų71.559%0.58838%0.379SS*.G310 helixtrans-61.2-16.7178.9-70.6-6.7000113.2R222 L290 V294 G295R222-D292 PolarHBondContact NH1-O 3.37Å; L290-D292 PolarHBondContact O-N 2.85Å; L290-D292 VanDerWaalsContact O-N 3.16Å; D292-V294 VanDerWaalsContact C-N 3.33Å; D292-G295 PolarHBondContact O-N 3.04Å
293D89.9Confident88.1Confident37 Ų3767.1 Ų67.120%0.19836%0.36CS..G310 helixtrans-72.5-25.4174.3-174.255.9000113.1R257 Q286 D287 L290 W291 G295R257-D293 IonicContact CZ-OD2 3.29Å; R257-D293 PolarHBondContact NH1-O 3.23Å; R257-D293 PolarHBondContact NH2-O 2.86Å; R257-D293 IonicContact NH2-OD1 2.68Å; R257-D293 PolarHBondContact NH2-OD1 3.17Å; R257-D293 IonicContact NH2-OD2 3.38Å; R257-D293 PolarHBondContact NH2-OD2 3.16Å; Q286-D293 WeakPolarHBondContact CA-OD2 3.44Å; D287-D293 HydrophobicContact CB-CB 3.92Å; D287-D293 PolarHBondContact N-OD2 2.93Å; L290-D293 WeakPolarHBondContact O-CB 3.12Å; L290-D293 PolarHBondContact O-N 2.94Å; W291-D293 PolarHBondContact O-N 3.15Å; D293-G295 PolarHBondContact O-N 2.86Å
294V86.8Confident88.1Confident0 Ų069.1 Ų69.10%037%0.37CS..G310 helixtrans-55.6-23.3173.4175.40000112L254 R257 A258 F261 W291 D292 L296L254-V294 WeakPolarHBondContact CD2-O 3.33Å; R257-V294 HydrophobicContact CB-CG1 4.17Å; A258-V294 HydrophobicContact CB-CG1 3.72Å; F261-V294 HydrophobicContact CB-CG2 3.96Å; F261-V294 HydrophobicContact CD2-CG2 4.22Å; F261-V294 HydrophobicContact CG-CG2 4.27Å; W291-V294 HydrophobicContact CD2-CG2 4.34Å; W291-V294 HydrophobicContact CE3-CB 4.45Å; W291-V294 HydrophobicContact CE3-CG2 3.81Å; W291-V294 HydrophobicContact CH2-CB 4.49Å; W291-V294 HydrophobicContact CH2-CG1 4.07Å; W291-V294 HydrophobicContact CH2-CG2 4.41Å; W291-V294 HydrophobicContact CZ2-CG1 4.39Å; W291-V294 HydrophobicContact CZ3-CB 4.4Å; W291-V294 HydrophobicContact CZ3-CG1 4.32Å; W291-V294 HydrophobicContact CZ3-CG2 3.86Å; W291-V294 VanDerWaalsContact O-CB 3.26Å; W291-V294 WeakPolarHBondContact O-CB 3.48Å; W291-V294 WeakPolarHBondContact O-CG2 3.44Å; W291-V294 PolarHBondContact O-N 2.87Å; D292-V294 VanDerWaalsContact C-N 3.33Å; V294-L296 VanDerWaalsContact C-N 3.29Å; V294-L296 HydrophobicContact CG1-CB 4.49Å; V294-L296 HydrophobicContact CG1-CD1 3.83Å; V294-L296 HydrophobicContact CG1-CG 3.99Å; V294-L296 PolarHBondContact O-N 3.13Å
295G83.3Confident88.1Confident17 Ų1765.6 Ų65.618%0.17535%0.351CS..  trans82.91.1171.800000114.8T226 D292 D293T226-G295 PolarHBondContact OG1-O 3.15Å; T226-G295 VanDerWaalsContact OG1-O 3.13Å; D292-G295 PolarHBondContact O-N 3.04Å; D293-G295 PolarHBondContact O-N 2.86Å
