A0A077Z2G6_TRITR Loading...

Yip1 domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z2G6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 227 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
1M39.2Very low46.7Very low238 Ų238164.9 Ų164.9100%1.17283%0.834SS**  091.60-69.2-171.7-89.500105.5
2A41.1Very low46.1Very low96 Ų96160.6 Ų160.679%0.79383%0.831SS**  63119.299.800000110.2
3H46.4Very low46.1Very low181 Ų181159.8 Ų159.884%0.83883%0.828SS**  cis-158.8128.925.5-146.7-96.7000106.6
4E43.3Very low45.8Very low190 Ų190157.6 Ų157.689%0.88883%0.825SS**  trans-67.7132.1173.7-84.5-171.6110.900110.3Q6E4-Q6 PolarHBondContact O-N 3.4Å
5L49.9Very low45.2Very low148 Ų148153.3 Ų153.378%0.77582%0.821SS**  trans-85.5103.5169.4-74.9164.8000107.6F7L5-F7 HydrophobicContact CB-CD2 4.42Å; L5-F7 HydrophobicContact CB-CE2 3.91Å; L5-F7 PolarHBondContact O-N 3.48Å
6Q47.8Very low45.1Very low195 Ų195151.3 Ų151.391%0.91182%0.819SS**  trans-80.4101.6177.9-159.6176-0.500108.9E4E4-Q6 PolarHBondContact O-N 3.4Å
7F49.1Very low44.4Very low165 Ų165149.9 Ų149.972%0.72482%0.824SS**  trans-79.8130.2169.5-71.3-87000108.9L5 D9L5-F7 HydrophobicContact CB-CD2 4.42Å; L5-F7 HydrophobicContact CB-CE2 3.91Å; L5-F7 PolarHBondContact O-N 3.48Å; F7-D9 PolarHBondContact O-N 3.36Å
8Q47.9Very low43.8Very low167 Ų167145.9 Ų145.978%0.7882%0.822SS**  trans-83.797.6178.1-169.7161.336.600108.7
9D52.1Low43.2Very low148 Ų148147.1 Ų147.179%0.79183%0.826SS**PPolyproline II helixtrans-76.2123172.8-70.5-40.2000109.9F7F7-D9 PolarHBondContact O-N 3.36Å
10F41.7Very low43.1Very low168 Ų168145.2 Ų145.274%0.73782%0.819SS**PPolyproline II helixtrans-84.2133.5170.8-74.6-88.7000109.6S12F10-S12 PolarHBondContact O-N 3.19Å
11P54.9Low42.6Very low118 Ų118143.9 Ų143.977%0.76682%0.82SS**PPolyproline II helixtrans-66.2127.8-176.524.8-31.8000111.3
12S39.3Very low42.3Very low113 Ų113137.7 Ų137.779%0.7980%0.8SS**  trans-107.483172.6-63.60000109.2F10F10-S12 PolarHBondContact O-N 3.19Å
13D45.8Very low41.9Very low150 Ų150138.9 Ų138.980%0.80280%0.802SS**  trans-123.1103.9167.2-75.1-41.1000107.8
14V42.3Very low41.4Very low129 Ų129135 Ų13578%0.78280%0.802SS**  73.391.688.2179.70000113.8
15A37.6Very low40.9Very low93 Ų93137.3 Ų137.377%0.76980%0.802SS**  64.5166.5124.100000120.7
16P43.6Very low40.3Very low121 Ų121137.9 Ų137.979%0.78681%0.806SS**  -118.2145.6-124.635.5-18.1000114.5
17S32.2Very low39.9Very low129 Ų129137.6 Ų137.690%0.90281%0.805SS**  trans-168.4117.8165.3420000112.7
18G33.2Very low39.3Very low77 Ų77136.7 Ų136.779%0.79481%0.808SS**  trans14388.5156.700000116.4
19L33.6Very low39.3Very low169 Ų169137.1 Ų137.189%0.88581%0.814SS**  trans-122.2158.2142.2-112.4105000106.1
20P40.2Very low38.8Very low108 Ų108135.8 Ų135.870%0.70181%0.807SS**  cis-141.3167.620.637.1-17000115.3
21S32.7Very low38.8Very low118 Ų118130.5 Ų130.583%0.82579%0.794SS**  172.8154.412749.40000112.7
22S33.8Very low38.1Very low108 Ų108132.3 Ų132.376%0.75580%0.798SS**  trans-54.1137.2-172.953.90000116.4
23S32.9Very low38.4Very low121 Ų121136.8 Ų136.885%0.84680%0.797SS**  155.765.3129.553.50000113.1
24A36.6Very low38.5Very low100 Ų100137 Ų13783%0.82680%0.798SS**  trans-168.281.6160.200000110.6
25R31.6Very low38.3Very low239 Ų239139.3 Ų139.390%0.90280%0.797SS**  trans-98.5125.1158.8-77.1179.2173.7140.9-2105.5
26D37.7Very low38.7Very low160 Ų160140.1 Ų140.186%0.85680%0.795SS**SBendtrans116.326166-52.6-21.5000119.3
27E39.6Very low38.5Very low188 Ų188140.2 Ų140.288%0.87980%0.795SS**  trans-129.812.2167.8-85.1-151.811900117
28N36.7Very low38.6Very low147 Ų147142.5 Ų142.579%0.78679%0.792SS**THydrogen-bonded Turntrans-106.722.2-173.1-96.1-27.8000116.9
29L46.5Very low38.9Very low175 Ų175143.2 Ų143.292%0.91679%0.785SS**THydrogen-bonded Turntrans-86.8-5.5171.6-87155.9000114.2
30N42.6Very low39.2Very low120 Ų120139.7 Ų139.764%0.64278%0.78SS**SBendtrans-117.30.4-175.9-91.5-21.3000115.8N32N30-N32 VanDerWaalsContact C-N 3.32Å; N30-N32 PolarHBondContact O-N 2.77Å
31A41Very low39.5Very low57 Ų57143.1 Ų143.147%0.47179%0.786SS.*G310 helixtrans-78.7-11.917900000114.2R33A31-R33 PolarHBondContact O-N 3.16Å
32N40.7Very low39.9Very low156 Ų156146.4 Ų146.483%0.83479%0.786SS**G310 helixtrans-80.213.8176.9-81.30.4000114.6N30N30-N32 VanDerWaalsContact C-N 3.32Å; N30-N32 PolarHBondContact O-N 2.77Å
33R46.4Very low40.6Very low208 Ų208146 Ų14679%0.78578%0.783SS**G310 helixtrans-1022.5173.7-65.3-166.2-166.5-172.35.1114.4A31A31-R33 PolarHBondContact O-N 3.16Å
34L47.2Very low41.5Very low154 Ų154142.6 Ų142.681%0.80676%0.758SS**SBendtrans-99.5-2.5-175.7-124.862000114.9
35F39.1Very low42.6Very low178 Ų178142.4 Ų142.478%0.78175%0.749SS**SBendtrans-108.2102.6165.2-66.4-81.2000107.9
36P44.2Very low43.8Very low110 Ų110137.3 Ų137.371%0.71474%0.739SS**  trans-60.4135.9164.926-27.6000106.9E38P36-E38 PolarHBondContact O-N 3.04Å
37P40.8Very low44.6Very low123 Ų123139.3 Ų139.380%0.79974%0.74SS**  trans-55.7119.7175.122.9-30.9000108.2S39P37-S39 PolarHBondContact O-N 3.13Å
38E34.3Very low45.5Very low177 Ų177131.5 Ų131.583%0.82771%0.706SS**SBendtrans-26.8127.7158.4-164.1178122.600110.7P36P36-E38 PolarHBondContact O-N 3.04Å
39S38.7Very low46.6Very low92 Ų92131.4 Ų131.464%0.64371%0.705SS**  trans46.578171.452.10000114.9P37 E41P37-S39 PolarHBondContact O-N 3.13Å; S39-E41 PolarHBondContact O-N 2.95Å
40A39.6Very low47.3Very low94 Ų94130 Ų13078%0.77769%0.693SS**  trans-55.791.213300000106.2K42A40-K42 PolarHBondContact O-N 3.5Å
41E46.2Very low47.9Very low181 Ų181127.2 Ų127.285%0.84668%0.676SS**  trans-50.593.7161.6-92.2-168.9127.500105S39 S43S39-E41 PolarHBondContact O-N 2.95Å; E41-S43 PolarHBondContact O-N 3.23Å
42K42.7Very low48.6Very low186 Ų186127.1 Ų127.181%0.80967%0.671SS**  trans-68.190175.1-160.7178.5-168.6177.40102.3A40 P44A40-K42 PolarHBondContact O-N 3.5Å; K42-P44 WeakPolarHBondContact O-CA 3.38Å; K42-P44 WeakPolarHBondContact O-CD 3.3Å
43S47.7Very low49.6Very low101 Ų101125.4 Ų125.471%0.70666%0.658SS**  trans-39109.2176.941.90000105.6E41E41-S43 PolarHBondContact O-N 3.23Å
44P51.6Low50.3Low49 Ų49119.5 Ų119.532%0.31864%0.639SS.*  trans-54.8137.2-166.714-26.6000106.7K42 L46 F51K42-P44 WeakPolarHBondContact O-CA 3.38Å; K42-P44 WeakPolarHBondContact O-CD 3.3Å; P44-L46 PolarHBondContact O-N 2.96Å; P44-F51 HydrophobicContact CB-CB 4.25Å; P44-F51 HydrophobicContact CG-CB 3.99Å; P44-F51 HydrophobicContact CG-CD2 4.05Å; P44-F51 HydrophobicContact CG-CG 4.48Å
45P58.9Low50.8Low96 Ų96114 Ų11462%0.62361%0.609SS**  trans-48.1140.5179.118.9-29.9000107.7F47 S48P45-F47 CarbonylContact O-C 3.6Å; P45-F47 PolarHBondContact O-N 3.38Å; P45-S48 VanDerWaalsContact O-CB 3.28Å; P45-S48 WeakPolarHBondContact O-CB 3.41Å; P45-S48 PolarHBondContact O-N 3.45Å
46L58.5Low51.7Low132 Ų132109.9 Ų109.969%0.69159%0.591SS**THydrogen-bonded Turntrans-55.7-6-171.1-64.4174000114.9P44 F51P44-L46 PolarHBondContact O-N 2.96Å; L46-F51 HydrophobicContact CD2-CE1 4.09Å; L46-F51 HydrophobicContact CD2-CZ 4.13Å
47F54Low52.4Low202 Ų202111.1 Ų111.189%0.88659%0.592SS**THydrogen-bonded Turntrans-111.85.5174.9-76.7-82.9000115P45 L49P45-F47 CarbonylContact O-C 3.6Å; P45-F47 PolarHBondContact O-N 3.38Å; F47-L49 PolarHBondContact O-N 3.29Å
48S58.2Low53.1Low24 Ų24106.9 Ų106.917%0.16856%0.563CS.*  trans-63.1127.1171.3149.40000108.1P45 Q50 F51 C52P45-S48 VanDerWaalsContact O-CB 3.28Å; P45-S48 WeakPolarHBondContact O-CB 3.41Å; P45-S48 PolarHBondContact O-N 3.45Å; S48-Q50 PolarHBondContact O-N 2.69Å; S48-Q50 VanDerWaalsContact OG-CB 3.28Å; S48-Q50 WeakPolarHBondContact OG-CB 3.46Å; S48-Q50 PolarHBondContact OG-N 3.01Å; S48-F51 WeakPolarHBondContact O-CA 3.42Å; S48-F51 WeakPolarHBondContact O-CB 3.38Å; S48-F51 PolarHBondContact O-N 3.32Å; S48-F51 PolarHBondContact OG-N 3.38Å; S48-C52 PolarHBondContact O-N 3.28Å
49L60.8Low54.2Low145 Ų145104.5 Ų104.576%0.75956%0.556SS**Hα-helixtrans-52.4-30.7176.4-128.3162.4000111.3F47 C52 Q53F47-L49 PolarHBondContact O-N 3.29Å; L49-C52 PolarHBondContact O-N 3.06Å; L49-Q53 WeakPolarHBondContact O-CB 3.18Å; L49-Q53 PolarHBondContact O-N 3.4Å
50Q59.4Low55.2Low145 Ų145105.2 Ų105.268%0.67856%0.557SS**Hα-helixtrans-67-37.5176.1-134.5171600112.7S48 Q53 Q54S48-Q50 PolarHBondContact O-N 2.69Å; S48-Q50 VanDerWaalsContact OG-CB 3.28Å; S48-Q50 WeakPolarHBondContact OG-CB 3.46Å; S48-Q50 PolarHBondContact OG-N 3.01Å; Q50-Q53 PolarHBondContact O-N 3.34Å; Q50-Q54 PolarHBondContact O-N 3.38Å
51F56Low55.7Low61 Ų61104.5 Ų104.527%0.26855%0.551SS.*Hα-helixtrans-71.2-31.9174.3-173.4-100.2000112.2P44 L46 S48 Q54 F55P44-F51 HydrophobicContact CB-CB 4.25Å; P44-F51 HydrophobicContact CG-CB 3.99Å; P44-F51 HydrophobicContact CG-CD2 4.05Å; P44-F51 HydrophobicContact CG-CG 4.48Å; L46-F51 HydrophobicContact CD2-CE1 4.09Å; L46-F51 HydrophobicContact CD2-CZ 4.13Å; S48-F51 WeakPolarHBondContact O-CA 3.42Å; S48-F51 WeakPolarHBondContact O-CB 3.38Å; S48-F51 PolarHBondContact O-N 3.32Å; S48-F51 PolarHBondContact OG-N 3.38Å; F51-Q54 WeakPolarHBondContact O-CG 3.49Å; F51-Q54 PolarHBondContact O-NE2 3.02Å; F51-Q54 VanDerWaalsContact O-NE2 3.14Å; F51-F55 AromaticContact CD1-CE2 3.91Å; F51-F55 HydrophobicContact CD1-CE2 3.91Å; F51-F55 AromaticContact CE1-CE2 3.53Å; F51-F55 HydrophobicContact CE1-CE2 3.53Å; F51-F55 HydrophobicContact CE1-CZ 4.21Å; F51-F55 HydrophobicContact CE2-CE2 4.25Å; F51-F55 HydrophobicContact CE2-CZ 4.39Å; F51-F55 HydrophobicContact CG-CE2 4.42Å; F51-F55 AromaticContact CZ-CE2 3.71Å; F51-F55 HydrophobicContact CZ-CE2 3.71Å; F51-F55 AromaticContact CZ-CZ 3.93Å; F51-F55 HydrophobicContact CZ-CZ 3.93Å; F51-F55 WeakPolarHBondContact O-CD2 3.44Å; F51-F55 VanDerWaalsContact O-CE2 3.22Å; F51-F55 WeakPolarHBondContact O-CE2 3.48Å
52C56.2Low56.4Low56 Ų5698.7 Ų98.738%0.37853%0.528SS..Hα-helixtrans-72.2-40.7170.1-70.80000111.2S48 L49 Q54 F55 F56S48-C52 PolarHBondContact O-N 3.28Å; L49-C52 PolarHBondContact O-N 3.06Å; C52-Q54 VanDerWaalsContact C-N 3.32Å; C52-Q54 PolarHBondContact O-N 3.41Å; C52-F55 PolarHBondContact O-N 3.45Å; C52-F56 VanDerWaalsContact O-CD2 3.26Å; C52-F56 WeakPolarHBondContact O-CD2 3.43Å; C52-F56 PolarHBondContact O-N 3.19Å
53Q60.9Low57.1Low119 Ų11990.8 Ų90.856%0.55650%0.495SS*.Hα-helixtrans-58.4-39.7-174.8-170.1176.1-5.100112.9L49 Q50 F55 F56 D57L49-Q53 WeakPolarHBondContact O-CB 3.18Å; L49-Q53 PolarHBondContact O-N 3.4Å; Q50-Q53 PolarHBondContact O-N 3.34Å; Q53-F55 PolarHBondContact O-N 2.78Å; Q53-F55 VanDerWaalsContact O-N 3.13Å; Q53-F56 PolarHBondContact O-N 3.1Å; Q53-D57 PolarHBondContact O-N 2.87Å
54Q61.7Low57.6Low84 Ų8490.1 Ų90.139%0.39349%0.487SS..THydrogen-bonded Turntrans-59.5-23.2175.556.8167.2-0.500114.3Q50 F51 C52Q50-Q54 PolarHBondContact O-N 3.38Å; F51-Q54 WeakPolarHBondContact O-CG 3.49Å; F51-Q54 PolarHBondContact O-NE2 3.02Å; F51-Q54 VanDerWaalsContact O-NE2 3.14Å; C52-Q54 VanDerWaalsContact C-N 3.32Å; C52-Q54 PolarHBondContact O-N 3.41Å
55F56.6Low57.9Low39 Ų3995.9 Ų95.917%0.17150%0.502CS..THydrogen-bonded Turntrans-93.5-4.5177.2-58.1-59.2000113.1F51 C52 Q53 P88 L90 L167F51-F55 AromaticContact CD1-CE2 3.91Å; F51-F55 HydrophobicContact CD1-CE2 3.91Å; F51-F55 AromaticContact CE1-CE2 3.53Å; F51-F55 HydrophobicContact CE1-CE2 3.53Å; F51-F55 HydrophobicContact CE1-CZ 4.21Å; F51-F55 HydrophobicContact CE2-CE2 4.25Å; F51-F55 HydrophobicContact CE2-CZ 4.39Å; F51-F55 HydrophobicContact CG-CE2 4.42Å; F51-F55 AromaticContact CZ-CE2 3.71Å; F51-F55 HydrophobicContact CZ-CE2 3.71Å; F51-F55 AromaticContact CZ-CZ 3.93Å; F51-F55 HydrophobicContact CZ-CZ 3.93Å; F51-F55 WeakPolarHBondContact O-CD2 3.44Å; F51-F55 VanDerWaalsContact O-CE2 3.22Å; F51-F55 WeakPolarHBondContact O-CE2 3.48Å; C52-F55 PolarHBondContact O-N 3.45Å; Q53-F55 PolarHBondContact O-N 2.78Å; Q53-F55 VanDerWaalsContact O-N 3.13Å; F55-P88 WeakPolarHBondContact CD1-O 3.38Å; F55-L90 PolarHBondContact O-N 3.29Å; F55-L90 VanDerWaalsContact O-N 3.08Å; F55-L167 HydrophobicContact CD1-CD2 3.66Å; F55-L167 HydrophobicContact CE1-CD2 3.38Å; F55-L167 HydrophobicContact CG-CD2 4.5Å; F55-L167 HydrophobicContact CZ-CD2 4.07Å
56F58.2Low58Low92 Ų9292.9 Ų92.940%0.40448%0.478SS..THydrogen-bonded Turntrans-114.4-8.2-178.4-80.2-104.8000113.4C52 Q53 V58 L90 F91C52-F56 VanDerWaalsContact O-CD2 3.26Å; C52-F56 WeakPolarHBondContact O-CD2 3.43Å; C52-F56 PolarHBondContact O-N 3.19Å; Q53-F56 PolarHBondContact O-N 3.1Å; F56-V58 PolarHBondContact O-N 3.49Å; F56-L90 HydrophobicContact CE2-CB 4.48Å; F56-F91 HydrophobicContact CD1-CB 4.36Å; F56-F91 AromaticContact CD1-CD2 3.72Å; F56-F91 HydrophobicContact CD1-CD2 3.72Å; F56-F91 HydrophobicContact CE1-CD2 4.34Å
57D58.6Low58.3Low136 Ų13688 Ų8873%0.72745%0.454SS*.  trans-86.879.2178.3-162.421.9000111Q53Q53-D57 PolarHBondContact O-N 2.87Å
58V56.2Low58.4Low33 Ų3384 Ų8420%0.244%0.441CS..  trans-129.8125.2-178.5-167.30000111.3F56 T60 V62 V63 D89F56-V58 PolarHBondContact O-N 3.49Å; V58-T60 PolarHBondContact O-N 3.17Å; V58-V62 HydrophobicContact CG1-CB 4.48Å; V58-V63 HydrophobicContact CB-CG2 4.33Å; V58-V63 HydrophobicContact CG1-CG2 3.69Å; V58-D89 HydrophobicContact CG2-CB 3.29Å
59D58.6Low58.6Low128 Ų12887.5 Ų87.568%0.68445%0.451SS*.  trans-59.6126.9172.4-84-47.3000112A61 V62 V63D59-A61 PolarHBondContact O-N 3.16Å; D59-A61 VanDerWaalsContact O-N 3.1Å; D59-V62 HydrophobicContact CB-CG2 4.05Å; D59-V62 WeakPolarHBondContact O-CB 3.28Å; D59-V62 PolarHBondContact O-N 3.07Å; D59-V63 PolarHBondContact O-N 3.21Å