296L81.4Confident88.1Confident33 Ų3363.9 Ų63.917%0.17334%0.34CS..  trans-85.2127.2172.6-63170.9000110.1T226 L254 A258 W291 V294 I298T226-L296 HydrophobicContact CG2-CD2 3.87Å; L254-L296 HydrophobicContact CB-CD2 3.92Å; L254-L296 HydrophobicContact CB-CG 4.33Å; L254-L296 HydrophobicContact CD1-CD2 4.02Å; A258-L296 HydrophobicContact CB-CD1 4.06Å; W291-L296 HydrophobicContact CZ2-CD1 4.43Å; V294-L296 VanDerWaalsContact C-N 3.29Å; V294-L296 HydrophobicContact CG1-CB 4.49Å; V294-L296 HydrophobicContact CG1-CD1 3.83Å; V294-L296 HydrophobicContact CG1-CG 3.99Å; V294-L296 PolarHBondContact O-N 3.13Å; L296-I298 HydrophobicContact CB-CD1 4.15Å; L296-I298 HydrophobicContact CB-CG1 3.87Å; L296-I298 HydrophobicContact CD1-CD1 3.91Å; L296-I298 HydrophobicContact CD1-CG1 4.47Å; L296-I298 PolarHBondContact O-N 3.18Å
297N79.3Confident88.1Confident78 Ų7866.6 Ų66.642%0.41735%0.354SS..SBendtrans-81.153172.6-170.578.1000111.9Q219 A223 T226Q219-N297 WeakPolarHBondContact CG-OD1 3.33Å; Q219-N297 PolarHBondContact NE2-OD1 3.16Å; A223-N297 HydrophobicContact CB-CB 3.84Å; T226-N297 PolarHBondContact OG1-N 3.14Å
298I82.1Confident88Confident77 Ų7772.3 Ų72.340%0.39537%0.372SS..SBendtrans-126.5148.6175.169.4-175.7000109.4W291 L296W291-I298 HydrophobicContact CZ2-CD1 4.38Å; W291-I298 HydrophobicContact CZ2-CG1 4.07Å; W291-I298 PolarHBondContact NE1-O 2.83Å; L296-I298 HydrophobicContact CB-CD1 4.15Å; L296-I298 HydrophobicContact CB-CG1 3.87Å; L296-I298 HydrophobicContact CD1-CD1 3.91Å; L296-I298 HydrophobicContact CD1-CG1 4.47Å; L296-I298 PolarHBondContact O-N 3.18Å
299P85.4Confident87.9Confident118 Ų11878.2 Ų78.277%0.76639%0.393SS*.PPolyproline II helixtrans-60.4146.5170.228.4-35.4000110
300K90.6Very high87.6Confident97 Ų9772.6 Ų72.642%0.42237%0.369SS..PPolyproline II helixtrans-50125.1177.5-178.9175173170.80111.1F261 E265 W291F261-K300 HydrophobicContact CE1-CD 4.28Å; E265-K300 WeakPolarHBondContact OE2-CE 3.39Å; E265-K300 IonicContact OE2-NZ 2.65Å; E265-K300 PolarHBondContact OE2-NZ 2.94Å; W291-K300 HydrophobicContact CB-CB 4.32Å; W291-K300 HydrophobicContact CB-CD 4.22Å; W291-K300 HydrophobicContact CB-CG 4.45Å; W291-K300 HydrophobicContact CD2-CB 3.86Å; W291-K300 HydrophobicContact CD2-CG 3.93Å; W291-K300 HydrophobicContact CE3-CB 4.45Å; W291-K300 HydrophobicContact CE3-CG 4.03Å; W291-K300 HydrophobicContact CG-CB 3.72Å; W291-K300 HydrophobicContact CG-CD 4.38Å; W291-K300 HydrophobicContact CG-CG 4.08Å
301P88.4Confident86.9Confident39 Ų3975.7 Ų75.725%0.25338%0.378SS..PPolyproline II helixtrans-69.1168.8-179.929-34.9000111.7L262 W291L262-P301 HydrophobicContact CD1-CG 4.03Å; L262-P301 HydrophobicContact CD2-CG 4.25Å; W291-P301 HydrophobicContact CH2-CG 3.86Å; W291-P301 VanDerWaalsContact CZ2-CD 3.42Å; W291-P301 HydrophobicContact CZ2-CG 4.38Å; W291-P301 HydrophobicContact CZ3-CG 4.28Å
302P90.1Very high85.7Confident68 Ų6877.6 Ų77.644%0.44241%0.405SS..PPolyproline II helixtrans-54.6157.9169.6-22.633.8000112Q306 L307P302-Q306 HydrophobicContact CB-CB 3.87Å; P302-Q306 HydrophobicContact CB-CG 3.78Å; P302-L307 HydrophobicContact CB-CG 4.44Å; P302-L307 VanDerWaalsContact O-CD1 3.3Å; P302-L307 WeakPolarHBondContact O-CD1 3.28Å