60T57.7Low58.4Low107 Ų10781.2 Ų81.266%0.65642%0.419SS*.Hα-helixtrans-57.4-32.1-176.2-32.90000112.5V58 V62 V63 V64V58-T60 PolarHBondContact O-N 3.17Å; T60-V62 VanDerWaalsContact C-N 3.32Å; T60-V62 PolarHBondContact O-N 3.45Å; T60-V63 WeakPolarHBondContact O-CB 3.12Å; T60-V63 PolarHBondContact O-N 3.23Å; T60-V64 WeakPolarHBondContact O-CG2 3.4Å; T60-V64 PolarHBondContact O-N 3.41Å; T60-V64 VanDerWaalsContact O-N 3.08Å
61A52Low58.3Low78 Ų7878.2 Ų78.265%0.64541%0.406SS*.Hα-helixtrans-64.8-34.8176.800000112.7D59 R65D59-A61 PolarHBondContact O-N 3.16Å; D59-A61 VanDerWaalsContact O-N 3.1Å; A61-R65 WeakPolarHBondContact O-CB 3.21Å; A61-R65 PolarHBondContact O-N 3.38Å; A61-R65 VanDerWaalsContact O-N 3.1Å
62V60.2Low58.2Low59 Ų5979.5 Ų79.536%0.35842%0.419SS..Hα-helixtrans-69.2-42.5176.9177.90000110V58 D59 T60 R65 R66V58-V62 HydrophobicContact CG1-CB 4.48Å; D59-V62 HydrophobicContact CB-CG2 4.05Å; D59-V62 WeakPolarHBondContact O-CB 3.28Å; D59-V62 PolarHBondContact O-N 3.07Å; T60-V62 VanDerWaalsContact C-N 3.32Å; T60-V62 PolarHBondContact O-N 3.45Å; V62-R65 PolarHBondContact O-N 2.85Å; V62-R66 HydrophobicContact CG1-CG 4.34Å; V62-R66 WeakPolarHBondContact O-CB 3.27Å; V62-R66 VanDerWaalsContact O-CG 3.25Å; V62-R66 WeakPolarHBondContact O-CG 3.38Å; V62-R66 PolarHBondContact O-N 2.79Å
63V57.7Low57.7Low20 Ų2079.8 Ų79.812%0.12142%0.42CS..Hα-helixtrans-58.8-49.8177.2-176.80000110.6V58 D59 T60 R65 R66 V67 Y175V58-V63 HydrophobicContact CB-CG2 4.33Å; V58-V63 HydrophobicContact CG1-CG2 3.69Å; D59-V63 PolarHBondContact O-N 3.21Å; T60-V63 WeakPolarHBondContact O-CB 3.12Å; T60-V63 PolarHBondContact O-N 3.23Å; V63-R65 PolarHBondContact O-N 3.18Å; V63-R66 PolarHBondContact O-N 3.12Å; V63-V67 WeakPolarHBondContact O-CG2 3.43Å; V63-V67 PolarHBondContact O-N 3.4Å; V63-Y175 HydrophobicContact CB-CE1 4.43Å; V63-Y175 HydrophobicContact CG1-CE1 3.71Å
64V57Low57Low88 Ų8883.5 Ų83.553%0.53343%0.429SS..Hα-helixtrans-62.7-42.9179.2174.60000111.3T60 R66 V67 L68T60-V64 WeakPolarHBondContact O-CG2 3.4Å; T60-V64 PolarHBondContact O-N 3.41Å; T60-V64 VanDerWaalsContact O-N 3.08Å; V64-R66 VanDerWaalsContact C-N 3.32Å; V64-R66 PolarHBondContact O-N 2.86Å; V64-V67 PolarHBondContact O-N 2.91Å; V64-L68 WeakPolarHBondContact O-CB 3.46Å; V64-L68 PolarHBondContact O-N 3.11Å
65R57.9Low56.3Low169 Ų16986.5 Ų86.564%0.63845%0.447SS*.Hα-helixtrans-62.3-41.8178.1-155.1-171.9-147.8-172.410.2111.4A61 V62 V63 L68 Y69A61-R65 WeakPolarHBondContact O-CB 3.21Å; A61-R65 PolarHBondContact O-N 3.38Å; A61-R65 VanDerWaalsContact O-N 3.1Å; V62-R65 PolarHBondContact O-N 2.85Å; V63-R65 PolarHBondContact O-N 3.18Å; R65-L68 PolarHBondContact O-N 3Å; R65-Y69 HydrophobicContact CG-CD2 4Å; R65-Y69 HydrophobicContact CG-CE2 3.57Å; R65-Y69 WeakPolarHBondContact O-CD2 3.45Å; R65-Y69 PolarHBondContact O-N 3.42Å
66R62.2Low55.6Low33 Ų3391.9 Ų91.913%0.12548%0.477CS..Hα-helixtrans-66.3-40.8177-74.3173.7173.7-178.9-3.1112.2V62 V63 V64 Y69 S70 S83 D89 Y175V62-R66 HydrophobicContact CG1-CG 4.34Å; V62-R66 WeakPolarHBondContact O-CB 3.27Å; V62-R66 VanDerWaalsContact O-CG 3.25Å; V62-R66 WeakPolarHBondContact O-CG 3.38Å; V62-R66 PolarHBondContact O-N 2.79Å; V63-R66 PolarHBondContact O-N 3.12Å; V64-R66 VanDerWaalsContact C-N 3.32Å; V64-R66 PolarHBondContact O-N 2.86Å; R66-Y69 PolarHBondContact O-N 2.87Å; R66-S70 PolarHBondContact O-N 3.32Å; R66-S70 PolarHBondContact O-OG 2.95Å; R66-S83 PolarHBondContact NH2-O 3.35Å; R66-D89 IonicContact CZ-OD1 3.85Å; R66-D89 IonicContact NH1-OD1 2.68Å; R66-D89 PolarHBondContact NH1-OD1 3.13Å; R66-D89 IonicContact NH1-OD2 3.52Å; R66-Y175 HydrophobicContact CB-CD1 4.21Å; R66-Y175 HydrophobicContact CB-CE1 4.12Å
67V63.8Low54.9Low31 Ų3194.2 Ų94.219%0.18849%0.491CS..Hα-helixtrans-59.8-48.7171.8166.30000110.9V63 V64 Y69 S70 M71 I96 Y175V63-V67 WeakPolarHBondContact O-CG2 3.43Å; V63-V67 PolarHBondContact O-N 3.4Å; V64-V67 PolarHBondContact O-N 2.91Å; V67-Y69 VanDerWaalsContact C-N 3.28Å; V67-Y69 PolarHBondContact O-N 3.26Å; V67-S70 WeakPolarHBondContact CA-OG 3.48Å; V67-S70 PolarHBondContact O-N 2.9Å; V67-S70 VanDerWaalsContact O-N 3.11Å; V67-S70 PolarHBondContact O-OG 3.28Å; V67-M71 PolarHBondContact O-N 3.3Å; V67-I96 HydrophobicContact CG2-CD1 3.87Å; V67-Y175 HydrophobicContact CG2-CD1 3.76Å; V67-Y175 HydrophobicContact CG2-CE1 4.17Å
68L57.6Low54.5Low117 Ų11792.1 Ų92.161%0.61348%0.48SS*.Hα-helixtrans-61.7-39-178.4-143.685.6000111.9V64 R65 V72V64-L68 WeakPolarHBondContact O-CB 3.46Å; V64-L68 PolarHBondContact O-N 3.11Å; R65-L68 PolarHBondContact O-N 3Å; L68-V72 PolarHBondContact O-N 3.39Å
69Y61.8Low54.1Low98 Ų9893.8 Ų93.838%0.38449%0.485SS..Hα-helixtrans-75.5-24.9176.9-74.5-54.9000114.3R65 R66 V67 F79R65-Y69 HydrophobicContact CG-CD2 4Å; R65-Y69 HydrophobicContact CG-CE2 3.57Å; R65-Y69 WeakPolarHBondContact O-CD2 3.45Å; R65-Y69 PolarHBondContact O-N 3.42Å; R66-Y69 PolarHBondContact O-N 2.87Å; V67-Y69 VanDerWaalsContact C-N 3.28Å; V67-Y69 PolarHBondContact O-N 3.26Å; Y69-F79 AromaticContact CD2-CZ 3.96Å; Y69-F79 HydrophobicContact CD2-CZ 3.96Å; Y69-F79 HydrophobicContact CG-CE2 4.22Å; Y69-F79 AromaticContact CG-CZ 3.73Å; Y69-F79 HydrophobicContact CG-CZ 3.73Å
70S57.1Low53.7Low12 Ų1287.8 Ų87.88%0.08445%0.453CS..Hα-helixtrans-79.2-24.6174.434.30000112.3R66 V67R66-S70 PolarHBondContact O-N 3.32Å; R66-S70 PolarHBondContact O-OG 2.95Å; V67-S70 WeakPolarHBondContact CA-OG 3.48Å; V67-S70 PolarHBondContact O-N 2.9Å; V67-S70 VanDerWaalsContact O-N 3.11Å; V67-S70 PolarHBondContact O-OG 3.28Å
71M56.5Low53.2Low83 Ų8386 Ų8641%0.40944%0.442SS..Hα-helixtrans-74.1-25.8170.9-69.9-171.971.900113.9V67 V179 P182V67-M71 PolarHBondContact O-N 3.3Å; M71-V179 HydrophobicContact CG-CG2 3.86Å; M71-P182 HydrophobicContact CE-CG 4.45Å
72V52.8Low53Low87 Ų8790.1 Ų90.153%0.52745%0.448SS..SBendtrans-116.899.7-178.4-175.20000109.4L68 R74L68-V72 PolarHBondContact O-N 3.39Å; V72-R74 VanDerWaalsContact C-N 3.35Å; V72-R74 PolarHBondContact O-N 3.04Å
73P46.8Very low52.4Low63 Ų6389.5 Ų89.541%0.40945%0.446SS..  trans-71.190.8-177.429-32000109.3L75 L212P73-L75 PolarHBondContact O-N 3.25Å; P73-L75 VanDerWaalsContact O-N 3.12Å; P73-L212 HydrophobicContact CB-CD1 4.43Å
74R46.6Very low52.1Low196 Ų19688.9 Ų88.974%0.7444%0.442SS*.  trans-74.498.8161.5-77.6-168.9174.7-178.6-0.2107.4V72 N76V72-R74 VanDerWaalsContact C-N 3.35Å; V72-R74 PolarHBondContact O-N 3.04Å; R74-N76 PolarHBondContact O-N 3.25Å
75L45.8Very low51.6Low148 Ų14892.8 Ų92.878%0.77545%0.447SS*.THydrogen-bonded Turntrans-52.7-0.2-176.7-76.5106.1000117P73P73-L75 PolarHBondContact O-N 3.25Å; P73-L75 VanDerWaalsContact O-N 3.12Å
76N43.4Very low51.4Low151 Ų15189.3 Ų89.381%0.80745%0.447SS*.THydrogen-bonded Turntrans-1228.2-163.7-106.7-4.3000116.5R74R74-N76 PolarHBondContact O-N 3.25Å
77M43Very low51.1Low141 Ų14193.8 Ų93.870%0.69547%0.469SS*.SBendtrans-137.2121.9-180-68.7-82.3160.300110.4F79M77-F79 PolarHBondContact O-N 2.91Å
78N49.8Very low51Low93 Ų9393.5 Ų93.550%0.49747%0.468SS..  trans-61.492.8176.6-72.1-41000110.3I80 T81 P216N78-I80 PolarHBondContact O-N 3.49Å; N78-I80 VanDerWaalsContact O-N 3.13Å; N78-T81 PolarHBondContact O-N 2.93Å; N78-T81 VanDerWaalsContact O-N 3.14Å; N78-P216 WeakPolarHBondContact OD1-CG 3.27Å
79F48.1Very low51.7Low68 Ų6888 Ų8830%0.29844%0.439SS..Hα-helixtrans-53.9-36.1-174.3-129.1-87.8000113.3Y69 M77 S83Y69-F79 AromaticContact CD2-CZ 3.96Å; Y69-F79 HydrophobicContact CD2-CZ 3.96Å; Y69-F79 HydrophobicContact CG-CE2 4.22Å; Y69-F79 AromaticContact CG-CZ 3.73Å; Y69-F79 HydrophobicContact CG-CZ 3.73Å; M77-F79 PolarHBondContact O-N 2.91Å; F79-S83 PolarHBondContact O-N 2.81Å
80I49.4Very low52.2Low2 Ų285.8 Ų85.81%0.0143%0.433CS..Hα-helixtrans-75.3-37.7-177.4-54.2-165.3000112.2N78 Q82 I84 Y164N78-I80 PolarHBondContact O-N 3.49Å; N78-I80 VanDerWaalsContact O-N 3.13Å; I80-Q82 PolarHBondContact O-N 3.38Å; I80-I84 HydrophobicContact CG1-CD1 4.23Å; I80-I84 HydrophobicContact CG2-CB 4.49Å; I80-I84 HydrophobicContact CG2-CD1 4.44Å; I80-Y164 HydrophobicContact CB-CD1 4.45Å; I80-Y164 HydrophobicContact CB-CE1 3.76Å; I80-Y164 HydrophobicContact CD1-CD1 4.19Å; I80-Y164 HydrophobicContact CD1-CD2 3.98Å; I80-Y164 HydrophobicContact CD1-CE1 4.02Å; I80-Y164 HydrophobicContact CD1-CE2 3.75Å; I80-Y164 HydrophobicContact CD1-CG 4.19Å; I80-Y164 HydrophobicContact CG1-CE1 4.45Å; I80-Y164 HydrophobicContact CG2-CD1 3.56Å; I80-Y164 HydrophobicContact CG2-CE1 3.23Å; I80-Y164 HydrophobicContact CG2-CG 4.49Å
81T48.7Very low53.1Low69 Ų6988.2 Ų88.242%0.42344%0.443SS..Hα-helixtrans-71.7-31.7-174.5-49.80000112.9N78N78-T81 PolarHBondContact O-N 2.93Å; N78-T81 VanDerWaalsContact O-N 3.14Å
82Q46.5Very low54.1Low165 Ų16584.3 Ų84.377%0.77142%0.424SS*.Hα-helixtrans-109.6-15-170.1-156.5148.3-5.200114.9I80I80-Q82 PolarHBondContact O-N 3.38Å
83S48.3Very low55.6Low46 Ų4680.7 Ų80.732%0.32240%0.402SS..Hα-helixtrans-117.2-18.4-179.5-72.60000115.7R66 F79R66-S83 PolarHBondContact NH2-O 3.35Å; F79-S83 PolarHBondContact O-N 2.81Å
84I50.7Low57.5Low7 Ų781.9 Ų81.94%0.03640%0.4CS..THydrogen-bonded Turntrans-109.1-23.3-170-56-178.7000113I80 P86 H87 P88 E168I80-I84 HydrophobicContact CG1-CD1 4.23Å; I80-I84 HydrophobicContact CG2-CB 4.49Å; I80-I84 HydrophobicContact CG2-CD1 4.44Å; I84-P86 VanDerWaalsContact C-CD 3.45Å; I84-H87 PolarHBondContact O-N 3.14Å; I84-P88 HydrophobicContact CG2-CB 4.11Å; I84-E168 HydrophobicContact CG2-CB 4.28Å; I84-E168 HydrophobicContact CG2-CG 3.81Å
85R46.3Very low59.5Low169 Ų16978 Ų7864%0.63839%0.386SS*.SBendtrans-64.1-22.5-171.3-73.1-152.1-165.9-126.96.3118
86P53.7Low61.5Low97 Ų9771.5 Ų71.563%0.6335%0.352SS*.SBendtrans-76.3-45.1176.5-15.329.7000112.4I84I84-P86 VanDerWaalsContact C-CD 3.45Å
87H56.6Low63.8Low126 Ų12664.3 Ų64.358%0.58331%0.314SS*.  trans-152.396.2-175.6-67-67.9000111.1I84 D89I84-H87 PolarHBondContact O-N 3.14Å; H87-D89 PolarHBondContact O-N 3.45Å
88P62.4Low66.2Low26 Ų2660.9 Ų60.917%0.16930%0.298CS..  trans-67.3119.7171.326-34.3000110.2F55 I84 L167 E168F55-P88 WeakPolarHBondContact CD1-O 3.38Å; I84-P88 HydrophobicContact CG2-CB 4.11Å; P88-L167 HydrophobicContact CB-CD2 3.63Å; P88-L167 HydrophobicContact CB-CG 4.22Å; P88-L167 HydrophobicContact CG-CD2 3.51Å; P88-L167 WeakPolarHBondContact O-CD2 3.25Å; P88-E168 HydrophobicContact CB-CG 4.25Å
89D70.6Confident68.3Low2 Ų259.3 Ų59.31%0.01129%0.291CS..  trans-107.5140.8-17254.4-51.8000113.4V58 R66 H87 C171 Y175V58-D89 HydrophobicContact CG2-CB 3.29Å; R66-D89 IonicContact CZ-OD1 3.85Å; R66-D89 IonicContact NH1-OD1 2.68Å; R66-D89 PolarHBondContact NH1-OD1 3.13Å; R66-D89 IonicContact NH1-OD2 3.52Å; H87-D89 PolarHBondContact O-N 3.45Å; D89-C171 PolarHBondContact O-SG 3.01Å; D89-C171 VanDerWaalsContact O-SG 3.38Å; D89-C171 PolarHBondContact OD1-SG 3.3Å; D89-Y175 PolarHBondContact OD2-OH 3Å
90L73.8Confident70.4Confident51 Ų5156.6 Ų56.627%0.26728%0.28SS..SBendtrans-98-15.3176.8-14177.8000112.6F55 F56 P93 F94 L167 I170F55-L90 PolarHBondContact O-N 3.29Å; F55-L90 VanDerWaalsContact O-N 3.08Å; F56-L90 HydrophobicContact CE2-CB 4.48Å; L90-P93 WeakPolarHBondContact O-CD 3.46Å; L90-F94 WeakPolarHBondContact O-CB 3.48Å; L90-F94 PolarHBondContact O-N 3.36Å; L90-L167 HydrophobicContact CD1-CD1 3.67Å; L90-L167 HydrophobicContact CD1-CG 4.41Å; L90-I170 HydrophobicContact CD1-CG2 4.03Å
91F75.3Confident72.6Confident63 Ų6357.5 Ų57.528%0.27629%0.285SS..Hα-helixtrans-56.7-52.5178.2-172.7-91.2000111.5F56 F94 W95F56-F91 HydrophobicContact CD1-CB 4.36Å; F56-F91 AromaticContact CD1-CD2 3.72Å; F56-F91 HydrophobicContact CD1-CD2 3.72Å; F56-F91 HydrophobicContact CE1-CD2 4.34Å; F91-F94 PolarHBondContact O-N 2.88Å; F91-W95 AromaticContact CD1-CD1 3.47Å; F91-W95 VanDerWaalsContact CD1-CD1 3.47Å; F91-W95 HydrophobicContact CD1-CG 4.46Å; F91-W95 AromaticContact CD2-CD1 3.49Å; F91-W95 VanDerWaalsContact CD2-CD1 3.49Å; F91-W95 AromaticContact CD2-NE1 3.29Å; F91-W95 VanDerWaalsContact CD2-NE1 3.29Å; F91-W95 AromaticContact CE1-CD1 3.35Å; F91-W95 HydrophobicContact CE1-CG 4.16Å; F91-W95 AromaticContact CE1-NE1 3.72Å; F91-W95 AromaticContact CE2-CD1 3.4Å; F91-W95 VanDerWaalsContact CE2-CD1 3.4Å; F91-W95 AromaticContact CE2-CE2 3.92Å; F91-W95 AromaticContact CE2-NE1 2.9Å; F91-W95 AromaticContact CG-CD1 3.53Å; F91-W95 AromaticContact CG-NE1 3.86Å; F91-W95 AromaticContact CZ-CD1 3.31Å; F91-W95 AromaticContact CZ-CE2 3.95Å; F91-W95 HydrophobicContact CZ-CG 4.22Å; F91-W95 AromaticContact CZ-NE1 3.13Å; F91-W95 PolarHBondContact O-N 3.4Å
92G77.6Confident74.7Confident1 Ų161.1 Ų61.11%0.0130%0.295CS..Hα-helixtrans-53.9-61-179.500000113F94 W95 I96G92-F94 VanDerWaalsContact C-N 3.31Å; G92-F94 PolarHBondContact O-N 2.94Å; G92-W95 PolarHBondContact O-N 2.8Å; G92-I96 WeakPolarHBondContact O-CB 3.27Å; G92-I96 WeakPolarHBondContact O-CG1 3.35Å; G92-I96 PolarHBondContact O-N 3.41Å
93P84Confident77Confident10 Ų1054.2 Ų54.27%0.06526%0.264CS..Hα-helixtrans-52.4-44.4178.1-29.634.8000114.4L90 A97 I170L90-P93 WeakPolarHBondContact O-CD 3.46Å; P93-A97 WeakPolarHBondContact O-CB 3.36Å; P93-A97 PolarHBondContact O-N 3.48Å; P93-I170 HydrophobicContact CB-CG2 4.35Å; P93-I170 HydrophobicContact CG-CG2 4.48Å
94F87.2Confident79.1Confident88 Ų8852.3 Ų52.339%0.38625%0.252SS..Hα-helixtrans-64.9-48.1-178.6175.6-101.3000111.8L90 F91 G92 A97 L98 F141L90-F94 WeakPolarHBondContact O-CB 3.48Å; L90-F94 PolarHBondContact O-N 3.36Å; F91-F94 PolarHBondContact O-N 2.88Å; G92-F94 VanDerWaalsContact C-N 3.31Å; G92-F94 PolarHBondContact O-N 2.94Å; F94-A97 PolarHBondContact O-N 3.31Å; F94-L98 PolarHBondContact O-N 3.26Å; F94-F141 HydrophobicContact CD2-CE1 4.15Å; F94-F141 HydrophobicContact CD2-CZ 4.43Å; F94-F141 HydrophobicContact CE2-CE1 4.4Å; F94-F141 HydrophobicContact CE2-CZ 4.31Å
95W87.6Confident81.1Confident114 Ų11453.6 Ų53.643%0.43226%0.26SS..Hα-helixtrans-71.1-34.1179.9-75.5107.4000113.1F91 G92 L98 T99F91-W95 AromaticContact CD1-CD1 3.47Å; F91-W95 VanDerWaalsContact CD1-CD1 3.47Å; F91-W95 HydrophobicContact CD1-CG 4.46Å; F91-W95 AromaticContact CD2-CD1 3.49Å; F91-W95 VanDerWaalsContact CD2-CD1 3.49Å; F91-W95 AromaticContact CD2-NE1 3.29Å; F91-W95 VanDerWaalsContact CD2-NE1 3.29Å; F91-W95 AromaticContact CE1-CD1 3.35Å; F91-W95 HydrophobicContact CE1-CG 4.16Å; F91-W95 AromaticContact CE1-NE1 3.72Å; F91-W95 AromaticContact CE2-CD1 3.4Å; F91-W95 VanDerWaalsContact CE2-CD1 3.4Å; F91-W95 AromaticContact CE2-CE2 3.92Å; F91-W95 AromaticContact CE2-NE1 2.9Å; F91-W95 AromaticContact CG-CD1 3.53Å; F91-W95 AromaticContact CG-NE1 3.86Å; F91-W95 AromaticContact CZ-CD1 3.31Å; F91-W95 AromaticContact CZ-CE2 3.95Å; F91-W95 HydrophobicContact CZ-CG 4.22Å; F91-W95 AromaticContact CZ-NE1 3.13Å; F91-W95 PolarHBondContact O-N 3.4Å; G92-W95 PolarHBondContact O-N 2.8Å; W95-L98 HydrophobicContact CE3-CD2 3.77Å; W95-L98 HydrophobicContact CZ3-CD2 3.6Å; W95-L98 PolarHBondContact O-N 2.78Å; W95-T99 WeakPolarHBondContact O-CB 3.38Å; W95-T99 WeakPolarHBondContact O-CG2 3.39Å; W95-T99 PolarHBondContact O-N 2.82Å; W95-T99 PolarHBondContact O-OG1 3.43Å
96I88.7Confident83.2Confident12 Ų1248.3 Ų48.36%0.06225%0.247CC..Hα-helixtrans-63.8-43.6172.9-69.4168.9000110.1V67 G92 L98 T99 L100 G174 Y175 L177 I181V67-I96 HydrophobicContact CG2-CD1 3.87Å; G92-I96 WeakPolarHBondContact O-CB 3.27Å; G92-I96 WeakPolarHBondContact O-CG1 3.35Å; G92-I96 PolarHBondContact O-N 3.41Å; I96-L98 VanDerWaalsContact C-N 3.34Å; I96-L98 PolarHBondContact O-N 3.12Å; I96-T99 WeakPolarHBondContact CA-OG1 3.12Å; I96-T99 PolarHBondContact O-N 3.01Å; I96-T99 PolarHBondContact O-OG1 3.39Å; I96-L100 WeakPolarHBondContact O-CB 3.28Å; I96-L100 PolarHBondContact O-N 3.41Å; I96-G174 WeakPolarHBondContact CG2-O 3.43Å; I96-Y175 HydrophobicContact CD1-CD1 3.68Å; I96-Y175 HydrophobicContact CD1-CE1 4.16Å; I96-Y175 HydrophobicContact CD1-CG 4.4Å; I96-L177 HydrophobicContact CG2-CB 3.92Å; I96-I181 HydrophobicContact CG2-CD1 4.38Å
97A92.4Very high84.9Confident1 Ų143.7 Ų43.71%0.00822%0.217CC..Hα-helixtrans-61.9-41.6175.100000112.1P93 F94 L100 L101 I140 F141P93-A97 WeakPolarHBondContact O-CB 3.36Å; P93-A97 PolarHBondContact O-N 3.48Å; F94-A97 PolarHBondContact O-N 3.31Å; A97-L100 PolarHBondContact O-N 3.36Å; A97-L101 PolarHBondContact O-N 2.91Å; A97-I140 HydrophobicContact CB-CG2 4Å; A97-F141 HydrophobicContact CB-CD1 4.19Å; A97-F141 HydrophobicContact CB-CE1 3.73Å; A97-F141 HydrophobicContact CB-CZ 4.03Å
98L92.8Very high86.4Confident68 Ų6839.6 Ų39.636%0.35620%0.199SC..Hα-helixtrans-67.4-44.8179-170.968.1000112.6F94 W95 I96 L100 L101 F102F94-L98 PolarHBondContact O-N 3.26Å; W95-L98 HydrophobicContact CE3-CD2 3.77Å; W95-L98 HydrophobicContact CZ3-CD2 3.6Å; W95-L98 PolarHBondContact O-N 2.78Å; I96-L98 VanDerWaalsContact C-N 3.34Å; I96-L98 PolarHBondContact O-N 3.12Å; L98-L100 VanDerWaalsContact C-N 3.32Å; L98-L101 WeakPolarHBondContact O-CB 3.33Å; L98-L101 PolarHBondContact O-N 3.1Å; L98-F102 PolarHBondContact O-N 2.8Å
99T93Very high87.6Confident60 Ų6041.2 Ų41.237%0.36821%0.205SC..Hα-helixtrans-65.8-36.8176.447.60000111.7W95 I96 F102 T103W95-T99 WeakPolarHBondContact O-CB 3.38Å; W95-T99 WeakPolarHBondContact O-CG2 3.39Å; W95-T99 PolarHBondContact O-N 2.82Å; W95-T99 PolarHBondContact O-OG1 3.43Å; I96-T99 WeakPolarHBondContact CA-OG1 3.12Å; I96-T99 PolarHBondContact O-N 3.01Å; I96-T99 PolarHBondContact O-OG1 3.39Å; T99-F102 PolarHBondContact O-N 3.25Å; T99-T103 WeakPolarHBondContact O-CB 3.46Å; T99-T103 WeakPolarHBondContact O-CG2 3.41Å; T99-T103 PolarHBondContact O-N 3.08Å; T99-T103 PolarHBondContact O-OG1 3.36Å
100L93.3Very high88.5Confident11 Ų1144.9 Ų44.96%0.05822%0.224CC..Hα-helixtrans-61.9-45.3171.7177.257.2000111.7I96 A97 L98 F102 T103 A104 I140 F180 I181I96-L100 WeakPolarHBondContact O-CB 3.28Å; I96-L100 PolarHBondContact O-N 3.41Å; A97-L100 PolarHBondContact O-N 3.36Å; L98-L100 VanDerWaalsContact C-N 3.32Å; L100-F102 VanDerWaalsContact C-N 3.33Å; L100-F102 PolarHBondContact O-N 2.92Å; L100-T103 WeakPolarHBondContact CA-OG1 3.5Å; L100-T103 PolarHBondContact O-N 3.26Å; L100-T103 PolarHBondContact O-OG1 2.96Å; L100-T103 VanDerWaalsContact O-OG1 3.07Å; L100-A104 WeakPolarHBondContact O-CB 3.11Å; L100-A104 PolarHBondContact O-N 3.35Å; L100-I140 HydrophobicContact CD2-CD1 4.37Å; L100-I140 HydrophobicContact CD2-CG1 4.25Å; L100-I140 HydrophobicContact CD2-CG2 4.01Å; L100-I140 HydrophobicContact CG-CD1 4.01Å; L100-I140 HydrophobicContact CG-CG1 4.43Å; L100-F180 HydrophobicContact CD1-CB 3.48Å; L100-F180 VanDerWaalsContact CD1-CB 3.48Å; L100-F180 WeakPolarHBondContact CD1-O 3.5Å; L100-F180 HydrophobicContact CD2-CB 3.68Å; L100-F180 HydrophobicContact CD2-CG 4.39Å; L100-F180 HydrophobicContact CG-CB 4.23Å; L100-I181 HydrophobicContact CB-CG1 4.3Å
101L95Very high89.1Confident22 Ų2242.5 Ų42.512%0.11521%0.212CC..Hα-helixtrans-59.3-46176.4175.262.1000111.4A97 L98 A104 C105 V133 M136 A137 I140A97-L101 PolarHBondContact O-N 2.91Å; L98-L101 WeakPolarHBondContact O-CB 3.33Å; L98-L101 PolarHBondContact O-N 3.1Å; L101-A104 PolarHBondContact O-N 3.47Å; L101-C105 PolarHBondContact O-N 2.85Å; L101-C105 PolarHBondContact O-SG 3.18Å; L101-V133 HydrophobicContact CD1-CG1 4.46Å; L101-M136 HydrophobicContact CD1-CB 3.77Å; L101-A137 HydrophobicContact CD1-CB 3.98Å; L101-A137 HydrophobicContact CD2-CB 3.64Å; L101-A137 HydrophobicContact CG-CB 4.46Å; L101-I140 HydrophobicContact CB-CD1 3.94Å; L101-I140 HydrophobicContact CD1-CD1 4.08Å
102F93.3Very high89.6Confident144 Ų14443.9 Ų43.963%0.63222%0.22SC*.Hα-helixtrans-61.8-51.4178.5179.5-99.4000111.7L98 T99 L100 A104 C105 V106L98-F102 PolarHBondContact O-N 2.8Å; T99-F102 PolarHBondContact O-N 3.25Å; L100-F102 VanDerWaalsContact C-N 3.33Å; L100-F102 PolarHBondContact O-N 2.92Å; F102-A104 VanDerWaalsContact C-N 3.32Å; F102-A104 PolarHBondContact O-N 3.46Å; F102-C105 PolarHBondContact O-N 3.45Å; F102-V106 HydrophobicContact CD1-CG2 4.29Å; F102-V106 HydrophobicContact CE1-CG2 3.86Å; F102-V106 HydrophobicContact CE2-CG2 4.26Å; F102-V106 HydrophobicContact CZ-CG2 3.84Å; F102-V106 WeakPolarHBondContact O-CG2 3.46Å; F102-V106 PolarHBondContact O-N 3.05Å
103T93.8Very high89.9Confident20 Ų2047.4 Ų47.412%0.12324%0.237CC..Hα-helixtrans-64.5-34.8179.550.20000112.8T99 L100 V106 G107 I181 S184 L185T99-T103 WeakPolarHBondContact O-CB 3.46Å; T99-T103 WeakPolarHBondContact O-CG2 3.41Å; T99-T103 PolarHBondContact O-N 3.08Å; T99-T103 PolarHBondContact O-OG1 3.36Å; L100-T103 WeakPolarHBondContact CA-OG1 3.5Å; L100-T103 PolarHBondContact O-N 3.26Å; L100-T103 PolarHBondContact O-OG1 2.96Å; L100-T103 VanDerWaalsContact O-OG1 3.07Å; T103-V106 PolarHBondContact O-N 3.25Å; T103-G107 PolarHBondContact O-N 2.99Å; T103-I181 HydrophobicContact CG2-CG2 4.01Å; T103-S184 VanDerWaalsContact CB-OG 3.24Å; T103-S184 WeakPolarHBondContact CB-OG 3.36Å; T103-S184 PolarHBondContact OG1-OG 3.33Å; T103-L185 HydrophobicContact CG2-CD2 4.24Å; T103-L185 HydrophobicContact CG2-CG 4.41Å
104A92.9Very high90Very high7 Ų749.9 Ų49.96%0.05825%0.249CC..Hα-helixtrans-65.3-40.5173.200000112.3L100 L101 F102 N108 W187L100-A104 WeakPolarHBondContact O-CB 3.11Å; L100-A104 PolarHBondContact O-N 3.35Å; L101-A104 PolarHBondContact O-N 3.47Å; F102-A104 VanDerWaalsContact C-N 3.32Å; F102-A104 PolarHBondContact O-N 3.46Å; A104-N108 WeakPolarHBondContact O-CB 3.49Å; A104-N108 PolarHBondContact O-N 2.95Å; A104-W187 HydrophobicContact CB-CZ3 4.45Å
105C92.3Very high89.9Confident33 Ų3350.1 Ų50.122%0.22325%0.254CS..Hα-helixtrans-64.2-47174.6-67.80000111.2L101 F102 N108 Q109L101-C105 PolarHBondContact O-N 2.85Å; L101-C105 PolarHBondContact O-SG 3.18Å; F102-C105 PolarHBondContact O-N 3.45Å; C105-N108 PolarHBondContact O-N 2.92Å; C105-Q109 WeakPolarHBondContact O-CB 3.41Å; C105-Q109 PolarHBondContact O-N 3.42Å
106V90.5Very high89.8Confident58 Ų5845.7 Ų45.735%0.35224%0.242SC..Hα-helixtrans-62.1-46.7177.5173.50000111.1F102 T103 N108 Q109 L110F102-V106 HydrophobicContact CD1-CG2 4.29Å; F102-V106 HydrophobicContact CE1-CG2 3.86Å; F102-V106 HydrophobicContact CE2-CG2 4.26Å; F102-V106 HydrophobicContact CZ-CG2 3.84Å; F102-V106 WeakPolarHBondContact O-CG2 3.46Å; F102-V106 PolarHBondContact O-N 3.05Å; T103-V106 PolarHBondContact O-N 3.25Å; V106-N108 VanDerWaalsContact C-N 3.35Å; V106-N108 PolarHBondContact O-N 3.02Å; V106-Q109 PolarHBondContact O-N 2.69Å; V106-L110 WeakPolarHBondContact O-CB 3.04Å; V106-L110 PolarHBondContact O-N 3.11Å
107G90.1Very high89.6Confident1 Ų150 Ų501%0.0126%0.264CS..Hα-helixtrans-60.6-42.5178.200000112.3T103 L110 G111 A188T103-G107 PolarHBondContact O-N 2.99Å; G107-L110 PolarHBondContact O-N 2.74Å; G107-G111 PolarHBondContact O-N 3.32Å; G107-A188 WeakPolarHBondContact O-CA 3.26Å
108N88.4Confident89.2Confident39 Ų3957.3 Ų57.321%0.20930%0.298CS..Hα-helixtrans-62.2-46.3174.4-170.874.9000111.5A104 C105 V106 L110 G111 E112 R195A104-N108 WeakPolarHBondContact O-CB 3.49Å; A104-N108 PolarHBondContact O-N 2.95Å; C105-N108 PolarHBondContact O-N 2.92Å; V106-N108 VanDerWaalsContact C-N 3.35Å; V106-N108 PolarHBondContact O-N 3.02Å; N108-L110 VanDerWaalsContact C-N 3.32Å; N108-L110 PolarHBondContact O-N 3.42Å; N108-G111 PolarHBondContact O-N 2.92Å; N108-E112 PolarHBondContact ND2-OE1 3.38Å; N108-E112 PolarHBondContact O-N 3.09Å; N108-E112 VanDerWaalsContact O-N 3.09Å; N108-R195 PolarHBondContact OD1-NH2 3.44Å
109Q87.5Confident88.5Confident60 Ų6057 Ų5728%0.2831%0.31SS..Hα-helixtrans-62.6-41.4-179.5-171.756.176.800112.4C105 V106 G111 E112 M113C105-Q109 WeakPolarHBondContact O-CB 3.41Å; C105-Q109 PolarHBondContact O-N 3.42Å; V106-Q109 PolarHBondContact O-N 2.69Å; Q109-G111 VanDerWaalsContact C-N 3.34Å; Q109-E112 PolarHBondContact O-N 2.92Å; Q109-M113 PolarHBondContact O-N 3.25Å
110L89.2Confident87.5Confident79 Ų7957.6 Ų57.641%0.41433%0.329SS..Hα-helixtrans-66.9-38.6179.4-157.369.3000110.9V106 G107 N108 M113 L114 A188V106-L110 WeakPolarHBondContact O-CB 3.04Å; V106-L110 PolarHBondContact O-N 3.11Å; G107-L110 PolarHBondContact O-N 2.74Å; N108-L110 VanDerWaalsContact C-N 3.32Å; N108-L110 PolarHBondContact O-N 3.42Å; L110-M113 HydrophobicContact CD1-CE 3.91Å; L110-M113 PolarHBondContact O-N 3.42Å; L110-L114 HydrophobicContact CG-CD1 4.47Å; L110-L114 WeakPolarHBondContact O-CB 3.48Å; L110-L114 VanDerWaalsContact O-CG 3.27Å; L110-L114 WeakPolarHBondContact O-CG 3.34Å; L110-L114 PolarHBondContact O-N 2.63Å; L110-A188 HydrophobicContact CB-CB 4.04Å; L110-A188 HydrophobicContact CD2-CB 4Å; L110-A188 HydrophobicContact CG-CB 4.31Å
111G87.2Confident86.2Confident2 Ų259.1 Ų59.12%0.02135%0.347CS..Hα-helixtrans-67.3-34.3176.100000114.1G107 N108 Q109 N115 A188 N190G107-G111 PolarHBondContact O-N 3.32Å; N108-G111 PolarHBondContact O-N 2.92Å; Q109-G111 VanDerWaalsContact C-N 3.34Å; G111-N115 WeakPolarHBondContact O-CB 3.47Å; G111-N115 PolarHBondContact O-N 2.94Å; G111-N115 VanDerWaalsContact O-N 3.12Å; G111-A188 WeakPolarHBondContact CA-O 3.49Å; G111-N190 PolarHBondContact O-ND2 2.86Å
112E84.7Confident84.7Confident92 Ų9263.2 Ų63.243%0.4337%0.373SS..Hα-helixtrans-66.2-45.1171-72.3176-167.900111.4N108 Q109 N115 A116N108-E112 PolarHBondContact ND2-OE1 3.38Å; N108-E112 PolarHBondContact O-N 3.09Å; N108-E112 VanDerWaalsContact O-N 3.09Å; Q109-E112 PolarHBondContact O-N 2.92Å; E112-N115 PolarHBondContact O-N 3.36Å; E112-A116 PolarHBondContact O-N 3.08Å
113M84.9Confident83.3Confident75 Ų7560.7 Ų60.737%0.36937%0.369SS..Hα-helixtrans-61.1-48.1177.6-174.3-162.58000111.7Q109 L110 N115 A116 I117Q109-M113 PolarHBondContact O-N 3.25Å; L110-M113 HydrophobicContact CD1-CE 3.91Å; L110-M113 PolarHBondContact O-N 3.42Å; M113-N115 VanDerWaalsContact C-N 3.3Å; M113-N115 PolarHBondContact O-N 2.94Å; M113-A116 PolarHBondContact O-N 2.89Å; M113-I117 HydrophobicContact CE-CD1 4.01Å; M113-I117 HydrophobicContact CG-CD1 3.98Å; M113-I117 WeakPolarHBondContact O-CG1 3.28Å; M113-I117 PolarHBondContact O-N 3.26Å; M113-I117 HydrophobicContact SD-CD1 4.46Å
114L86.2Confident81.7Confident62 Ų6267 Ų6733%0.32540%0.397SS..Hα-helixtrans-61.2-40.4179.1-73171.4000111.4L110 I117 H118 A188L110-L114 HydrophobicContact CG-CD1 4.47Å; L110-L114 WeakPolarHBondContact O-CB 3.48Å; L110-L114 VanDerWaalsContact O-CG 3.27Å; L110-L114 WeakPolarHBondContact O-CG 3.34Å; L110-L114 PolarHBondContact O-N 2.63Å; L114-I117 PolarHBondContact O-N 3.49Å; L114-H118 PolarHBondContact O-N 3.18Å; L114-H118 PolarHBondContact O-ND1 3.45Å; L114-A188 HydrophobicContact CD1-CB 4.45Å