303D90.6Very high84.6Confident47 Ų4778.6 Ų78.625%0.25141%0.41SS..PPolyproline II helixtrans-66.5164.4179.772.734.1000113E265 K269 L305 Q306 L307E265-D303 WeakPolarHBondContact OE1-CB 3.36Å; K269-D303 VanDerWaalsContact NZ-CB 3.33Å; K269-D303 IonicContact NZ-OD2 2.8Å; K269-D303 PolarHBondContact NZ-OD2 3.39Å; D303-L305 PolarHBondContact O-N 3.39Å; D303-L305 VanDerWaalsContact O-N 3.14Å; D303-L305 WeakPolarHBondContact OD1-CB 3.43Å; D303-L305 PolarHBondContact OD1-N 3.42Å; D303-L305 VanDerWaalsContact OD1-N 3.15Å; D303-Q306 PolarHBondContact O-N 2.81Å; D303-Q306 PolarHBondContact OD1-N 3.44Å; D303-L307 WeakPolarHBondContact O-CG 3.46Å; D303-L307 PolarHBondContact O-N 3.24Å
304L93.7Very high82.8Confident56 Ų5683.9 Ų83.929%0.29343%0.433SS..Hα-helixtrans-58.2-31-174-17160.8000113.2V263 F266 Y308V263-L304 HydrophobicContact CG2-CD2 4.11Å; F266-L304 HydrophobicContact CB-CB 4.19Å; F266-L304 HydrophobicContact CB-CD2 4.1Å; F266-L304 HydrophobicContact CD2-CB 4.36Å; F266-L304 HydrophobicContact CG-CD2 4.15Å; L304-Y308 WeakPolarHBondContact O-CB 3.28Å; L304-Y308 PolarHBondContact O-N 2.81Å
305L89.3Confident80.9Confident74 Ų7491.9 Ų91.939%0.38747%0.471SS..Hα-helixtrans-74.5-40.2177.1177.161.9000111.4D303 Y308 R309D303-L305 PolarHBondContact O-N 3.39Å; D303-L305 VanDerWaalsContact O-N 3.14Å; D303-L305 WeakPolarHBondContact OD1-CB 3.43Å; D303-L305 PolarHBondContact OD1-N 3.42Å; D303-L305 VanDerWaalsContact OD1-N 3.15Å; L305-Y308 PolarHBondContact O-N 3.16Å; L305-R309 WeakPolarHBondContact O-CG 3.31Å; L305-R309 PolarHBondContact O-N 3.16Å
306Q89.4Confident79Confident73 Ų7396.2 Ų96.234%0.34149%0.493SS..Hα-helixtrans-66.8-43.6175.6-171.358.532.300111.1P302 D303 Y308 R309 D310P302-Q306 HydrophobicContact CB-CB 3.87Å; P302-Q306 HydrophobicContact CB-CG 3.78Å; D303-Q306 PolarHBondContact O-N 2.81Å; D303-Q306 PolarHBondContact OD1-N 3.44Å; Q306-Y308 VanDerWaalsContact C-N 3.35Å; Q306-Y308 PolarHBondContact O-N 2.77Å; Q306-R309 PolarHBondContact O-N 2.77Å; Q306-D310 PolarHBondContact NE2-OD1 2.68Å; Q306-D310 PolarHBondContact NE2-OD2 3.5Å; Q306-D310 WeakPolarHBondContact O-CB 3.33Å; Q306-D310 PolarHBondContact O-N 3.35Å
307L90.6Very high77.3Confident69 Ų69100.6 Ų100.636%0.36152%0.522SS..Hα-helixtrans-57.3-45.2172.9-72168.1000112L262 P302 D303 R309 D310 F311L262-L307 HydrophobicContact CD1-CD1 3.78Å; P302-L307 HydrophobicContact CB-CG 4.44Å; P302-L307 VanDerWaalsContact O-CD1 3.3Å; P302-L307 WeakPolarHBondContact O-CD1 3.28Å; D303-L307 WeakPolarHBondContact O-CG 3.46Å; D303-L307 PolarHBondContact O-N 3.24Å; L307-R309 PolarHBondContact O-N 2.89Å; L307-D310 PolarHBondContact O-N 2.83Å; L307-F311 WeakPolarHBondContact O-CB 3.27Å; L307-F311 PolarHBondContact O-N 2.86Å
308Y88.1Confident75.7Confident189 Ų18999.5 Ų99.574%0.74153%0.529SS*.Hα-helixtrans-62.3-39.9176.3175.8-100000112.8L304 L305 Q306L304-Y308 WeakPolarHBondContact O-CB 3.28Å; L304-Y308 PolarHBondContact O-N 2.81Å; L305-Y308 PolarHBondContact O-N 3.16Å; Q306-Y308 VanDerWaalsContact C-N 3.35Å; Q306-Y308 PolarHBondContact O-N 2.77Å