115N84.5Confident80Confident92 Ų9275.1 Ų75.149%0.49243%0.434SS..Hα-helixtrans-67.5-38.6177.6-163.521.2000112G111 E112 M113 I117 H118 G119G111-N115 WeakPolarHBondContact O-CB 3.47Å; G111-N115 PolarHBondContact O-N 2.94Å; G111-N115 VanDerWaalsContact O-N 3.12Å; E112-N115 PolarHBondContact O-N 3.36Å; M113-N115 VanDerWaalsContact C-N 3.3Å; M113-N115 PolarHBondContact O-N 2.94Å; N115-I117 PolarHBondContact O-N 3.3Å; N115-H118 PolarHBondContact O-N 3.38Å; N115-G119 WeakPolarHBondContact O-CA 3.37Å; N115-G119 PolarHBondContact O-N 2.9Å
116A84.8Confident78.6Confident22 Ų2275.7 Ų75.718%0.18244%0.44CS..Hα-helixtrans-61.1-43.8175.100000111.9E112 M113 G120 G121 V123E112-A116 PolarHBondContact O-N 3.08Å; M113-A116 PolarHBondContact O-N 2.89Å; A116-G120 PolarHBondContact O-N 3.05Å; A116-G121 PolarHBondContact O-N 2.78Å; A116-G121 VanDerWaalsContact O-N 3.09Å; A116-V123 HydrophobicContact CB-CG2 4.45Å
117I84.5Confident77.6Confident101 Ų10178.6 Ų78.652%0.51846%0.458SS..Hα-helixtrans-65-46.3179.1-65.7165.7000111.6M113 L114 N115M113-I117 HydrophobicContact CE-CD1 4.01Å; M113-I117 HydrophobicContact CG-CD1 3.98Å; M113-I117 WeakPolarHBondContact O-CG1 3.28Å; M113-I117 PolarHBondContact O-N 3.26Å; M113-I117 HydrophobicContact SD-CD1 4.46Å; L114-I117 PolarHBondContact O-N 3.49Å; N115-I117 PolarHBondContact O-N 3.3Å
118H83.5Confident76.8Confident156 Ų15683.4 Ų83.472%0.72248%0.483SS*.Hα-helixtrans-77.7-31.6-177.7-68.887.7000113.2L114 N115 G120L114-H118 PolarHBondContact O-N 3.18Å; L114-H118 PolarHBondContact O-ND1 3.45Å; N115-H118 PolarHBondContact O-N 3.38Å; H118-G120 VanDerWaalsContact C-N 3.32Å
119G79.4Confident76.7Confident60 Ų6086.4 Ų86.462%0.61950%0.499SS*.THydrogen-bonded Turntrans-84-0-178.900000114.7N115 G121N115-G119 WeakPolarHBondContact O-CA 3.37Å; N115-G119 PolarHBondContact O-N 2.9Å; G119-G121 PolarHBondContact O-N 3.03Å
120G71.2Confident76.8Confident74 Ų7491.8 Ų91.876%0.76352%0.522SS*.THydrogen-bonded Turntrans67.216.9-177.400000114.2A116 H118A116-G120 PolarHBondContact O-N 3.05Å; H118-G120 VanDerWaalsContact C-N 3.32Å
121G66.5Low76.9Confident42 Ų4298.1 Ų98.143%0.43354%0.54SS..  trans-82.5152.4178.600000112.1A116 G119 V123A116-G121 PolarHBondContact O-N 2.78Å; A116-G121 VanDerWaalsContact O-N 3.09Å; G119-G121 PolarHBondContact O-N 3.03Å; G121-V123 PolarHBondContact O-N 2.94Å
122T63.2Low77Confident108 Ų108101.7 Ų101.766%0.66356%0.558SS**  trans-57.6128.9168.344.40000109.9H124T122-H124 VanDerWaalsContact C-N 3.27Å; T122-H124 PolarHBondContact O-N 2.9Å
123V63.7Low77.4Confident91 Ų9199 Ų9955%0.55255%0.548SS*.  trans-62.894.2169.2-177.30000106.9A116 G121 H125A116-V123 HydrophobicContact CB-CG2 4.45Å; G121-V123 PolarHBondContact O-N 2.94Å; V123-H125 PolarHBondContact O-N 2.83Å
124H60.2Low77.8Confident154 Ų15499.6 Ų99.671%0.71356%0.556SS**  trans-62.3125.9168.6-80.7-43.9000107T122 A126T122-H124 VanDerWaalsContact C-N 3.27Å; T122-H124 PolarHBondContact O-N 2.9Å; H124-A126 VanDerWaalsContact C-N 3.32Å; H124-A126 PolarHBondContact O-N 3.5Å
125H58.4Low78.2Confident177 Ų177101.5 Ų101.582%0.81957%0.566SS**  trans-52.8106.7166.6-67.1-64000106.5V123 V127V123-H125 PolarHBondContact O-N 2.83Å; H125-V127 VanDerWaalsContact C-N 3.26Å; H125-V127 VanDerWaalsContact O-CG2 3.28Å; H125-V127 WeakPolarHBondContact O-CG2 3.45Å; H125-V127 PolarHBondContact O-N 3.42Å
126A61.1Low78.7Confident44 Ų44100.1 Ų100.136%0.36456%0.557SS.*  trans-77.792-170.500000107.8H124 L128H124-A126 VanDerWaalsContact C-N 3.32Å; H124-A126 PolarHBondContact O-N 3.5Å; A126-L128 PolarHBondContact O-N 3.42Å
127V70.8Confident79.1Confident119 Ų119100 Ų10072%0.72156%0.556SS**  trans-68.5117.1177.3-153.40000105.8H125 N129H125-V127 VanDerWaalsContact C-N 3.26Å; H125-V127 VanDerWaalsContact O-CG2 3.28Å; H125-V127 WeakPolarHBondContact O-CG2 3.45Å; H125-V127 PolarHBondContact O-N 3.42Å; V127-N129 PolarHBondContact O-N 3.05Å
128L73.4Confident79.6Confident103 Ų10398.4 Ų98.454%0.53955%0.554SS.*  trans-62.699.8-178.2-132.7159.2000108.1A126 F130 V133A126-L128 PolarHBondContact O-N 3.42Å; L128-F130 PolarHBondContact O-N 2.76Å; L128-V133 HydrophobicContact CD2-CG2 3.07Å
129N85.5Confident80.1Confident102 Ų10295.1 Ų95.155%0.54555%0.545SS..  trans-71104.8-177.8-92.7-52.6000108.9V127 R131 I132 V133V127-N129 PolarHBondContact O-N 3.05Å; N129-R131 PolarHBondContact O-N 3.35Å; N129-I132 HydrophobicContact CB-CB 4.3Å; N129-I132 HydrophobicContact CB-CD1 3.87Å; N129-I132 HydrophobicContact CB-CG1 3.91Å; N129-I132 PolarHBondContact O-N 3Å; N129-V133 PolarHBondContact O-N 3.22Å
130F88.8Confident80.8Confident172 Ų17293.2 Ų93.275%0.75452%0.52SS*.Hα-helixtrans-51.1-34.2178.6-66.5-72.7000112.4L128 I132 V133 T134L128-F130 PolarHBondContact O-N 2.76Å; F130-I132 VanDerWaalsContact C-N 3.35Å; F130-I132 PolarHBondContact O-N 3.46Å; F130-V133 PolarHBondContact O-N 2.77Å; F130-T134 WeakPolarHBondContact O-CB 3.37Å; F130-T134 PolarHBondContact O-N 2.75Å; F130-T134 PolarHBondContact O-OG1 3.44Å
131R91.5Very high81.8Confident213 Ų21392.2 Ų92.280%0.80450%0.495SS*.Hα-helixtrans-60.7-41.1176-162.8175.9101.9-145.46.8112.9N129 L135N129-R131 PolarHBondContact O-N 3.35Å; R131-L135 WeakPolarHBondContact O-CB 3.06Å; R131-L135 PolarHBondContact O-N 3.03Å
132I90.6Very high83.1Confident77 Ų7792.6 Ų92.640%0.39549%0.494SS..Hα-helixtrans-70.7-44.4179.5-60.6178.1000109.3N129 F130 T134 L135 M136N129-I132 HydrophobicContact CB-CB 4.3Å; N129-I132 HydrophobicContact CB-CD1 3.87Å; N129-I132 HydrophobicContact CB-CG1 3.91Å; N129-I132 PolarHBondContact O-N 3Å; F130-I132 VanDerWaalsContact C-N 3.35Å; F130-I132 PolarHBondContact O-N 3.46Å; I132-T134 PolarHBondContact O-N 3.31Å; I132-L135 WeakPolarHBondContact O-CB 3.35Å; I132-L135 PolarHBondContact O-N 3.4Å; I132-M136 HydrophobicContact CG2-CE 4.16Å; I132-M136 HydrophobicContact CG2-CG 4.43Å; I132-M136 WeakPolarHBondContact O-CG 3.34Å; I132-M136 PolarHBondContact O-N 2.92Å
133V92.1Very high84.4Confident35 Ų3590.3 Ų90.321%0.21247%0.474CS..Hα-helixtrans-60.4-46.8177.6-177.30000111.5L101 L128 N129 F130 L135 M136 A137L101-V133 HydrophobicContact CD1-CG1 4.46Å; L128-V133 HydrophobicContact CD2-CG2 3.07Å; N129-V133 PolarHBondContact O-N 3.22Å; F130-V133 PolarHBondContact O-N 2.77Å; V133-L135 VanDerWaalsContact C-N 3.27Å; V133-L135 PolarHBondContact O-N 2.89Å; V133-M136 PolarHBondContact O-N 3.44Å; V133-A137 WeakPolarHBondContact O-CB 2.94Å; V133-A137 PolarHBondContact O-N 3.33Å
134T93.9Very high85.6Confident88 Ų8886.3 Ų86.354%0.5445%0.45SS..Hα-helixtrans-62.6-37.6178.1-58.50000111F130 I132 A137 S138F130-T134 WeakPolarHBondContact O-CB 3.37Å; F130-T134 PolarHBondContact O-N 2.75Å; F130-T134 PolarHBondContact O-OG1 3.44Å; I132-T134 PolarHBondContact O-N 3.31Å; T134-A137 PolarHBondContact O-N 2.69Å; T134-S138 WeakPolarHBondContact O-CB 3.3Å; T134-S138 PolarHBondContact O-N 3.13Å; T134-S138 PolarHBondContact O-OG 3.49Å
135L94.6Very high87Confident101 Ų10184 Ų8453%0.52944%0.438SS..Hα-helixtrans-63.7-47174.4-164.7161.8000110.9R131 I132 V133 A137 S138 V139R131-L135 WeakPolarHBondContact O-CB 3.06Å; R131-L135 PolarHBondContact O-N 3.03Å; I132-L135 WeakPolarHBondContact O-CB 3.35Å; I132-L135 PolarHBondContact O-N 3.4Å; V133-L135 VanDerWaalsContact C-N 3.27Å; V133-L135 PolarHBondContact O-N 2.89Å; L135-A137 VanDerWaalsContact C-N 3.34Å; L135-A137 PolarHBondContact O-N 2.89Å; L135-S138 WeakPolarHBondContact O-CB 3.49Å; L135-S138 PolarHBondContact O-N 3.44Å; L135-V139 HydrophobicContact CD2-CG2 3.84Å; L135-V139 WeakPolarHBondContact O-CG2 3.39Å; L135-V139 PolarHBondContact O-N 3.26Å
136M93.9Very high88.5Confident63 Ų6380.7 Ų80.731%0.3143%0.426SS..Hα-helixtrans-60-44.5176.6-65.7-60174.900111.8L101 I132 V133 S138 V139 I140L101-M136 HydrophobicContact CD1-CB 3.77Å; I132-M136 HydrophobicContact CG2-CE 4.16Å; I132-M136 HydrophobicContact CG2-CG 4.43Å; I132-M136 WeakPolarHBondContact O-CG 3.34Å; I132-M136 PolarHBondContact O-N 2.92Å; V133-M136 PolarHBondContact O-N 3.44Å; M136-S138 VanDerWaalsContact C-N 3.34Å; M136-S138 PolarHBondContact O-N 3.1Å; M136-V139 PolarHBondContact O-N 3.32Å; M136-I140 WeakPolarHBondContact O-CB 3.09Å; M136-I140 VanDerWaalsContact O-CG1 3.29Å; M136-I140 WeakPolarHBondContact O-CG1 3.09Å; M136-I140 PolarHBondContact O-N 3.04Å
137A94.6Very high89.8Confident20 Ų2080 Ų8017%0.16542%0.417CS..Hα-helixtrans-59.6-47.3175.800000110.7L101 V133 T134 L135 V139 I140 F141L101-A137 HydrophobicContact CD1-CB 3.98Å; L101-A137 HydrophobicContact CD2-CB 3.64Å; L101-A137 HydrophobicContact CG-CB 4.46Å; V133-A137 WeakPolarHBondContact O-CB 2.94Å; V133-A137 PolarHBondContact O-N 3.33Å; T134-A137 PolarHBondContact O-N 2.69Å; L135-A137 VanDerWaalsContact C-N 3.34Å; L135-A137 PolarHBondContact O-N 2.89Å; A137-V139 VanDerWaalsContact C-N 3.32Å; A137-V139 PolarHBondContact O-N 3.33Å; A137-I140 PolarHBondContact O-N 3.49Å; A137-F141 WeakPolarHBondContact O-CB 3.46Å; A137-F141 VanDerWaalsContact O-CD2 3.3Å; A137-F141 WeakPolarHBondContact O-CD2 3.48Å; A137-F141 PolarHBondContact O-N 3.31Å
138S94.8Very high90.6Very high68 Ų6874.3 Ų74.348%0.47638%0.383SS..Hα-helixtrans-57.5-46.3178.1-55.50000111T134 L135 M136 A142T134-S138 WeakPolarHBondContact O-CB 3.3Å; T134-S138 PolarHBondContact O-N 3.13Å; T134-S138 PolarHBondContact O-OG 3.49Å; L135-S138 WeakPolarHBondContact O-CB 3.49Å; L135-S138 PolarHBondContact O-N 3.44Å; M136-S138 VanDerWaalsContact C-N 3.34Å; M136-S138 PolarHBondContact O-N 3.1Å; S138-A142 WeakPolarHBondContact O-CA 3.14Å; S138-A142 WeakPolarHBondContact O-CB 3.2Å; S138-A142 PolarHBondContact O-N 3.42Å
139V94.5Very high91.3Very high86 Ų8670.4 Ų70.452%0.52137%0.368SS..Hα-helixtrans-65.6-45.2179.7171.20000111.5L135 M136 A137 Y143L135-V139 HydrophobicContact CD2-CG2 3.84Å; L135-V139 WeakPolarHBondContact O-CG2 3.39Å; L135-V139 PolarHBondContact O-N 3.26Å; M136-V139 PolarHBondContact O-N 3.32Å; A137-V139 VanDerWaalsContact C-N 3.32Å; A137-V139 PolarHBondContact O-N 3.33Å; V139-Y143 WeakPolarHBondContact O-CB 3.29Å; V139-Y143 PolarHBondContact O-N 2.94Å
140I93.4Very high91.4Very high21 Ų2171 Ų7111%0.10837%0.37CS..Hα-helixtrans-64.5-50.5-178.6-69.7164.4000110.7A97 L100 L101 M136 A137 Y143 A144A97-I140 HydrophobicContact CB-CG2 4Å; L100-I140 HydrophobicContact CD2-CD1 4.37Å; L100-I140 HydrophobicContact CD2-CG1 4.25Å; L100-I140 HydrophobicContact CD2-CG2 4.01Å; L100-I140 HydrophobicContact CG-CD1 4.01Å; L100-I140 HydrophobicContact CG-CG1 4.43Å; L101-I140 HydrophobicContact CB-CD1 3.94Å; L101-I140 HydrophobicContact CD1-CD1 4.08Å; M136-I140 WeakPolarHBondContact O-CB 3.09Å; M136-I140 VanDerWaalsContact O-CG1 3.29Å; M136-I140 WeakPolarHBondContact O-CG1 3.09Å; M136-I140 PolarHBondContact O-N 3.04Å; A137-I140 PolarHBondContact O-N 3.49Å; I140-Y143 PolarHBondContact O-N 3.27Å; I140-A144 WeakPolarHBondContact O-CB 3.42Å; I140-A144 PolarHBondContact O-N 2.96Å
141F92.7Very high91.2Very high53 Ų5365 Ų6523%0.23234%0.344CS..Hα-helixtrans-67.9-41.7179.2-78.6-71.5000111.5F94 A97 A137 Y143 A144 F145F94-F141 HydrophobicContact CD2-CE1 4.15Å; F94-F141 HydrophobicContact CD2-CZ 4.43Å; F94-F141 HydrophobicContact CE2-CE1 4.4Å; F94-F141 HydrophobicContact CE2-CZ 4.31Å; A97-F141 HydrophobicContact CB-CD1 4.19Å; A97-F141 HydrophobicContact CB-CE1 3.73Å; A97-F141 HydrophobicContact CB-CZ 4.03Å; A137-F141 WeakPolarHBondContact O-CB 3.46Å; A137-F141 VanDerWaalsContact O-CD2 3.3Å; A137-F141 WeakPolarHBondContact O-CD2 3.48Å; A137-F141 PolarHBondContact O-N 3.31Å; F141-Y143 VanDerWaalsContact C-N 3.3Å; F141-Y143 PolarHBondContact O-N 3.41Å; F141-A144 PolarHBondContact O-N 3.47Å; F141-F145 AromaticContact CD1-CE2 3.99Å; F141-F145 HydrophobicContact CD1-CE2 3.99Å; F141-F145 WeakPolarHBondContact O-CD2 2.94Å; F141-F145 PolarHBondContact O-N 3.2Å
142A93.5Very high90.9Very high50 Ų5055.8 Ų55.841%0.41331%0.311SS..Hα-helixtrans-57.7-45.5173.900000110.7S138 A144 F145 L146S138-A142 WeakPolarHBondContact O-CA 3.14Å; S138-A142 WeakPolarHBondContact O-CB 3.2Å; S138-A142 PolarHBondContact O-N 3.42Å; A142-A144 VanDerWaalsContact C-N 3.34Å; A142-A144 PolarHBondContact O-N 2.93Å; A142-F145 PolarHBondContact O-N 3.16Å; A142-L146 WeakPolarHBondContact O-CA 3.44Å; A142-L146 WeakPolarHBondContact O-CB 3.45Å; A142-L146 PolarHBondContact O-N 3.19Å
143Y90.7Very high90.8Very high59 Ų5956.8 Ų56.823%0.23132%0.32CS..Hα-helixtrans-62.3-41.2177.1-174.2-117.1000112.3V139 I140 F141 F145 V147 Y173 L177 F180 S206V139-Y143 WeakPolarHBondContact O-CB 3.29Å; V139-Y143 PolarHBondContact O-N 2.94Å; I140-Y143 PolarHBondContact O-N 3.27Å; F141-Y143 VanDerWaalsContact C-N 3.3Å; F141-Y143 PolarHBondContact O-N 3.41Å; Y143-F145 VanDerWaalsContact C-N 3.34Å; Y143-F145 PolarHBondContact O-N 3.33Å; Y143-V147 HydrophobicContact CD2-CG2 3.83Å; Y143-V147 HydrophobicContact CE2-CG2 3.77Å; Y143-Y173 HydrophobicContact CE1-CE1 4.49Å; Y143-Y173 AromaticContact CE1-CZ 3.96Å; Y143-Y173 WeakPolarHBondContact CE1-OH 2.99Å; Y143-Y173 VanDerWaalsContact CE2-OH 3.3Å; Y143-Y173 WeakPolarHBondContact CE2-OH 3.48Å; Y143-Y173 WeakPolarHBondContact O-CE1 3.38Å; Y143-Y173 PolarHBondContact OH-OH 3.34Å; Y143-Y173 VanDerWaalsContact OH-OH 3.05Å; Y143-L177 HydrophobicContact CD1-CD2 3.59Å; Y143-L177 HydrophobicContact CE1-CD2 3.5Å; Y143-L177 VanDerWaalsContact CE1-CD2 3.5Å; Y143-F180 AromaticContact CE1-CE2 4Å; Y143-F180 HydrophobicContact CE1-CE2 4Å; Y143-F180 HydrophobicContact CE1-CZ 4.34Å; Y143-S206 PolarHBondContact OH-OG 3.36Å
144A89.5Confident90.5Very high8 Ų859.3 Ų59.37%0.06633%0.328CS..Hα-helixtrans-62.5-35.3178.600000113.6I140 F141 A142 P148 L177I140-A144 WeakPolarHBondContact O-CB 3.42Å; I140-A144 PolarHBondContact O-N 2.96Å; F141-A144 PolarHBondContact O-N 3.47Å; A142-A144 VanDerWaalsContact C-N 3.34Å; A142-A144 PolarHBondContact O-N 2.93Å; A144-P148 WeakPolarHBondContact O-CD 3.41Å; A144-P148 WeakPolarHBondContact O-CG 3.48Å; A144-L177 HydrophobicContact CB-CD1 3.67Å
145F88.8Confident89.9Confident105 Ų10555.1 Ų55.146%0.46130%0.303SS..Hα-helixtrans-98-37.7-178.2-70.9-72000114F141 A142 Y143 V147 P148 G149 I170F141-F145 AromaticContact CD1-CE2 3.99Å; F141-F145 HydrophobicContact CD1-CE2 3.99Å; F141-F145 WeakPolarHBondContact O-CD2 2.94Å; F141-F145 PolarHBondContact O-N 3.2Å; A142-F145 PolarHBondContact O-N 3.16Å; Y143-F145 VanDerWaalsContact C-N 3.34Å; Y143-F145 PolarHBondContact O-N 3.33Å; F145-V147 PolarHBondContact O-N 3.19Å; F145-P148 WeakPolarHBondContact O-CD 3.5Å; F145-G149 PolarHBondContact O-N 3.29Å; F145-I170 HydrophobicContact CD1-CD1 3.73Å; F145-I170 HydrophobicContact CD1-CG1 4.39Å; F145-I170 HydrophobicContact CE1-CD1 3.96Å; F145-I170 HydrophobicContact CE1-CG2 4.29Å
146L90.6Very high89.4Confident108 Ų10856 Ų5657%0.56531%0.306SS*.Hα-helixtrans-66.4-41.3-174.3-172.4150000111.3A142 G149 L150A142-L146 WeakPolarHBondContact O-CA 3.44Å; A142-L146 WeakPolarHBondContact O-CB 3.45Å; A142-L146 PolarHBondContact O-N 3.19Å; L146-G149 PolarHBondContact O-N 2.52Å; L146-L150 HydrophobicContact CD2-CD1 4.21Å; L146-L150 WeakPolarHBondContact O-CB 3.3Å; L146-L150 PolarHBondContact O-N 2.68Å
147V88.4Confident89Confident28 Ų2862.5 Ų62.517%0.1733%0.327CS..Hα-helixtrans-65.4-52.5-179.4173.80000111.5Y143 F145 G149 L150 F151 Y173 L210Y143-V147 HydrophobicContact CD2-CG2 3.83Å; Y143-V147 HydrophobicContact CE2-CG2 3.77Å; F145-V147 PolarHBondContact O-N 3.19Å; V147-G149 VanDerWaalsContact C-N 3.29Å; V147-G149 PolarHBondContact O-N 3.28Å; V147-L150 PolarHBondContact O-N 3.26Å; V147-F151 HydrophobicContact CG1-CD2 4.46Å; V147-F151 WeakPolarHBondContact O-CD2 3.34Å; V147-F151 PolarHBondContact O-N 2.89Å; V147-Y173 HydrophobicContact CB-CD1 4.49Å; V147-Y173 HydrophobicContact CB-CE1 3.8Å; V147-Y173 HydrophobicContact CB-CE2 4.44Å; V147-Y173 HydrophobicContact CG1-CD2 4.46Å; V147-Y173 HydrophobicContact CG1-CE1 4.15Å; V147-Y173 HydrophobicContact CG1-CE2 3.9Å; V147-Y173 HydrophobicContact CG2-CE1 4.38Å; V147-L210 HydrophobicContact CG1-CD2 3.81Å
148P86.7Confident88.3Confident0 Ų067.7 Ų67.70%034%0.342CS..Hα-helixtrans-55.6-41.9171.2-30.238.5000113.5A144 F145 L150 F151 I152 L169 I170 Y173A144-P148 WeakPolarHBondContact O-CD 3.41Å; A144-P148 WeakPolarHBondContact O-CG 3.48Å; F145-P148 WeakPolarHBondContact O-CD 3.5Å; P148-L150 PolarHBondContact O-N 3.27Å; P148-F151 PolarHBondContact O-N 3.08Å; P148-I152 WeakPolarHBondContact O-CG1 3.25Å; P148-I152 PolarHBondContact O-N 3.38Å; P148-L169 HydrophobicContact CB-CB 4.18Å; P148-I170 HydrophobicContact CB-CG1 3.66Å; P148-I170 HydrophobicContact CG-CG1 3.96Å; P148-Y173 HydrophobicContact CG-CD1 3.62Å; P148-Y173 HydrophobicContact CG-CE1 4.45Å; P148-Y173 HydrophobicContact CG-CG 3.98Å
149G87.4Confident87.4Confident22 Ų2270.8 Ų70.823%0.22735%0.353CS..Hα-helixtrans-61-42.8178.200000112.6F145 L146 V147 F151 I152 V153F145-G149 PolarHBondContact O-N 3.29Å; L146-G149 PolarHBondContact O-N 2.52Å; V147-G149 VanDerWaalsContact C-N 3.29Å; V147-G149 PolarHBondContact O-N 3.28Å; G149-F151 VanDerWaalsContact C-N 3.3Å; G149-F151 PolarHBondContact O-N 3.34Å; G149-I152 PolarHBondContact O-N 2.93Å; G149-V153 WeakPolarHBondContact O-CG2 3.37Å; G149-V153 PolarHBondContact O-N 3.17Å
150L89.2Confident86.3Confident114 Ų11467.2 Ų67.260%0.59733%0.331SS*.Hα-helixtrans-62.5-38.6179.1-147.9111.9000111.7L146 V147 P148 V153 F154L146-L150 HydrophobicContact CD2-CD1 4.21Å; L146-L150 WeakPolarHBondContact O-CB 3.3Å; L146-L150 PolarHBondContact O-N 2.68Å; V147-L150 PolarHBondContact O-N 3.26Å; P148-L150 PolarHBondContact O-N 3.27Å; L150-V153 PolarHBondContact O-N 3.36Å; L150-F154 WeakPolarHBondContact O-CB 3.37Å; L150-F154 PolarHBondContact O-N 3.21Å
151F84.8Confident85.1Confident45 Ų4573.9 Ų73.920%0.19737%0.367CS..Hα-helixtrans-69.5-40175.9-88.8-84.1000112.8V147 P148 G149 F154 F155 L169 L210 L211 I214V147-F151 HydrophobicContact CG1-CD2 4.46Å; V147-F151 WeakPolarHBondContact O-CD2 3.34Å; V147-F151 PolarHBondContact O-N 2.89Å; P148-F151 PolarHBondContact O-N 3.08Å; G149-F151 VanDerWaalsContact C-N 3.3Å; G149-F151 PolarHBondContact O-N 3.34Å; F151-F154 WeakPolarHBondContact O-CB 3.49Å; F151-F154 PolarHBondContact O-N 2.85Å; F151-F155 HydrophobicContact CB-CE2 4.37Å; F151-F155 HydrophobicContact CD1-CZ 4.45Å; F151-F155 WeakPolarHBondContact O-CD2 3.37Å; F151-F155 VanDerWaalsContact O-CG 3.27Å; F151-F155 WeakPolarHBondContact O-CG 3.48Å; F151-F155 PolarHBondContact O-N 3.14Å; F151-L169 HydrophobicContact CB-CD2 3.6Å; F151-L210 HydrophobicContact CD2-CD2 3.31Å; F151-L210 HydrophobicContact CE2-CD2 3.18Å; F151-L210 HydrophobicContact CE2-CG 4.46Å; F151-L210 HydrophobicContact CG-CD2 4.11Å; F151-L210 HydrophobicContact CZ-CD2 3.87Å; F151-L211 HydrophobicContact CZ-CD2 4.26Å; F151-I214 HydrophobicContact CB-CD1 4.04Å; F151-I214 HydrophobicContact CD1-CD1 3.24Å; F151-I214 HydrophobicContact CD1-CG2 4.31Å; F151-I214 HydrophobicContact CD2-CD1 4.28Å; F151-I214 HydrophobicContact CE1-CD1 3.61Å; F151-I214 HydrophobicContact CE1-CG2 4.21Å; F151-I214 HydrophobicContact CG-CD1 3.59Å; F151-I214 HydrophobicContact CZ-CD1 4.28Å
152I84.2Confident83.8Confident21 Ų2175.5 Ų75.511%0.10838%0.378CS..Hα-helixtrans-60.9-46.9173.4-69.7-71.4000110.5P148 G149 F154 F155 M156 Y164 L166 L169P148-I152 WeakPolarHBondContact O-CG1 3.25Å; P148-I152 PolarHBondContact O-N 3.38Å; G149-I152 PolarHBondContact O-N 2.93Å; I152-F154 VanDerWaalsContact C-N 3.29Å; I152-F154 PolarHBondContact O-N 3.44Å; I152-F155 PolarHBondContact O-N 2.83Å; I152-F155 VanDerWaalsContact O-N 3.17Å; I152-M156 HydrophobicContact CG2-CG 4.34Å; I152-M156 HydrophobicContact CG2-SD 4.14Å; I152-M156 WeakPolarHBondContact O-CG 3.38Å; I152-M156 PolarHBondContact O-N 3.1Å; I152-Y164 WeakPolarHBondContact CD1-O 3.42Å; I152-L166 HydrophobicContact CD1-CB 4.15Å; I152-L166 HydrophobicContact CG1-CB 4.05Å; I152-L166 HydrophobicContact CG1-CD1 4.38Å; I152-L166 HydrophobicContact CG1-CG 4.42Å; I152-L169 HydrophobicContact CD1-CD2 4.35Å; I152-L169 HydrophobicContact CG1-CD2 4.16Å
153V88.1Confident82.7Confident98 Ų9876.2 Ų76.259%0.59437%0.374SS*.Hα-helixtrans-59-42.4175.9172.30000110.9G149 L150 F155 M156 W157G149-V153 WeakPolarHBondContact O-CG2 3.37Å; G149-V153 PolarHBondContact O-N 3.17Å; L150-V153 PolarHBondContact O-N 3.36Å; V153-F155 PolarHBondContact O-N 3.3Å; V153-M156 PolarHBondContact O-N 3.49Å; V153-W157 WeakPolarHBondContact O-CB 3.38Å; V153-W157 PolarHBondContact O-N 3.32Å
154F85.7Confident81.7Confident88 Ų8874.5 Ų74.539%0.38637%0.367SS..Hα-helixtrans-61.8-42.6176176.5-97.7000112.6L150 F151 I152 W157 R158L150-F154 WeakPolarHBondContact O-CB 3.37Å; L150-F154 PolarHBondContact O-N 3.21Å; F151-F154 WeakPolarHBondContact O-CB 3.49Å; F151-F154 PolarHBondContact O-N 2.85Å; I152-F154 VanDerWaalsContact C-N 3.29Å; I152-F154 PolarHBondContact O-N 3.44Å; F154-W157 HydrophobicContact CD2-CE3 4.37Å; F154-W157 HydrophobicContact CE2-CE3 4.43Å; F154-W157 PolarHBondContact O-N 3.24Å; F154-R158 HydrophobicContact CE1-CG 4.37Å; F154-R158 HydrophobicContact CE2-CG 4.46Å; F154-R158 HydrophobicContact CZ-CG 4.21Å; F154-R158 WeakPolarHBondContact O-CG 3.36Å; F154-R158 PolarHBondContact O-N 3.36Å
155F83Confident81.2Confident0 Ų077.7 Ų77.70%039%0.386CS..Hα-helixtrans-67.8-41.1177-67.7-43.1000112.4F151 I152 V153 W157 R158 N159 M160 M163 L169 I214 V218F151-F155 HydrophobicContact CB-CE2 4.37Å; F151-F155 HydrophobicContact CD1-CZ 4.45Å; F151-F155 WeakPolarHBondContact O-CD2 3.37Å; F151-F155 VanDerWaalsContact O-CG 3.27Å; F151-F155 WeakPolarHBondContact O-CG 3.48Å; F151-F155 PolarHBondContact O-N 3.14Å; I152-F155 PolarHBondContact O-N 2.83Å; I152-F155 VanDerWaalsContact O-N 3.17Å; V153-F155 PolarHBondContact O-N 3.3Å; F155-W157 VanDerWaalsContact C-N 3.29Å; F155-W157 PolarHBondContact O-N 2.69Å; F155-R158 CarbonylContact O-C 3.57Å; F155-R158 PolarHBondContact O-N 3.45Å; F155-R158 VanDerWaalsContact O-N 3.07Å; F155-N159 PolarHBondContact O-N 2.92Å; F155-N159 VanDerWaalsContact O-N 3.16Å; F155-M160 HydrophobicContact CD1-CG 4.36Å; F155-M163 HydrophobicContact CB-CE 3.26Å; F155-M163 HydrophobicContact CB-CG 3.87Å; F155-M163 HydrophobicContact CB-SD 3.69Å; F155-M163 HydrophobicContact CD2-CE 4.42Å; F155-M163 HydrophobicContact CG-CE 4.3Å; F155-M163 HydrophobicContact CG-CG 4.41Å; F155-L169 HydrophobicContact CE2-CD2 4.35Å; F155-I214 HydrophobicContact CE1-CG2 3.8Å; F155-I214 HydrophobicContact CE2-CD1 4.18Å; F155-I214 HydrophobicContact CE2-CG1 4.44Å; F155-I214 HydrophobicContact CZ-CB 4.22Å; F155-I214 HydrophobicContact CZ-CD1 3.93Å; F155-I214 HydrophobicContact CZ-CG1 3.94Å; F155-I214 HydrophobicContact CZ-CG2 3.4Å; F155-I214 VanDerWaalsContact CZ-CG2 3.4Å; F155-V218 HydrophobicContact CE1-CG2 4.04Å
156M83.4Confident80.8Confident120 Ų12076.9 Ų76.959%0.59139%0.385SS*.Hα-helixtrans-60.1-42.8174.3-71.8-176.771.900110.7I152 V153 R158 N159 M163I152-M156 HydrophobicContact CG2-CG 4.34Å; I152-M156 HydrophobicContact CG2-SD 4.14Å; I152-M156 WeakPolarHBondContact O-CG 3.38Å; I152-M156 PolarHBondContact O-N 3.1Å; V153-M156 PolarHBondContact O-N 3.49Å; M156-R158 PolarHBondContact O-N 3.07Å; M156-N159 PolarHBondContact O-N 3.33Å; M156-M163 HydrophobicContact CG-CE 3.82Å
157W85.4Confident80.2Confident199 Ų19973.8 Ų73.875%0.75437%0.369SS*.Hα-helixtrans-62.2-26.7176.7-175.354.3000113.1V153 F154 F155V153-W157 WeakPolarHBondContact O-CB 3.38Å; V153-W157 PolarHBondContact O-N 3.32Å; F154-W157 HydrophobicContact CD2-CE3 4.37Å; F154-W157 HydrophobicContact CE2-CE3 4.43Å; F154-W157 PolarHBondContact O-N 3.24Å; F155-W157 VanDerWaalsContact C-N 3.29Å; F155-W157 PolarHBondContact O-N 2.69Å
158R80.4Confident79.8Confident128 Ų12873.5 Ų73.548%0.48337%0.366SS..THydrogen-bonded Turntrans-94.1-1.4179.4-67.2-74.2-79.9150.7-6.5114.3F154 F155 M156 M160F154-R158 HydrophobicContact CE1-CG 4.37Å; F154-R158 HydrophobicContact CE2-CG 4.46Å; F154-R158 HydrophobicContact CZ-CG 4.21Å; F154-R158 WeakPolarHBondContact O-CG 3.36Å; F154-R158 PolarHBondContact O-N 3.36Å; F155-R158 CarbonylContact O-C 3.57Å; F155-R158 PolarHBondContact O-N 3.45Å; F155-R158 VanDerWaalsContact O-N 3.07Å; M156-R158 PolarHBondContact O-N 3.07Å; R158-M160 VanDerWaalsContact C-N 3.28Å; R158-M160 HydrophobicContact CB-CG 3.75Å; R158-M160 HydrophobicContact CB-SD 3.6Å; R158-M160 VanDerWaalsContact CB-SD 3.6Å; R158-M160 PolarHBondContact O-N 3.08Å
159N75.1Confident79.5Confident134 Ų13473.5 Ų73.572%0.71737%0.366SS*.THydrogen-bonded Turntrans47.647.7-176.9-68.5-54.1000112.8F155 M156F155-N159 PolarHBondContact O-N 2.92Å; F155-N159 VanDerWaalsContact O-N 3.16Å; M156-N159 PolarHBondContact O-N 3.33Å
160M71.2Confident79.4Confident10 Ų1073 Ų735%0.04936%0.358CS..  trans-79.7128.9179-43.1-75.6-99.100108.5F155 R158 M163 H221F155-M160 HydrophobicContact CD1-CG 4.36Å; R158-M160 VanDerWaalsContact C-N 3.28Å; R158-M160 HydrophobicContact CB-CG 3.75Å; R158-M160 HydrophobicContact CB-SD 3.6Å; R158-M160 VanDerWaalsContact CB-SD 3.6Å; R158-M160 PolarHBondContact O-N 3.08Å; M160-M163 HydrophobicContact CB-CG 4.03Å; M160-M163 WeakPolarHBondContact O-CG 3.46Å; M160-H221 HydrophobicContact CE-CB 3.33Å; M160-H221 HydrophobicContact SD-CB 3.89Å; M160-H221 PolarHBondContact SD-CD2 3.23Å; M160-H221 PolarHBondContact SD-CE1 3.36Å; M160-H221 PolarHBondContact SD-ND1 3.27Å; M160-H221 PolarHBondContact SD-NE2 3.37Å; M160-H221 VanDerWaalsContact SD-NE2 3.41Å
161D67.5Low79.1Confident161 Ų16167.6 Ų67.686%0.86133%0.33SS*.SBendtrans-79.2-29.7179.5-63.4-46.2000113.1M163D161-M163 PolarHBondContact O-N 3.36Å; D161-M163 VanDerWaalsContact O-N 3.1Å
162D67Low78.8Confident88 Ų8866.1 Ų66.147%0.47133%0.325SS..SBendtrans-86.351178.8-87-30.9000111.8V217 K220D162-V217 VanDerWaalsContact O-CG1 3.28Å; D162-V217 WeakPolarHBondContact O-CG1 3.32Å; D162-K220 WeakPolarHBondContact OD2-CE 3.35Å; D162-K220 IonicContact OD2-NZ 2.69Å; D162-K220 PolarHBondContact OD2-NZ 3.05Å
163M69.2Low78.8Confident65 Ų6565.2 Ų65.232%0.3232%0.321SS..PPolyproline II helixtrans-80.3136.3-178.6-77.4176.565.300112.7F155 M156 M160 D161F155-M163 HydrophobicContact CB-CE 3.26Å; F155-M163 HydrophobicContact CB-CG 3.87Å; F155-M163 HydrophobicContact CB-SD 3.69Å; F155-M163 HydrophobicContact CD2-CE 4.42Å; F155-M163 HydrophobicContact CG-CE 4.3Å; F155-M163 HydrophobicContact CG-CG 4.41Å; M156-M163 HydrophobicContact CG-CE 3.82Å; M160-M163 HydrophobicContact CB-CG 4.03Å; M160-M163 WeakPolarHBondContact O-CG 3.46Å; D161-M163 PolarHBondContact O-N 3.36Å; D161-M163 VanDerWaalsContact O-N 3.1Å