309R89.9Confident74Confident155 Ų155104.7 Ų104.759%0.58555%0.549SS*.Hα-helixtrans-68.4-45.2176.7-77.5174.5162.7176.1-3.9112.2L305 Q306 L307 F311 G312L305-R309 WeakPolarHBondContact O-CG 3.31Å; L305-R309 PolarHBondContact O-N 3.16Å; Q306-R309 PolarHBondContact O-N 2.77Å; L307-R309 PolarHBondContact O-N 2.89Å; R309-F311 VanDerWaalsContact C-N 3.28Å; R309-F311 PolarHBondContact O-N 2.8Å; R309-G312 PolarHBondContact O-N 3.21Å
310D82.9Confident71.8Confident62 Ų62105.8 Ų105.833%0.33255%0.548SS..Hα-helixtrans-73.6-20.3-177-68.9-22.2000112.7Q306 L307 G312 N313 H314Q306-D310 PolarHBondContact NE2-OD1 2.68Å; Q306-D310 PolarHBondContact NE2-OD2 3.5Å; Q306-D310 WeakPolarHBondContact O-CB 3.33Å; Q306-D310 PolarHBondContact O-N 3.35Å; L307-D310 PolarHBondContact O-N 2.83Å; D310-G312 PolarHBondContact O-N 3.03Å; D310-N313 CarbonylContact O-C 3.59Å; D310-N313 WeakPolarHBondContact O-CA 3.23Å; D310-N313 PolarHBondContact O-N 3.46Å; D310-H314 PolarHBondContact O-N 3.4Å
311F74.7Confident69.9Low168 Ų168108.7 Ų108.774%0.73757%0.567SS**Hα-helixtrans-55.3-36.6172.6-169.8-97.7000112.7L307 R309 N313L307-F311 WeakPolarHBondContact O-CB 3.27Å; L307-F311 PolarHBondContact O-N 2.86Å; R309-F311 VanDerWaalsContact C-N 3.28Å; R309-F311 PolarHBondContact O-N 2.8Å; F311-N313 VanDerWaalsContact C-N 3.33Å
312G66.2Low67.9Low62 Ų62111.4 Ų111.464%0.63958%0.583SS**THydrogen-bonded Turntrans-74-22174.700000114.2R309 D310R309-G312 PolarHBondContact O-N 3.21Å; D310-G312 PolarHBondContact O-N 3.03Å
313N63.9Low66Low131 Ų131115 Ų11570%0.70160%0.599SS**THydrogen-bonded Turntrans-94.1-10.8-179.9-7322.7000112.7D310 F311 Q315D310-N313 CarbonylContact O-C 3.59Å; D310-N313 WeakPolarHBondContact O-CA 3.23Å; D310-N313 PolarHBondContact O-N 3.46Å; F311-N313 VanDerWaalsContact C-N 3.33Å; N313-Q315 PolarHBondContact O-N 3.27Å
314H51.9Low63.9Low148 Ų148118.7 Ų118.769%0.68562%0.623SS**  trans-76.947.1177.2-13382.3000113D310 V316D310-H314 PolarHBondContact O-N 3.4Å; H314-V316 PolarHBondContact O-N 3.33Å
315Q46.5Very low61.5Low168 Ų168119.7 Ų119.779%0.78564%0.639SS**  trans-57.5111.5150.8-80.4-86.567.400106.1N313 T317N313-Q315 PolarHBondContact O-N 3.27Å; Q315-T317 VanDerWaalsContact C-N 3.28Å; Q315-T317 PolarHBondContact O-N 3.33Å
316V44.9Very low59.5Low108 Ų108121.2 Ų121.266%0.65566%0.656SS**  trans-57.498.2175.7179.10000107.1H314 G318H314-V316 PolarHBondContact O-N 3.33Å; V316-G318 PolarHBondContact O-N 3.1Å
317T44.5Very low57.1Low125 Ų125120.6 Ų120.677%0.76767%0.669SS**  trans-62.396.1157.2-59.50000102.8Q315 K319Q315-T317 VanDerWaalsContact C-N 3.28Å; Q315-T317 PolarHBondContact O-N 3.33Å; T317-K319 VanDerWaalsContact C-N 3.34Å; T317-K319 PolarHBondContact O-N 2.85Å