164Y71Confident78.7Confident23 Ų2360.6 Ų60.69%0.0929%0.293CS..PPolyproline II helixtrans-69.4143163.1-68-56.4000109.9I80 I152 L169 V217I80-Y164 HydrophobicContact CB-CD1 4.45Å; I80-Y164 HydrophobicContact CB-CE1 3.76Å; I80-Y164 HydrophobicContact CD1-CD1 4.19Å; I80-Y164 HydrophobicContact CD1-CD2 3.98Å; I80-Y164 HydrophobicContact CD1-CE1 4.02Å; I80-Y164 HydrophobicContact CD1-CE2 3.75Å; I80-Y164 HydrophobicContact CD1-CG 4.19Å; I80-Y164 HydrophobicContact CG1-CE1 4.45Å; I80-Y164 HydrophobicContact CG2-CD1 3.56Å; I80-Y164 HydrophobicContact CG2-CE1 3.23Å; I80-Y164 HydrophobicContact CG2-CG 4.49Å; I152-Y164 WeakPolarHBondContact CD1-O 3.42Å; Y164-L169 VanDerWaalsContact CB-CD1 3.43Å; Y164-L169 HydrophobicContact CD2-CD1 3.98Å; Y164-L169 HydrophobicContact CG-CD1 4.05Å; Y164-V217 HydrophobicContact CD2-CG2 4.11Å; Y164-V217 HydrophobicContact CE1-CG2 4.46Å; Y164-V217 HydrophobicContact CE2-CB 4.31Å; Y164-V217 HydrophobicContact CE2-CG2 3.27Å; Y164-V217 VanDerWaalsContact CZ-CG2 3.48Å; Y164-V217 WeakPolarHBondContact OH-CG2 3.42Å
165T77.9Confident78.5Confident75 Ų7556.9 Ų56.946%0.4628%0.276SS..PPolyproline II helixtrans-67150.1173.7620000110.3L167 E168 L169T165-L167 PolarHBondContact O-N 3.16Å; T165-E168 PolarHBondContact N-OE2 2.82Å; T165-E168 PolarHBondContact O-N 3.26Å; T165-E168 VanDerWaalsContact O-N 3.1Å; T165-E168 WeakPolarHBondContact OG1-CB 3.5Å; T165-E168 VanDerWaalsContact OG1-CD 3.25Å; T165-E168 WeakPolarHBondContact OG1-CG 3.16Å; T165-E168 PolarHBondContact OG1-N 3.44Å; T165-E168 PolarHBondContact OG1-OE2 3.13Å; T165-L169 PolarHBondContact O-N 3.06Å; T165-L169 VanDerWaalsContact O-N 3.08Å
166L80Confident78.7Confident87 Ų8756.9 Ų56.946%0.45528%0.276SS..Hα-helixtrans-55.8-34.7176.3176.4144.1000111.5I152 L169 I170I152-L166 HydrophobicContact CD1-CB 4.15Å; I152-L166 HydrophobicContact CG1-CB 4.05Å; I152-L166 HydrophobicContact CG1-CD1 4.38Å; I152-L166 HydrophobicContact CG1-CG 4.42Å; L166-L169 PolarHBondContact O-N 3.11Å; L166-I170 HydrophobicContact CD2-CD1 3.31Å; L166-I170 HydrophobicContact CD2-CG1 4.32Å; L166-I170 HydrophobicContact CG-CD1 3.91Å; L166-I170 WeakPolarHBondContact O-CB 3Å; L166-I170 VanDerWaalsContact O-CG1 3.29Å; L166-I170 WeakPolarHBondContact O-CG1 3.43Å; L166-I170 PolarHBondContact O-N 2.89Å
167L79.7Confident78.9Confident43 Ų4351.2 Ų51.223%0.22525%0.249CC..Hα-helixtrans-66.9-43.8177.6-156.887.2000112.1F55 P88 L90 T165 L169 I170 C171F55-L167 HydrophobicContact CD1-CD2 3.66Å; F55-L167 HydrophobicContact CE1-CD2 3.38Å; F55-L167 HydrophobicContact CG-CD2 4.5Å; F55-L167 HydrophobicContact CZ-CD2 4.07Å; P88-L167 HydrophobicContact CB-CD2 3.63Å; P88-L167 HydrophobicContact CB-CG 4.22Å; P88-L167 HydrophobicContact CG-CD2 3.51Å; P88-L167 WeakPolarHBondContact O-CD2 3.25Å; L90-L167 HydrophobicContact CD1-CD1 3.67Å; L90-L167 HydrophobicContact CD1-CG 4.41Å; T165-L167 PolarHBondContact O-N 3.16Å; L167-L169 VanDerWaalsContact C-N 3.29Å; L167-L169 PolarHBondContact O-N 3.43Å; L167-I170 PolarHBondContact O-N 3.44Å; L167-C171 WeakPolarHBondContact O-CB 3.18Å; L167-C171 PolarHBondContact O-N 2.9Å
168E78.4Confident79Confident22 Ų2242 Ų4210%0.10322%0.215CC..Hα-helixtrans-62-38.7174.8-73.3167.6138.600111.8I84 P88 T165 S172I84-E168 HydrophobicContact CG2-CB 4.28Å; I84-E168 HydrophobicContact CG2-CG 3.81Å; P88-E168 HydrophobicContact CB-CG 4.25Å; T165-E168 PolarHBondContact N-OE2 2.82Å; T165-E168 PolarHBondContact O-N 3.26Å; T165-E168 VanDerWaalsContact O-N 3.1Å; T165-E168 WeakPolarHBondContact OG1-CB 3.5Å; T165-E168 VanDerWaalsContact OG1-CD 3.25Å; T165-E168 WeakPolarHBondContact OG1-CG 3.16Å; T165-E168 PolarHBondContact OG1-N 3.44Å; T165-E168 PolarHBondContact OG1-OE2 3.13Å; E168-S172 WeakPolarHBondContact O-CB 3.06Å; E168-S172 PolarHBondContact O-N 3.29Å; E168-S172 PolarHBondContact O-OG 2.89Å
169L81.5Confident79.3Confident0 Ų036.5 Ų36.50%020%0.195CC..Hα-helixtrans-68.7-46.1178-119.377.2000111.8P148 F151 I152 F155 Y164 T165 L166 L167 C171 S172 Y173 I214P148-L169 HydrophobicContact CB-CB 4.18Å; F151-L169 HydrophobicContact CB-CD2 3.6Å; I152-L169 HydrophobicContact CD1-CD2 4.35Å; I152-L169 HydrophobicContact CG1-CD2 4.16Å; F155-L169 HydrophobicContact CE2-CD2 4.35Å; Y164-L169 VanDerWaalsContact CB-CD1 3.43Å; Y164-L169 HydrophobicContact CD2-CD1 3.98Å; Y164-L169 HydrophobicContact CG-CD1 4.05Å; T165-L169 PolarHBondContact O-N 3.06Å; T165-L169 VanDerWaalsContact O-N 3.08Å; L166-L169 PolarHBondContact O-N 3.11Å; L167-L169 VanDerWaalsContact C-N 3.29Å; L167-L169 PolarHBondContact O-N 3.43Å; L169-C171 VanDerWaalsContact C-N 3.34Å; L169-S172 PolarHBondContact O-OG 3.19Å; L169-S172 VanDerWaalsContact O-OG 3.12Å; L169-Y173 WeakPolarHBondContact O-CB 3.33Å; L169-Y173 PolarHBondContact O-N 3.06Å; L169-I214 HydrophobicContact CD2-CD1 4.23Å
170I84.2Confident80Confident12 Ų1230.9 Ų30.96%0.06216%0.164CC..Hα-helixtrans-64.1-41.6175.6-70.7171000110.9L90 P93 F145 P148 L166 L167 G174L90-I170 HydrophobicContact CD1-CG2 4.03Å; P93-I170 HydrophobicContact CB-CG2 4.35Å; P93-I170 HydrophobicContact CG-CG2 4.48Å; F145-I170 HydrophobicContact CD1-CD1 3.73Å; F145-I170 HydrophobicContact CD1-CG1 4.39Å; F145-I170 HydrophobicContact CE1-CD1 3.96Å; F145-I170 HydrophobicContact CE1-CG2 4.29Å; P148-I170 HydrophobicContact CB-CG1 3.66Å; P148-I170 HydrophobicContact CG-CG1 3.96Å; L166-I170 HydrophobicContact CD2-CD1 3.31Å; L166-I170 HydrophobicContact CD2-CG1 4.32Å; L166-I170 HydrophobicContact CG-CD1 3.91Å; L166-I170 WeakPolarHBondContact O-CB 3Å; L166-I170 VanDerWaalsContact O-CG1 3.29Å; L166-I170 WeakPolarHBondContact O-CG1 3.43Å; L166-I170 PolarHBondContact O-N 2.89Å; L167-I170 PolarHBondContact O-N 3.44Å; I170-G174 WeakPolarHBondContact O-CA 3.21Å; I170-G174 PolarHBondContact O-N 3.45Å
171C83.3Confident81Confident0 Ų032.4 Ų32.40%017%0.172CC..Hα-helixtrans-57.5-63.2176.3179.70000110.5D89 L167 L169 Y173 G174 Y175D89-C171 PolarHBondContact O-SG 3.01Å; D89-C171 VanDerWaalsContact O-SG 3.38Å; D89-C171 PolarHBondContact OD1-SG 3.3Å; L167-C171 WeakPolarHBondContact O-CB 3.18Å; L167-C171 PolarHBondContact O-N 2.9Å; L169-C171 VanDerWaalsContact C-N 3.34Å; C171-Y173 VanDerWaalsContact C-N 3.31Å; C171-Y173 PolarHBondContact O-N 3.47Å; C171-G174 PolarHBondContact O-N 2.79Å; C171-Y175 WeakPolarHBondContact O-CD2 3.22Å; C171-Y175 PolarHBondContact O-N 3.47Å; C171-Y175 VanDerWaalsContact O-N 3.08Å; C171-Y175 VanDerWaalsContact SG-CE2 3.55Å
172S78.3Confident82.1Confident15 Ų1527.4 Ų27.411%0.10515%0.149CC..Hα-helixtrans-57.4-42.1-178.856.90000113.1E168 L169 S176E168-S172 WeakPolarHBondContact O-CB 3.06Å; E168-S172 PolarHBondContact O-N 3.29Å; E168-S172 PolarHBondContact O-OG 2.89Å; L169-S172 PolarHBondContact O-OG 3.19Å; L169-S172 VanDerWaalsContact O-OG 3.12Å; S172-S176 PolarHBondContact O-N 2.94Å
173Y85Confident83.2Confident2 Ų223.8 Ų23.81%0.00813%0.129CC..Hα-helixtrans-70.8-43.1179-173.2-114.9000113Y143 V147 P148 L169 C171 Y175 S176 L177 L210Y143-Y173 HydrophobicContact CE1-CE1 4.49Å; Y143-Y173 AromaticContact CE1-CZ 3.96Å; Y143-Y173 WeakPolarHBondContact CE1-OH 2.99Å; Y143-Y173 VanDerWaalsContact CE2-OH 3.3Å; Y143-Y173 WeakPolarHBondContact CE2-OH 3.48Å; Y143-Y173 WeakPolarHBondContact O-CE1 3.38Å; Y143-Y173 PolarHBondContact OH-OH 3.34Å; Y143-Y173 VanDerWaalsContact OH-OH 3.05Å; V147-Y173 HydrophobicContact CB-CD1 4.49Å; V147-Y173 HydrophobicContact CB-CE1 3.8Å; V147-Y173 HydrophobicContact CB-CE2 4.44Å; V147-Y173 HydrophobicContact CG1-CD2 4.46Å; V147-Y173 HydrophobicContact CG1-CE1 4.15Å; V147-Y173 HydrophobicContact CG1-CE2 3.9Å; V147-Y173 HydrophobicContact CG2-CE1 4.38Å; P148-Y173 HydrophobicContact CG-CD1 3.62Å; P148-Y173 HydrophobicContact CG-CE1 4.45Å; P148-Y173 HydrophobicContact CG-CG 3.98Å; L169-Y173 WeakPolarHBondContact O-CB 3.33Å; L169-Y173 PolarHBondContact O-N 3.06Å; C171-Y173 VanDerWaalsContact C-N 3.31Å; C171-Y173 PolarHBondContact O-N 3.47Å; Y173-Y175 PolarHBondContact O-N 3.34Å; Y173-S176 WeakPolarHBondContact O-CA 3.06Å; Y173-S176 WeakPolarHBondContact O-CB 3.44Å; Y173-S176 PolarHBondContact O-N 3.47Å; Y173-S176 PolarHBondContact O-OG 3.49Å; Y173-L177 HydrophobicContact CE1-CD2 4.2Å; Y173-L177 PolarHBondContact O-N 2.89Å; Y173-L210 HydrophobicContact CD2-CB 4.12Å; Y173-L210 HydrophobicContact CD2-CD1 3.7Å; Y173-L210 HydrophobicContact CD2-CD2 4.47Å; Y173-L210 HydrophobicContact CD2-CG 4.32Å; Y173-L210 HydrophobicContact CG-CD1 4Å
174G85.6Confident84.3Confident1 Ų120.7 Ų20.71%0.0111%0.114CC..Hα-helixtrans-58.8-36.117700000112.1I96 I170 C171 S176 L177I96-G174 WeakPolarHBondContact CG2-O 3.43Å; I170-G174 WeakPolarHBondContact O-CA 3.21Å; I170-G174 PolarHBondContact O-N 3.45Å; C171-G174 PolarHBondContact O-N 2.79Å; G174-S176 VanDerWaalsContact C-N 3.35Å; G174-S176 PolarHBondContact O-N 3.35Å; G174-L177 WeakPolarHBondContact O-CB 3.46Å; G174-L177 PolarHBondContact O-N 3.01Å
175Y82.4Confident85.2Confident9 Ų923.6 Ų23.64%0.03513%0.13CC..Hα-helixtrans-62.2-39.6171.2-81.4-66.8000113.2V63 R66 V67 D89 I96 C171 Y173 L177 S178V63-Y175 HydrophobicContact CB-CE1 4.43Å; V63-Y175 HydrophobicContact CG1-CE1 3.71Å; R66-Y175 HydrophobicContact CB-CD1 4.21Å; R66-Y175 HydrophobicContact CB-CE1 4.12Å; V67-Y175 HydrophobicContact CG2-CD1 3.76Å; V67-Y175 HydrophobicContact CG2-CE1 4.17Å; D89-Y175 PolarHBondContact OD2-OH 3Å; I96-Y175 HydrophobicContact CD1-CD1 3.68Å; I96-Y175 HydrophobicContact CD1-CE1 4.16Å; I96-Y175 HydrophobicContact CD1-CG 4.4Å; C171-Y175 WeakPolarHBondContact O-CD2 3.22Å; C171-Y175 PolarHBondContact O-N 3.47Å; C171-Y175 VanDerWaalsContact O-N 3.08Å; C171-Y175 VanDerWaalsContact SG-CE2 3.55Å; Y173-Y175 PolarHBondContact O-N 3.34Å; Y175-L177 PolarHBondContact O-N 3.35Å; Y175-S178 VanDerWaalsContact O-CB 3.3Å; Y175-S178 WeakPolarHBondContact O-CB 3.38Å; Y175-S178 PolarHBondContact O-N 3.18Å; Y175-S178 PolarHBondContact O-OG 3.47Å
176S85.4Confident85.8Confident1 Ų123.8 Ų23.81%0.00713%0.128CC..Hα-helixtrans-66-22.5177.680.70000113.7S172 Y173 G174 S178 V179S172-S176 PolarHBondContact O-N 2.94Å; Y173-S176 WeakPolarHBondContact O-CA 3.06Å; Y173-S176 WeakPolarHBondContact O-CB 3.44Å; Y173-S176 PolarHBondContact O-N 3.47Å; Y173-S176 PolarHBondContact O-OG 3.49Å; G174-S176 VanDerWaalsContact C-N 3.35Å; G174-S176 PolarHBondContact O-N 3.35Å; S176-S178 PolarHBondContact O-N 2.97Å; S176-V179 WeakPolarHBondContact O-CG2 3.27Å; S176-V179 PolarHBondContact O-N 2.96Å
177L87.6Confident86.2Confident1 Ų121.8 Ų21.81%0.00512%0.115CC..G310 helixtrans-66.8-14.8175.9-63.6178.4000113.2I96 Y143 A144 Y173 G174 Y175 V179 F180I96-L177 HydrophobicContact CG2-CB 3.92Å; Y143-L177 HydrophobicContact CD1-CD2 3.59Å; Y143-L177 HydrophobicContact CE1-CD2 3.5Å; Y143-L177 VanDerWaalsContact CE1-CD2 3.5Å; A144-L177 HydrophobicContact CB-CD1 3.67Å; Y173-L177 HydrophobicContact CE1-CD2 4.2Å; Y173-L177 PolarHBondContact O-N 2.89Å; G174-L177 WeakPolarHBondContact O-CB 3.46Å; G174-L177 PolarHBondContact O-N 3.01Å; Y175-L177 PolarHBondContact O-N 3.35Å; L177-V179 PolarHBondContact O-N 2.97Å; L177-V179 VanDerWaalsContact O-N 3.16Å; L177-F180 HydrophobicContact CD2-CD2 4.14Å; L177-F180 HydrophobicContact CD2-CE2 4.25Å; L177-F180 WeakPolarHBondContact O-CB 3.32Å; L177-F180 PolarHBondContact O-N 3.28Å
178S87.4Confident86.5Confident6 Ų620.1 Ų20.14%0.04211%0.107CC..G310 helixtrans-56.4-29.2174.359.40000113.1Y175 S176 F180 I181 P182Y175-S178 VanDerWaalsContact O-CB 3.3Å; Y175-S178 WeakPolarHBondContact O-CB 3.38Å; Y175-S178 PolarHBondContact O-N 3.18Å; Y175-S178 PolarHBondContact O-OG 3.47Å; S176-S178 PolarHBondContact O-N 2.97Å; S178-F180 PolarHBondContact O-N 3.4Å; S178-I181 WeakPolarHBondContact O-CB 3.43Å; S178-I181 PolarHBondContact O-N 2.93Å; S178-P182 VanDerWaalsContact O-CD 3.27Å; S178-P182 WeakPolarHBondContact O-CD 3.3Å
179V87.5Confident86.9Confident12 Ų1222.3 Ų22.37%0.07312%0.122CC..G310 helixtrans-58.2-29.7174.2177.10000111.7M71 S176 L177 I181 P182 I183 L205M71-V179 HydrophobicContact CG-CG2 3.86Å; S176-V179 WeakPolarHBondContact O-CG2 3.27Å; S176-V179 PolarHBondContact O-N 2.96Å; L177-V179 PolarHBondContact O-N 2.97Å; L177-V179 VanDerWaalsContact O-N 3.16Å; V179-I181 VanDerWaalsContact C-N 3.31Å; V179-I181 PolarHBondContact O-N 3.13Å; V179-P182 WeakPolarHBondContact O-CD 3.41Å; V179-P182 WeakPolarHBondContact O-CG 3.24Å; V179-I183 HydrophobicContact CG1-CD1 3.92Å; V179-I183 WeakPolarHBondContact O-CD1 3.21Å; V179-I183 WeakPolarHBondContact O-CG1 3.35Å; V179-L205 HydrophobicContact CG1-CB 4.24Å; V179-L205 HydrophobicContact CG1-CD1 3.84Å
180F90.3Very high87Confident16 Ų1625.4 Ų25.47%0.0714%0.139CC..Hα-helixtrans-74.3-19.2177.9-78.9-85.6000113.6L100 Y143 L177 S178 I183 S184 V203L100-F180 HydrophobicContact CD1-CB 3.48Å; L100-F180 VanDerWaalsContact CD1-CB 3.48Å; L100-F180 WeakPolarHBondContact CD1-O 3.5Å; L100-F180 HydrophobicContact CD2-CB 3.68Å; L100-F180 HydrophobicContact CD2-CG 4.39Å; L100-F180 HydrophobicContact CG-CB 4.23Å; Y143-F180 AromaticContact CE1-CE2 4Å; Y143-F180 HydrophobicContact CE1-CE2 4Å; Y143-F180 HydrophobicContact CE1-CZ 4.34Å; L177-F180 HydrophobicContact CD2-CD2 4.14Å; L177-F180 HydrophobicContact CD2-CE2 4.25Å; L177-F180 WeakPolarHBondContact O-CB 3.32Å; L177-F180 PolarHBondContact O-N 3.28Å; S178-F180 PolarHBondContact O-N 3.4Å; F180-I183 PolarHBondContact O-N 3.44Å; F180-S184 VanDerWaalsContact O-CB 3.3Å; F180-S184 WeakPolarHBondContact O-CB 3.37Å; F180-S184 PolarHBondContact O-N 3.37Å; F180-S184 PolarHBondContact O-OG 3.21Å; F180-V203 HydrophobicContact CZ-CG2 3.86Å; F180-V203 VanDerWaalsContact CZ-N 3.34Å
181I91.2Very high87.1Confident42 Ų4229.3 Ų29.322%0.21516%0.158CC..Hα-helixtrans-62.6-52.5-179.2-60.6174.6000111.7I96 L100 T103 S178 V179 I183 S184 L185I96-I181 HydrophobicContact CG2-CD1 4.38Å; L100-I181 HydrophobicContact CB-CG1 4.3Å; T103-I181 HydrophobicContact CG2-CG2 4.01Å; S178-I181 WeakPolarHBondContact O-CB 3.43Å; S178-I181 PolarHBondContact O-N 2.93Å; V179-I181 VanDerWaalsContact C-N 3.31Å; V179-I181 PolarHBondContact O-N 3.13Å; I181-I183 VanDerWaalsContact C-N 3.32Å; I181-I183 PolarHBondContact O-N 3.3Å; I181-S184 PolarHBondContact O-N 2.82Å; I181-S184 PolarHBondContact O-OG 2.87Å; I181-L185 PolarHBondContact O-N 2.93Å
182P90.5Very high87.3Confident56 Ų5635 Ų3536%0.36419%0.185SC..Hα-helixtrans-65.4-37.9173.924.5-33.1000111.5M71 S178 V179 S184 L185 L186M71-P182 HydrophobicContact CE-CG 4.45Å; S178-P182 VanDerWaalsContact O-CD 3.27Å; S178-P182 WeakPolarHBondContact O-CD 3.3Å; V179-P182 WeakPolarHBondContact O-CD 3.41Å; V179-P182 WeakPolarHBondContact O-CG 3.24Å; P182-S184 VanDerWaalsContact C-N 3.31Å; P182-S184 PolarHBondContact O-N 3.3Å; P182-L185 PolarHBondContact O-N 2.84Å; P182-L186 WeakPolarHBondContact O-CD1 3.35Å; P182-L186 PolarHBondContact O-N 3.46Å; P182-L186 VanDerWaalsContact O-N 3.07Å
183I90.4Very high87.9Confident11 Ų1142.9 Ų42.96%0.05621%0.213CC..Hα-helixtrans-59.2-41.6178.7-69.9171.3000111.8V179 F180 I181 L185 L186 W187 L198V179-I183 HydrophobicContact CG1-CD1 3.92Å; V179-I183 WeakPolarHBondContact O-CD1 3.21Å; V179-I183 WeakPolarHBondContact O-CG1 3.35Å; F180-I183 PolarHBondContact O-N 3.44Å; I181-I183 VanDerWaalsContact C-N 3.32Å; I181-I183 PolarHBondContact O-N 3.3Å; I183-L185 VanDerWaalsContact C-N 3.3Å; I183-L185 PolarHBondContact O-N 3.47Å; I183-L186 WeakPolarHBondContact O-CB 3.19Å; I183-L186 PolarHBondContact O-N 3.47Å; I183-L186 VanDerWaalsContact O-N 3.11Å; I183-W187 HydrophobicContact CG2-CZ2 4.43Å; I183-W187 PolarHBondContact O-N 2.9Å; I183-W187 VanDerWaalsContact O-N 3.16Å; I183-L198 HydrophobicContact CG2-CB 3.85Å
184S92Very high88.2Confident1 Ų145.7 Ų45.71%0.00723%0.225CC..Hα-helixtrans-67.1-32.5-178.374.70000112T103 F180 I181 P182 W187T103-S184 VanDerWaalsContact CB-OG 3.24Å; T103-S184 WeakPolarHBondContact CB-OG 3.36Å; T103-S184 PolarHBondContact OG1-OG 3.33Å; F180-S184 VanDerWaalsContact O-CB 3.3Å; F180-S184 WeakPolarHBondContact O-CB 3.37Å; F180-S184 PolarHBondContact O-N 3.37Å; F180-S184 PolarHBondContact O-OG 3.21Å; I181-S184 PolarHBondContact O-N 2.82Å; I181-S184 PolarHBondContact O-OG 2.87Å; P182-S184 VanDerWaalsContact C-N 3.31Å; P182-S184 PolarHBondContact O-N 3.3Å; S184-W187 WeakPolarHBondContact O-CB 3.38Å; S184-W187 PolarHBondContact O-N 3.2Å
185L90.1Very high88.4Confident83 Ų8348.1 Ų48.144%0.43523%0.234SC..Hα-helixtrans-69.5-38.5170.6-66.9175.4000111.8T103 I181 P182 I183 W187 A188T103-L185 HydrophobicContact CG2-CD2 4.24Å; T103-L185 HydrophobicContact CG2-CG 4.41Å; I181-L185 PolarHBondContact O-N 2.93Å; P182-L185 PolarHBondContact O-N 2.84Å; I183-L185 VanDerWaalsContact C-N 3.3Å; I183-L185 PolarHBondContact O-N 3.47Å; L185-W187 PolarHBondContact O-N 2.91Å; L185-A188 VanDerWaalsContact O-CB 3.23Å; L185-A188 WeakPolarHBondContact O-CB 3.29Å; L185-A188 PolarHBondContact O-N 3.2Å; L185-A188 VanDerWaalsContact O-N 3.08Å
186L90.6Very high88.9Confident79 Ų7954.9 Ų54.941%0.41426%0.26SS..Hα-helixtrans-64.7-21.7176.4-90.373.8000112.9P182 I183 A188 V189 F194 L198P182-L186 WeakPolarHBondContact O-CD1 3.35Å; P182-L186 PolarHBondContact O-N 3.46Å; P182-L186 VanDerWaalsContact O-N 3.07Å; I183-L186 WeakPolarHBondContact O-CB 3.19Å; I183-L186 PolarHBondContact O-N 3.47Å; I183-L186 VanDerWaalsContact O-N 3.11Å; L186-A188 PolarHBondContact O-N 3.05Å; L186-A188 VanDerWaalsContact O-N 3.13Å; L186-V189 PolarHBondContact O-N 3.21Å; L186-F194 HydrophobicContact CD2-CZ 4.4Å; L186-L198 HydrophobicContact CB-CD1 3.68Å; L186-L198 HydrophobicContact CD2-CD1 4.24Å; L186-L198 HydrophobicContact CD2-CD2 4.2Å
187W88.2Confident89.3Confident45 Ų4558.6 Ų58.617%0.1728%0.279CS..THydrogen-bonded Turntrans-64.2-10171.8-69.4-14.8000114.3A104 I183 S184 L185 V189 R195 T199A104-W187 HydrophobicContact CB-CZ3 4.45Å; I183-W187 HydrophobicContact CG2-CZ2 4.43Å; I183-W187 PolarHBondContact O-N 2.9Å; I183-W187 VanDerWaalsContact O-N 3.16Å; S184-W187 WeakPolarHBondContact O-CB 3.38Å; S184-W187 PolarHBondContact O-N 3.2Å; L185-W187 PolarHBondContact O-N 2.91Å; W187-V189 PolarHBondContact O-N 3.39Å; W187-R195 HydrophobicContact CB-CG 4.45Å; W187-R195 HydrophobicContact CG-CG 4.31Å; W187-T199 VanDerWaalsContact CZ2-OG1 3.25Å; W187-T199 WeakPolarHBondContact CZ2-OG1 3.28Å
188A86.8Confident89.5Confident9 Ų959.3 Ų59.37%0.07428%0.283CS..THydrogen-bonded Turntrans-57.6-25.6167.600000112.1G107 L110 G111 L114 L185 L186 N190G107-A188 WeakPolarHBondContact O-CA 3.26Å; L110-A188 HydrophobicContact CB-CB 4.04Å; L110-A188 HydrophobicContact CD2-CB 4Å; L110-A188 HydrophobicContact CG-CB 4.31Å; G111-A188 WeakPolarHBondContact CA-O 3.49Å; L114-A188 HydrophobicContact CD1-CB 4.45Å; L185-A188 VanDerWaalsContact O-CB 3.23Å; L185-A188 WeakPolarHBondContact O-CB 3.29Å; L185-A188 PolarHBondContact O-N 3.2Å; L185-A188 VanDerWaalsContact O-N 3.08Å; L186-A188 PolarHBondContact O-N 3.05Å; L186-A188 VanDerWaalsContact O-N 3.13Å; A188-N190 PolarHBondContact O-N 2.64Å; A188-N190 VanDerWaalsContact O-N 3.15Å
189V86.3Confident89.6Confident68 Ų6860.9 Ų60.941%0.41229%0.292SS..SBendtrans-75.1103.5168.8-175.40000108.6L186 W187 I191 F194L186-V189 PolarHBondContact O-N 3.21Å; W187-V189 PolarHBondContact O-N 3.39Å; V189-I191 HydrophobicContact CG1-CB 4.45Å; V189-I191 HydrophobicContact CG1-CD1 3.72Å; V189-I191 HydrophobicContact CG1-CG1 3.91Å; V189-I191 PolarHBondContact O-N 2.71Å; V189-F194 HydrophobicContact CB-CD1 4.25Å; V189-F194 HydrophobicContact CB-CE1 4.32Å; V189-F194 HydrophobicContact CG1-CD1 4.35Å
190N83.1Confident89.9Confident65 Ų6565.9 Ų65.935%0.34832%0.318SS..  trans-77.550.8-172.4-158-7.8000113.6G111 A188G111-N190 PolarHBondContact O-ND2 2.86Å; A188-N190 PolarHBondContact O-N 2.64Å; A188-N190 VanDerWaalsContact O-N 3.15Å
191I86.6Confident89.9Confident93 Ų9370.4 Ų70.448%0.47734%0.338SS..  trans-107.3114.4175.2-60.5171.8000108.2V189 W193 F194 R195V189-I191 HydrophobicContact CG1-CB 4.45Å; V189-I191 HydrophobicContact CG1-CD1 3.72Å; V189-I191 HydrophobicContact CG1-CG1 3.91Å; V189-I191 PolarHBondContact O-N 2.71Å; I191-W193 PolarHBondContact O-N 3.32Å; I191-F194 HydrophobicContact CB-CB 3.91Å; I191-F194 HydrophobicContact CG2-CB 3.94Å; I191-F194 WeakPolarHBondContact O-CB 3.3Å; I191-F194 PolarHBondContact O-N 3.33Å; I191-F194 VanDerWaalsContact O-N 3.13Å; I191-R195 PolarHBondContact O-N 3.46Å
192Q87.6Confident89.9Confident121 Ų12168.4 Ų68.457%0.56533%0.327SS*.Hα-helixtrans-56.2-50.1-171.2-175.765.8-1.300113.3F194 R195 W196Q192-F194 VanDerWaalsContact C-N 3.32Å; Q192-F194 PolarHBondContact O-N 3.15Å; Q192-R195 PolarHBondContact O-N 3.01Å; Q192-W196 VanDerWaalsContact NE2-NE1 3.13Å; Q192-W196 VanDerWaalsContact O-CD1 3.24Å; Q192-W196 PolarHBondContact O-N 2.8Å
193W91.7Very high89.9Confident180 Ų18068.7 Ų68.768%0.68233%0.328SS*.Hα-helixtrans-62-39.6179.1160.774000112.4I191 R195 W196 L197I191-W193 PolarHBondContact O-N 3.32Å; W193-R195 PolarHBondContact O-N 2.79Å; W193-W196 PolarHBondContact O-N 2.69Å; W193-L197 HydrophobicContact CH2-CD1 4.34Å; W193-L197 HydrophobicContact CZ2-CD1 3.52Å; W193-L197 WeakPolarHBondContact O-CB 3.49Å; W193-L197 PolarHBondContact O-N 3.07Å
194F90.5Very high89.8Confident61 Ų6175.6 Ų75.627%0.26836%0.358SS..Hα-helixtrans-64.7-40.7179.3-174.8-114000111.6L186 V189 I191 Q192 W196 L197 L198L186-F194 HydrophobicContact CD2-CZ 4.4Å; V189-F194 HydrophobicContact CB-CD1 4.25Å; V189-F194 HydrophobicContact CB-CE1 4.32Å; V189-F194 HydrophobicContact CG1-CD1 4.35Å; I191-F194 HydrophobicContact CB-CB 3.91Å; I191-F194 HydrophobicContact CG2-CB 3.94Å; I191-F194 WeakPolarHBondContact O-CB 3.3Å; I191-F194 PolarHBondContact O-N 3.33Å; I191-F194 VanDerWaalsContact O-N 3.13Å; Q192-F194 VanDerWaalsContact C-N 3.32Å; Q192-F194 PolarHBondContact O-N 3.15Å; F194-W196 PolarHBondContact O-N 3.21Å; F194-L197 PolarHBondContact O-N 2.89Å; F194-L198 HydrophobicContact CD1-CD1 3.8Å; F194-L198 HydrophobicContact CD1-CG 4.46Å; F194-L198 HydrophobicContact CE1-CD1 3.41Å; F194-L198 VanDerWaalsContact CE1-CD1 3.41Å; F194-L198 HydrophobicContact CE1-CG 4.18Å; F194-L198 HydrophobicContact CE2-CD1 4.41Å; F194-L198 HydrophobicContact CE2-CG 4.33Å; F194-L198 HydrophobicContact CG-CD1 4.46Å; F194-L198 HydrophobicContact CZ-CD1 3.75Å; F194-L198 HydrophobicContact CZ-CD2 4.26Å; F194-L198 HydrophobicContact CZ-CG 4.1Å; F194-L198 WeakPolarHBondContact O-CB 3.49Å; F194-L198 WeakPolarHBondContact O-CG 3.41Å; F194-L198 PolarHBondContact O-N 3.08Å
195R90.4Very high89.6Confident52 Ų5277.8 Ų77.820%0.19637%0.369CS..Hα-helixtrans-59.7-47174.6-66.7176.481167.56.6111.3N108 W187 I191 Q192 W193 L198 T199N108-R195 PolarHBondContact OD1-NH2 3.44Å; W187-R195 HydrophobicContact CB-CG 4.45Å; W187-R195 HydrophobicContact CG-CG 4.31Å; I191-R195 PolarHBondContact O-N 3.46Å; Q192-R195 PolarHBondContact O-N 3.01Å; W193-R195 PolarHBondContact O-N 2.79Å; R195-L198 PolarHBondContact O-N 2.79Å; R195-T199 PolarHBondContact O-N 2.99Å; R195-T199 PolarHBondContact O-OG1 3.4Å
196W91.8Very high89.4Confident151 Ų15173.9 Ų73.957%0.57235%0.348SS*.Hα-helixtrans-62.4-42.7176.9-79.7106.5000112.9Q192 W193 F194 T199 L200Q192-W196 VanDerWaalsContact NE2-NE1 3.13Å; Q192-W196 VanDerWaalsContact O-CD1 3.24Å; Q192-W196 PolarHBondContact O-N 2.8Å; W193-W196 PolarHBondContact O-N 2.69Å; F194-W196 PolarHBondContact O-N 3.21Å; W196-T199 PolarHBondContact O-N 3.5Å; W196-L200 WeakPolarHBondContact O-CB 3.41Å; W196-L200 WeakPolarHBondContact O-CG 3.47Å; W196-L200 PolarHBondContact O-N 2.95Å
197L94Very high89.2Confident78 Ų7871 Ų7141%0.40834%0.339SS..Hα-helixtrans-62-45.6178.6-167.9149.6000111.1W193 F194 L200 F201W193-L197 HydrophobicContact CH2-CD1 4.34Å; W193-L197 HydrophobicContact CZ2-CD1 3.52Å; W193-L197 WeakPolarHBondContact O-CB 3.49Å; W193-L197 PolarHBondContact O-N 3.07Å; F194-L197 PolarHBondContact O-N 2.89Å; L197-L200 PolarHBondContact O-N 3.4Å; L197-F201 VanDerWaalsContact O-CB 3.28Å; L197-F201 WeakPolarHBondContact O-CB 3.39Å; L197-F201 PolarHBondContact O-N 3.02Å
198L91.6Very high88.9Confident17 Ų1769.9 Ų69.99%0.08934%0.34CS..Hα-helixtrans-62.3-41.5174.9-73.8175.9000112.6I183 L186 F194 R195 F201 G202I183-L198 HydrophobicContact CG2-CB 3.85Å; L186-L198 HydrophobicContact CB-CD1 3.68Å; L186-L198 HydrophobicContact CD2-CD1 4.24Å; L186-L198 HydrophobicContact CD2-CD2 4.2Å; F194-L198 HydrophobicContact CD1-CD1 3.8Å; F194-L198 HydrophobicContact CD1-CG 4.46Å; F194-L198 HydrophobicContact CE1-CD1 3.41Å; F194-L198 VanDerWaalsContact CE1-CD1 3.41Å; F194-L198 HydrophobicContact CE1-CG 4.18Å; F194-L198 HydrophobicContact CE2-CD1 4.41Å; F194-L198 HydrophobicContact CE2-CG 4.33Å; F194-L198 HydrophobicContact CG-CD1 4.46Å; F194-L198 HydrophobicContact CZ-CD1 3.75Å; F194-L198 HydrophobicContact CZ-CD2 4.26Å; F194-L198 HydrophobicContact CZ-CG 4.1Å; F194-L198 WeakPolarHBondContact O-CB 3.49Å; F194-L198 WeakPolarHBondContact O-CG 3.41Å; F194-L198 PolarHBondContact O-N 3.08Å; R195-L198 PolarHBondContact O-N 2.79Å; L198-F201 PolarHBondContact O-N 3.41Å; L198-G202 PolarHBondContact O-N 2.84Å
199T90.6Very high88.6Confident39 Ų3970.7 Ų70.724%0.23935%0.345CS..Hα-helixtrans-62.4-48.3176.8-56.60000111.2W187 R195 W196 F201 G202 V203W187-T199 VanDerWaalsContact CZ2-OG1 3.25Å; W187-T199 WeakPolarHBondContact CZ2-OG1 3.28Å; R195-T199 PolarHBondContact O-N 2.99Å; R195-T199 PolarHBondContact O-OG1 3.4Å; W196-T199 PolarHBondContact O-N 3.5Å; T199-F201 VanDerWaalsContact C-N 3.29Å; T199-F201 PolarHBondContact O-N 3.47Å; T199-G202 PolarHBondContact O-N 3.43Å; T199-V203 WeakPolarHBondContact O-CG2 3.28Å; T199-V203 PolarHBondContact O-N 3.2Å
200L93.2Very high88.2Confident116 Ų11667.7 Ų67.761%0.60733%0.326SS*.Hα-helixtrans-61.5-40.8177.8-72.3173.8000111.5W196 L197 V203 F204W196-L200 WeakPolarHBondContact O-CB 3.41Å; W196-L200 WeakPolarHBondContact O-CG 3.47Å; W196-L200 PolarHBondContact O-N 2.95Å; L197-L200 PolarHBondContact O-N 3.4Å; L200-V203 PolarHBondContact O-N 3.18Å; L200-F204 VanDerWaalsContact O-CB 3.28Å; L200-F204 WeakPolarHBondContact O-CB 3.1Å; L200-F204 PolarHBondContact O-N 2.87Å
201F91.4Very high88.1Confident112 Ų11269.1 Ų69.149%0.49133%0.333SS..Hα-helixtrans-62.8-44.1176.2-174.6-109.2000112L197 L198 T199 F204 L205L197-F201 VanDerWaalsContact O-CB 3.28Å; L197-F201 WeakPolarHBondContact O-CB 3.39Å; L197-F201 PolarHBondContact O-N 3.02Å; L198-F201 PolarHBondContact O-N 3.41Å; T199-F201 VanDerWaalsContact C-N 3.29Å; T199-F201 PolarHBondContact O-N 3.47Å; F201-F204 PolarHBondContact O-N 3Å; F201-L205 HydrophobicContact CD1-CD1 3.69Å; F201-L205 HydrophobicContact CE1-CD1 3.22Å; F201-L205 HydrophobicContact CE1-CG 4.38Å; F201-L205 HydrophobicContact CE2-CD1 4.11Å; F201-L205 HydrophobicContact CG-CD1 4.32Å; F201-L205 HydrophobicContact CZ-CD1 3.46Å; F201-L205 VanDerWaalsContact CZ-CD1 3.46Å; F201-L205 HydrophobicContact CZ-CG 4.29Å; F201-L205 WeakPolarHBondContact O-CB 3.23Å; F201-L205 PolarHBondContact O-N 3.39Å
202G89.6Confident87.8Confident0 Ų069 Ų690%033%0.333CS..Hα-helixtrans-60.6-48.1174.500000112.5L198 T199 F204 L205 S206L198-G202 PolarHBondContact O-N 2.84Å; T199-G202 PolarHBondContact O-N 3.43Å; G202-F204 VanDerWaalsContact C-N 3.3Å; G202-F204 PolarHBondContact O-N 3.19Å; G202-L205 PolarHBondContact O-N 3.47Å; G202-S206 PolarHBondContact O-N 3.44Å; G202-S206 PolarHBondContact O-OG 2.98Å; G202-S206 VanDerWaalsContact O-OG 3.09Å