318G45.6Very low54.9Low55 Ų55123.2 Ų123.257%0.56769%0.687SS**  trans-51.810917500000105.2V316 D320V316-G318 PolarHBondContact O-N 3.1Å; G318-D320 PolarHBondContact O-N 3.3Å
319K45.9Very low52.5Low186 Ų186120.9 Ų120.981%0.80969%0.688SS**  trans-61104.7167.7-71.5176.2-178.7172.20102.5T317 L321T317-K319 VanDerWaalsContact C-N 3.34Å; T317-K319 PolarHBondContact O-N 2.85Å; K319-L321 PolarHBondContact O-N 3.38Å
320D40.6Very low50.6Low141 Ų141122.1 Ų122.175%0.75470%0.7SS**  trans-61.691.9167.8-166.623.3000104G318 V322G318-D320 PolarHBondContact O-N 3.3Å; D320-V322 HydrophobicContact CB-CG2 4.28Å; D320-V322 PolarHBondContact O-N 3.32Å; D320-V322 WeakPolarHBondContact OD2-CG2 3.38Å
321L50.6Low48.8Very low158 Ų158126.9 Ų126.983%0.82773%0.726SS**  trans-71.570.3169.9-81.6163.3000104.9K319 D323K319-L321 PolarHBondContact O-N 3.38Å; L321-D323 VanDerWaalsContact C-N 3.31Å; L321-D323 PolarHBondContact O-N 3.33Å
322V45Very low47.6Very low96 Ų96127.8 Ų127.858%0.58273%0.732SS**  trans-58.3107.3161.4-173.60000103.8D320 V324D320-V322 HydrophobicContact CB-CG2 4.28Å; D320-V322 PolarHBondContact O-N 3.32Å; D320-V322 WeakPolarHBondContact OD2-CG2 3.38Å; V322-V324 PolarHBondContact O-N 2.79Å
323D51.4Low46.8Very low145 Ų145132.6 Ų132.678%0.77574%0.742SS**  trans-62.392.1175.3-173.118.9000107.2L321 A325L321-D323 VanDerWaalsContact C-N 3.31Å; L321-D323 PolarHBondContact O-N 3.33Å; D323-A325 PolarHBondContact O-N 3.26Å
324V46.5Very low45.9Very low124 Ų124136 Ų13675%0.75275%0.754SS**  trans-74.975.7170.5-177.90000105.7V322 S326V322-V324 PolarHBondContact O-N 2.79Å; V324-S326 PolarHBondContact O-N 3.2Å
325A43.9Very low45.5Very low77 Ų77133.3 Ų133.364%0.63676%0.757SS**  trans-54107.5161.700000106.7D323 G327D323-A325 PolarHBondContact O-N 3.26Å; A325-G327 PolarHBondContact O-N 3.42Å
326S45.5Very low45.2Very low106 Ų106133.5 Ų133.574%0.74176%0.763SS**  trans-70.377.6165.259.80000107.5V324 V328V324-S326 PolarHBondContact O-N 3.2Å; S326-V328 PolarHBondContact O-N 3.29Å; S326-V328 VanDerWaalsContact O-N 3.15Å
327G39.1Very low45Very low60 Ų60134.7 Ų134.762%0.61977%0.771SS**  trans-56.5116.9163.400000107.3A325 D329A325-G327 PolarHBondContact O-N 3.42Å; G327-D329 PolarHBondContact O-N 2.68Å
328V45.2Very low44.8Very low123 Ų123135 Ų13575%0.74578%0.775SS**  trans-77116.3163.5-174.50000104.4S326 E330S326-V328 PolarHBondContact O-N 3.29Å; S326-V328 VanDerWaalsContact O-N 3.15Å; V328-E330 WeakPolarHBondContact O-CG 3.38Å; V328-E330 PolarHBondContact O-N 2.68Å; V328-E330 VanDerWaalsContact O-N 3.09Å
329D38.1Very low44.4Very low140 Ų140140.3 Ų140.375%0.74979%0.789SS**  trans-60.7113177.7-62.8-68.4000109.1G327 D331G327-D329 PolarHBondContact O-N 2.68Å; D329-D331 PolarHBondContact O-N 3.42Å; D329-D331 VanDerWaalsContact O-N 3.16Å
330E49.3Very low43.9Very low182 Ų182140 Ų14085%0.8580%0.795SS**THydrogen-bonded Turntrans-80.813.5-177-56-151.6147.700113.2V328 E332V328-E330 WeakPolarHBondContact O-CG 3.38Å; V328-E330 PolarHBondContact O-N 2.68Å; V328-E330 VanDerWaalsContact O-N 3.09Å; E330-E332 PolarHBondContact O-N 3.02Å