203V90.9Very high87.2Confident61 Ų6164 Ų6437%0.3731%0.311SS..Hα-helixtrans-60.9-40.7177.5170.50000111.2F180 T199 L200 S206 G207F180-V203 HydrophobicContact CZ-CG2 3.86Å; F180-V203 VanDerWaalsContact CZ-N 3.34Å; T199-V203 WeakPolarHBondContact O-CG2 3.28Å; T199-V203 PolarHBondContact O-N 3.2Å; L200-V203 PolarHBondContact O-N 3.18Å; V203-S206 PolarHBondContact O-OG 3.26Å; V203-G207 WeakPolarHBondContact O-CA 3.33Å; V203-G207 PolarHBondContact O-N 3.18Å
204F89.8Confident86.4Confident157 Ų15755.7 Ų55.769%0.68928%0.28SS*.Hα-helixtrans-67.2-42.8178.4-178.2-98.7000111.9L200 F201 G202 G208L200-F204 VanDerWaalsContact O-CB 3.28Å; L200-F204 WeakPolarHBondContact O-CB 3.1Å; L200-F204 PolarHBondContact O-N 2.87Å; F201-F204 PolarHBondContact O-N 3Å; G202-F204 VanDerWaalsContact C-N 3.3Å; G202-F204 PolarHBondContact O-N 3.19Å; F204-G208 WeakPolarHBondContact O-CA 3.39Å; F204-G208 PolarHBondContact O-N 3.07Å
205L86.1Confident85.9Confident47 Ų4759.9 Ų59.925%0.24629%0.294CS..Hα-helixtrans-66-50.3177.3-84.3166.2000112V179 F201 G202 G208 V209V179-L205 HydrophobicContact CG1-CB 4.24Å; V179-L205 HydrophobicContact CG1-CD1 3.84Å; F201-L205 HydrophobicContact CD1-CD1 3.69Å; F201-L205 HydrophobicContact CE1-CD1 3.22Å; F201-L205 HydrophobicContact CE1-CG 4.38Å; F201-L205 HydrophobicContact CE2-CD1 4.11Å; F201-L205 HydrophobicContact CG-CD1 4.32Å; F201-L205 HydrophobicContact CZ-CD1 3.46Å; F201-L205 VanDerWaalsContact CZ-CD1 3.46Å; F201-L205 HydrophobicContact CZ-CG 4.29Å; F201-L205 WeakPolarHBondContact O-CB 3.23Å; F201-L205 PolarHBondContact O-N 3.39Å; G202-L205 PolarHBondContact O-N 3.47Å; L205-G208 PolarHBondContact O-N 2.87Å; L205-V209 WeakPolarHBondContact O-CG2 3.45Å; L205-V209 PolarHBondContact O-N 3.48Å
206S87.4Confident85.2Confident0 Ų059.5 Ų59.50%030%0.298CS..Hα-helixtrans-63.7-45.2179.461.80000111.5Y143 G202 V203 G208 V209 L210Y143-S206 PolarHBondContact OH-OG 3.36Å; G202-S206 PolarHBondContact O-N 3.44Å; G202-S206 PolarHBondContact O-OG 2.98Å; G202-S206 VanDerWaalsContact O-OG 3.09Å; V203-S206 PolarHBondContact O-OG 3.26Å; S206-G208 VanDerWaalsContact C-N 3.34Å; S206-G208 PolarHBondContact O-N 2.95Å; S206-V209 PolarHBondContact O-N 3.05Å; S206-L210 PolarHBondContact O-N 2.87Å
207G85.1Confident84.3Confident20 Ų2053.1 Ų53.121%0.20628%0.276CS..Hα-helixtrans-64.5-37.5175.900000112.6V203 L210 L211V203-G207 WeakPolarHBondContact O-CA 3.33Å; V203-G207 PolarHBondContact O-N 3.18Å; G207-L210 PolarHBondContact O-N 3.42Å; G207-L211 WeakPolarHBondContact O-CB 3.19Å; G207-L211 WeakPolarHBondContact O-CG 3.4Å; G207-L211 PolarHBondContact O-N 3.34Å
208G82.7Confident83.4Confident20 Ų2051.8 Ų51.821%0.20627%0.271CS..Hα-helixtrans-62.4-44.8175.600000112.5F204 L205 S206 L210 L211 L212F204-G208 WeakPolarHBondContact O-CA 3.39Å; F204-G208 PolarHBondContact O-N 3.07Å; L205-G208 PolarHBondContact O-N 2.87Å; S206-G208 VanDerWaalsContact C-N 3.34Å; S206-G208 PolarHBondContact O-N 2.95Å; G208-L210 VanDerWaalsContact C-N 3.31Å; G208-L210 PolarHBondContact O-N 2.83Å; G208-L211 PolarHBondContact O-N 3.12Å; G208-L212 WeakPolarHBondContact O-CB 3.48Å; G208-L212 WeakPolarHBondContact O-CG 3.33Å; G208-L212 PolarHBondContact O-N 2.87Å
209V79.3Confident82.7Confident27 Ų2757.8 Ų57.816%0.16429%0.293CS..Hα-helixtrans-59.9-42.3176.2171.40000111.3L205 S206 S213L205-V209 WeakPolarHBondContact O-CG2 3.45Å; L205-V209 PolarHBondContact O-N 3.48Å; S206-V209 PolarHBondContact O-N 3.05Å; V209-S213 WeakPolarHBondContact O-CB 3.4Å; V209-S213 PolarHBondContact O-N 3.32Å; V209-S213 PolarHBondContact O-OG 2.77Å
210L79.1Confident81.9Confident4 Ų461.2 Ų61.22%0.02130%0.304CS..Hα-helixtrans-66.1-47.3177.1-167.292000111.8V147 F151 Y173 S206 G207 G208 L212 S213 I214V147-L210 HydrophobicContact CG1-CD2 3.81Å; F151-L210 HydrophobicContact CD2-CD2 3.31Å; F151-L210 HydrophobicContact CE2-CD2 3.18Å; F151-L210 HydrophobicContact CE2-CG 4.46Å; F151-L210 HydrophobicContact CG-CD2 4.11Å; F151-L210 HydrophobicContact CZ-CD2 3.87Å; Y173-L210 HydrophobicContact CD2-CB 4.12Å; Y173-L210 HydrophobicContact CD2-CD1 3.7Å; Y173-L210 HydrophobicContact CD2-CD2 4.47Å; Y173-L210 HydrophobicContact CD2-CG 4.32Å; Y173-L210 HydrophobicContact CG-CD1 4Å; S206-L210 PolarHBondContact O-N 2.87Å; G207-L210 PolarHBondContact O-N 3.42Å; G208-L210 VanDerWaalsContact C-N 3.31Å; G208-L210 PolarHBondContact O-N 2.83Å; L210-L212 VanDerWaalsContact C-N 3.33Å; L210-L212 PolarHBondContact O-N 3.27Å; L210-S213 WeakPolarHBondContact O-CB 3.39Å; L210-S213 PolarHBondContact O-N 2.86Å; L210-S213 VanDerWaalsContact O-N 3.11Å; L210-I214 HydrophobicContact CD2-CD1 4.15Å; L210-I214 HydrophobicContact CG-CD1 3.91Å; L210-I214 WeakPolarHBondContact O-CB 3.44Å; L210-I214 WeakPolarHBondContact O-CG1 3.36Å; L210-I214 PolarHBondContact O-N 3.4Å
211L80.9Confident80.7Confident96 Ų9657.5 Ų57.550%0.50328%0.284SS..Hα-helixtrans-57.6-46.1176.7-84.1164.3000111.3F151 G207 G208 S213 I214 W215F151-L211 HydrophobicContact CZ-CD2 4.26Å; G207-L211 WeakPolarHBondContact O-CB 3.19Å; G207-L211 WeakPolarHBondContact O-CG 3.4Å; G207-L211 PolarHBondContact O-N 3.34Å; G208-L211 PolarHBondContact O-N 3.12Å; L211-S213 VanDerWaalsContact C-N 3.28Å; L211-S213 PolarHBondContact O-N 3.21Å; L211-I214 PolarHBondContact O-N 3.42Å; L211-W215 WeakPolarHBondContact O-CA 3.4Å; L211-W215 WeakPolarHBondContact O-CB 3.46Å; L211-W215 PolarHBondContact O-N 3.28Å
212L79.3Confident79.7Confident89 Ų8955.2 Ų55.247%0.46628%0.282SS..Hα-helixtrans-63.6-33.9177.1-70.6172.4000112.4P73 G208 L210 P216P73-L212 HydrophobicContact CB-CD1 4.43Å; G208-L212 WeakPolarHBondContact O-CB 3.48Å; G208-L212 WeakPolarHBondContact O-CG 3.33Å; G208-L212 PolarHBondContact O-N 2.87Å; L210-L212 VanDerWaalsContact C-N 3.33Å; L210-L212 PolarHBondContact O-N 3.27Å; L212-P216 VanDerWaalsContact O-CD 3.27Å; L212-P216 WeakPolarHBondContact O-CD 3.32Å
213S75.5Confident78.8Confident16 Ų1663.8 Ų63.811%0.11231%0.314CS..Hα-helixtrans-71.4-34.9177-60.50000112.3V209 L210 L211 P216V209-S213 WeakPolarHBondContact O-CB 3.4Å; V209-S213 PolarHBondContact O-N 3.32Å; V209-S213 PolarHBondContact O-OG 2.77Å; L210-S213 WeakPolarHBondContact O-CB 3.39Å; L210-S213 PolarHBondContact O-N 2.86Å; L210-S213 VanDerWaalsContact O-N 3.11Å; L211-S213 VanDerWaalsContact C-N 3.28Å; L211-S213 PolarHBondContact O-N 3.21Å; S213-P216 WeakPolarHBondContact O-CD 3.43Å
214I76.2Confident77.7Confident6 Ų666.1 Ų66.13%0.03132%0.324CS..Hα-helixtrans-87.3-30-177.8-72.7175.3000112.5F151 F155 L169 L210 L211 P216 V217 V218F151-I214 HydrophobicContact CB-CD1 4.04Å; F151-I214 HydrophobicContact CD1-CD1 3.24Å; F151-I214 HydrophobicContact CD1-CG2 4.31Å; F151-I214 HydrophobicContact CD2-CD1 4.28Å; F151-I214 HydrophobicContact CE1-CD1 3.61Å; F151-I214 HydrophobicContact CE1-CG2 4.21Å; F151-I214 HydrophobicContact CG-CD1 3.59Å; F151-I214 HydrophobicContact CZ-CD1 4.28Å; F155-I214 HydrophobicContact CE1-CG2 3.8Å; F155-I214 HydrophobicContact CE2-CD1 4.18Å; F155-I214 HydrophobicContact CE2-CG1 4.44Å; F155-I214 HydrophobicContact CZ-CB 4.22Å; F155-I214 HydrophobicContact CZ-CD1 3.93Å; F155-I214 HydrophobicContact CZ-CG1 3.94Å; F155-I214 HydrophobicContact CZ-CG2 3.4Å; F155-I214 VanDerWaalsContact CZ-CG2 3.4Å; L169-I214 HydrophobicContact CD2-CD1 4.23Å; L210-I214 HydrophobicContact CD2-CD1 4.15Å; L210-I214 HydrophobicContact CG-CD1 3.91Å; L210-I214 WeakPolarHBondContact O-CB 3.44Å; L210-I214 WeakPolarHBondContact O-CG1 3.36Å; L210-I214 PolarHBondContact O-N 3.4Å; L211-I214 PolarHBondContact O-N 3.42Å; I214-P216 VanDerWaalsContact C-N 3.34Å; I214-V217 WeakPolarHBondContact O-CB 3.42Å; I214-V217 PolarHBondContact O-N 3.04Å; I214-V218 HydrophobicContact CG2-CG2 3.74Å; I214-V218 PolarHBondContact O-N 3.45Å
215W78.5Confident76.5Confident150 Ų15063.6 Ų63.657%0.56832%0.321SS*.Hα-helixtrans-48.8-43.6-176.8-176.2-98.5000114.6L211 V217 V218 R219L211-W215 WeakPolarHBondContact O-CA 3.4Å; L211-W215 WeakPolarHBondContact O-CB 3.46Å; L211-W215 PolarHBondContact O-N 3.28Å; W215-V217 VanDerWaalsContact C-N 3.31Å; W215-V217 PolarHBondContact O-N 3.4Å; W215-V218 PolarHBondContact O-N 2.98Å; W215-R219 VanDerWaalsContact O-CB 3.3Å; W215-R219 WeakPolarHBondContact O-CB 3.37Å; W215-R219 PolarHBondContact O-N 3.42Å
216P75.6Confident75.5Confident43 Ų4367 Ų6728%0.27935%0.348SS..Hα-helixtrans-61.7-38.8179.3-19.631.8000112.6N78 L212 S213 I214 K220N78-P216 WeakPolarHBondContact OD1-CG 3.27Å; L212-P216 VanDerWaalsContact O-CD 3.27Å; L212-P216 WeakPolarHBondContact O-CD 3.32Å; S213-P216 WeakPolarHBondContact O-CD 3.43Å; I214-P216 VanDerWaalsContact C-N 3.34Å; P216-K220 WeakPolarHBondContact O-CB 3.42Å; P216-K220 PolarHBondContact O-N 2.96Å
217V74.3Confident73.7Confident17 Ų1778.7 Ų78.710%0.10340%0.398CS..Hα-helixtrans-68.2-48.5-179.5175.50000110.7D162 Y164 I214 W215 R219 K220 H221D162-V217 VanDerWaalsContact O-CG1 3.28Å; D162-V217 WeakPolarHBondContact O-CG1 3.32Å; Y164-V217 HydrophobicContact CD2-CG2 4.11Å; Y164-V217 HydrophobicContact CE1-CG2 4.46Å; Y164-V217 HydrophobicContact CE2-CB 4.31Å; Y164-V217 HydrophobicContact CE2-CG2 3.27Å; Y164-V217 VanDerWaalsContact CZ-CG2 3.48Å; Y164-V217 WeakPolarHBondContact OH-CG2 3.42Å; I214-V217 WeakPolarHBondContact O-CB 3.42Å; I214-V217 PolarHBondContact O-N 3.04Å; W215-V217 VanDerWaalsContact C-N 3.31Å; W215-V217 PolarHBondContact O-N 3.4Å; V217-R219 VanDerWaalsContact C-N 3.3Å; V217-R219 PolarHBondContact O-N 2.95Å; V217-K220 PolarHBondContact O-N 2.85Å; V217-H221 PolarHBondContact O-N 3.48Å
218V74.7Confident73.2Confident51 Ų5181.7 Ų81.731%0.30941%0.408SS..Hα-helixtrans-60.8-42.4177.61740000110.8F155 I214 W215 K220 H221 S222F155-V218 HydrophobicContact CE1-CG2 4.04Å; I214-V218 HydrophobicContact CG2-CG2 3.74Å; I214-V218 PolarHBondContact O-N 3.45Å; W215-V218 PolarHBondContact O-N 2.98Å; V218-K220 PolarHBondContact O-N 3.03Å; V218-H221 PolarHBondContact O-N 3.09Å; V218-S222 PolarHBondContact O-N 3.27Å
219R76.2Confident72.7Confident143 Ų14384.9 Ų84.954%0.5442%0.419SS..Hα-helixtrans-66.6-37.7179.2-155.5-179.1-149.9-1726.8112W215 V217 S222 R223W215-R219 VanDerWaalsContact O-CB 3.3Å; W215-R219 WeakPolarHBondContact O-CB 3.37Å; W215-R219 PolarHBondContact O-N 3.42Å; V217-R219 VanDerWaalsContact C-N 3.3Å; V217-R219 PolarHBondContact O-N 2.95Å; R219-S222 PolarHBondContact O-OG 3.31Å; R219-R223 PolarHBondContact O-N 3.09Å
220K73.2Confident72.3Confident110 Ų11088.1 Ų88.148%0.47843%0.433SS..Hα-helixtrans-61.9-47.9175.2-170-175.7177.7-163.30110.8D162 P216 V217 V218 S222 R223 L224D162-K220 WeakPolarHBondContact OD2-CE 3.35Å; D162-K220 IonicContact OD2-NZ 2.69Å; D162-K220 PolarHBondContact OD2-NZ 3.05Å; P216-K220 WeakPolarHBondContact O-CB 3.42Å; P216-K220 PolarHBondContact O-N 2.96Å; V217-K220 PolarHBondContact O-N 2.85Å; V218-K220 PolarHBondContact O-N 3.03Å; K220-S222 PolarHBondContact O-N 3.03Å; K220-R223 PolarHBondContact O-N 2.81Å; K220-L224 PolarHBondContact O-N 3.32Å
221H69.7Low71.9Confident38 Ų3893.1 Ų93.118%0.17646%0.457CS..Hα-helixtrans-62.4-42.4178.5-170.8-85.4000112.8M160 V217 V218 R223 L224 V225M160-H221 HydrophobicContact CE-CB 3.33Å; M160-H221 HydrophobicContact SD-CB 3.89Å; M160-H221 PolarHBondContact SD-CD2 3.23Å; M160-H221 PolarHBondContact SD-CE1 3.36Å; M160-H221 PolarHBondContact SD-ND1 3.27Å; M160-H221 PolarHBondContact SD-NE2 3.37Å; M160-H221 VanDerWaalsContact SD-NE2 3.41Å; V217-H221 PolarHBondContact O-N 3.48Å; V218-H221 PolarHBondContact O-N 3.09Å; H221-R223 PolarHBondContact O-N 2.82Å; H221-R223 VanDerWaalsContact O-N 3.16Å; H221-L224 PolarHBondContact O-N 2.82Å; H221-V225 WeakPolarHBondContact CE1-CG2 3.28Å; H221-V225 PolarHBondContact O-N 3.19Å; H221-V225 VanDerWaalsContact O-N 3.13Å
222S70.3Confident71.4Confident64 Ų6492.9 Ų92.945%0.44845%0.454SS..Hα-helixtrans-58.7-30.5177.770.40000113.4V218 R219 K220V218-S222 PolarHBondContact O-N 3.27Å; R219-S222 PolarHBondContact O-OG 3.31Å; K220-S222 PolarHBondContact O-N 3.03Å
223R70.2Confident70.8Confident181 Ų18193.1 Ų93.168%0.68345%0.454SS*.Hα-helixtrans-78.9-27177-72.9-160.3-88.4-175.7-5.3113.4R219 K220 H221R219-R223 PolarHBondContact O-N 3.09Å; K220-R223 PolarHBondContact O-N 2.81Å; H221-R223 PolarHBondContact O-N 2.82Å; H221-R223 VanDerWaalsContact O-N 3.16Å
224L67.2Low70.5Confident110 Ų11098.6 Ų98.658%0.57648%0.478SS*.Hα-helixtrans-76.3-37.3177-67.3170.7000111.6K220 H221 C226 K227K220-L224 PolarHBondContact O-N 3.32Å; H221-L224 PolarHBondContact O-N 2.82Å; L224-C226 VanDerWaalsContact C-N 3.27Å; L224-C226 PolarHBondContact O-N 3.48Å; L224-K227 PolarHBondContact O-N 3.23Å
225V66Low70Confident103 Ų103105.8 Ų105.862%0.62451%0.512SS*.Hα-helixtrans-71.2-21.9178.6178.30000112.8H221H221-V225 WeakPolarHBondContact CE1-CG2 3.28Å; H221-V225 PolarHBondContact O-N 3.19Å; H221-V225 VanDerWaalsContact O-N 3.13Å
226C63.4Low69.3Low120 Ų120102.1 Ų102.181%0.81151%0.508SS*.THydrogen-bonded Turntrans-96.16.7-177.8-150.30000113.4L224L224-C226 VanDerWaalsContact C-N 3.27Å; L224-C226 PolarHBondContact O-N 3.48Å
227K51.3Low68.8Low245 Ų245107.5 Ų107.5100%1.06553%0.528SS*.  trans-111.50177.6-124.8-173.3-178.2-170.60109.9L224L224-K227 PolarHBondContact O-N 3.23Å

Retrieved 227 of 227 residues in 344.8 ms (Link to these results)