331D46.6Very low43.5Very low162 Ų162136.4 Ų136.487%0.86679%0.791SS**THydrogen-bonded Turntrans-88.812.1-175.2-82.5-39.7000114.7D329D329-D331 PolarHBondContact O-N 3.42Å; D329-D331 VanDerWaalsContact O-N 3.16Å
332E48.5Very low42.8Very low187 Ų187136.9 Ų136.987%0.87479%0.794SS**SBendtrans-11430.2177.3-147.1-176.9-174.200114.7E330E330-E332 PolarHBondContact O-N 3.02Å
333L49.9Very low42.5Very low163 Ų163138.5 Ų138.585%0.85380%0.804SS**SBendtrans-132.718.1176-129.4102.2000118.2
334E44.7Very low42.2Very low202 Ų202137 Ų13794%0.94480%0.802SS**  trans-120.767.5169.1-71.3-154.4164.700113.4
335A43.4Very low42.3Very low91 Ų91136.7 Ų136.775%0.75280%0.803SS**  trans-140.345.917800000115.4
336L40Very low42Very low173 Ų173139.5 Ų139.591%0.90681%0.812SS**  trans-154.272.3159.2-80.4-167.6000114.2
337T40.4Very low41.6Very low133 Ų133141.8 Ų141.882%0.81682%0.815SS**  trans-138.5135.3145.350.30000110.8
338P40.1Very low41.4Very low132 Ų132145.7 Ų145.786%0.85782%0.822SS**  trans-84.6132.5-175-7.225.6000112.6
339I37.5Very low41Very low166 Ų166146 Ų14685%0.85183%0.825SS**  trans-80.4131.9171.8-59.2171.4000109.8
340L36.2Very low41.5Very low180 Ų180144.4 Ų144.494%0.94282%0.821SS**  trans-132.9115.6166.6-167.1105.1000109.8
341G32.8Very low40.9Very low65 Ų65143.4 Ų143.467%0.6782%0.821SS**  trans147115.5171.100000114.6
342N34.2Very low40.9Very low167 Ų167140.3 Ų140.389%0.89381%0.81SS**  trans-80.4137.7-175.4-69.3-1.1000114.6
343V39.3Very low40.5Very low130 Ų130138.9 Ų138.979%0.78881%0.807SS**  trans-12.6150.5131.3174.50000115.6
344P44.3Very low39.9Very low113 Ų113143.5 Ų143.573%0.73482%0.824SS**  cis-132.7-179.71720.46.1000117
345P50.4Low39.7Very low118 Ų118140.6 Ų140.677%0.76682%0.818SS**  trans-98.1132.6171.335.9-29.7000114.2
346T36.3Very low39.5Very low137 Ų137143.2 Ų143.284%0.8482%0.822SS**  trans-155.7124158.448.30000114.2
347L37.3Very low39.5Very low154 Ų154141.6 Ų141.681%0.80682%0.817SS**  trans79.7141.7137.9-140.270.2000122.6
348D34.1Very low39.4Very low141 Ų141142.1 Ų142.175%0.75482%0.817SS**  trans70.8114.8161.1-66.1-33.4000123.3
349T37.4Very low39.4Very low131 Ų131142.7 Ų142.780%0.80481%0.814SS**  trans-77.4164.4151.8-12.30000109.1
350P48.9Very low39.5Very low105 Ų105141.1 Ų141.168%0.68281%0.812SS**  cis-138.2178.911.444.3-26.1000117
351L35.9Very low39.7Very low161 Ų161138.4 Ų138.484%0.84380%0.803SS**  trans23.7163140.6-70.5170.3000122.3
352P48.2Very low40.3Very low98 Ų98144 Ų14464%0.63681%0.813SS**  cis-137.8-177.7-8.431.8-8.3000115.6
353I39.9Very low40.8Very low157 Ų157142.1 Ų142.181%0.80581%0.806SS**  trans25.8118.3137.6-55.4160.6000118.6
354E37.2Very low40.9Very low260 Ų260143.2 Ų143.2100%1.21581%0.808SS**  -152.2095-158.3173159.100111.1

Retrieved 354 of 354 residues in 451.8 ms (Link to these results)