A0A077Z204_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z204, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 288 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
1M37.1Very low34.8Very low223 Ų223147.3 Ų147.3100%1.09982%0.817SS**  082.60-83.9175.316700106
2E34Very low34.8Very low162 Ų162143.7 Ų143.776%0.75781%0.809SS**  70.9102.985.5-73.5176.8140.800109.3
3M33.2Very low34.8Very low149 Ų149145 Ų14573%0.73481%0.813SS**  73.9136.993.7-79.4-179.415800110.1
4E36Very low35Very low163 Ų163146.4 Ų146.476%0.76281%0.807SS**  cis-173.2140.75-106.3160.6155.200103
5S35.6Very low35.4Very low125 Ų125141.8 Ų141.887%0.87478%0.781SS**  trans-107.1110.3160.577.70000109
6S38.1Very low35.6Very low107 Ų107145.1 Ų145.175%0.74879%0.788SS**  trans-60.3123.417148.50000111
7V33.8Very low35.9Very low112 Ų112143.4 Ų143.468%0.67978%0.779SS**  42.4116.3104.2-177.30000114.4
8N36.8Very low36.4Very low170 Ų170142.4 Ų142.491%0.90978%0.778SS**  trans-136.9119.3137.5-93.2-16.8000108.9
9T31.2Very low36.4Very low119 Ų119142.3 Ų142.373%0.7378%0.782SS**  trans-68.3137.2173-44.90000109.8
10E37.5Very low36.6Very low196 Ų196144.8 Ų144.892%0.91678%0.779SS**  trans-157133.1144.8-113.6168.3179.900111.2
11A29.9Very low36.5Very low94 Ų94146.3 Ų146.378%0.77778%0.782SS**  trans-71.4141.8-169.100000112
12S33.7Very low36.7Very low104 Ų104140.1 Ų140.173%0.72776%0.756SS**  trans-129.889.6164.8175.50000107.8F14S12-F14 PolarHBondContact O-N 3.39Å
13D35.4Very low36.7Very low161 Ų161140.3 Ų140.386%0.86176%0.759SS**  trans-55.597.1159-81.5-44.4000108.6
14F37.2Very low36.9Very low165 Ų165138.7 Ų138.772%0.72476%0.76SS**  trans-137.895.1172.8-136.6-99.5000112.8S12S12-F14 PolarHBondContact O-N 3.39Å
15N41.2Very low37Very low77 Ų77139 Ų13941%0.41277%0.765SS.*  trans75.484.7140-12821.5000117.9D17 R71N15-D17 PolarHBondContact O-N 3.15Å; N15-R71 PolarHBondContact OD1-NH2 3.38Å
16Q39.1Very low37.1Very low194 Ų194141.2 Ų141.291%0.90776%0.762SS**  trans-69.78.4167.4-80.2179.6-14.800114.9T18Q16-T18 PolarHBondContact O-N 3Å
17D39.8Very low37Very low117 Ų117147.7 Ų147.763%0.62677%0.77SS**THydrogen-bonded Turntrans-88.78.2-165.8-75.6-15.2000116N15 R71N15-D17 PolarHBondContact O-N 3.15Å; D17-R71 IonicContact OD2-NH2 3.76Å; D17-R71 PolarHBondContact OD2-NH2 2.75Å; D17-R71 VanDerWaalsContact OD2-NH2 3.13Å
18T46Very low37Very low125 Ų125148.5 Ų148.577%0.76777%0.771SS**THydrogen-bonded Turntrans-11010.7-17037.70000117Q16 R20Q16-T18 PolarHBondContact O-N 3Å; T18-R20 PolarHBondContact O-N 3.39Å
19V35.8Very low36.9Very low141 Ų141145.4 Ų145.486%0.85576%0.762SS**  trans-85.490172.8-171.30000109.9
20R41.5Very low37.3Very low192 Ų192147.6 Ų147.673%0.72577%0.768SS**  trans-95.9115163.1-94.7-171.2-179.7-165.30.4109.5T18 V22 Y126T18-R20 PolarHBondContact O-N 3.39Å; R20-V22 PolarHBondContact O-N 3.46Å; R20-Y126 PolarHBondContact NH1-OH 3.2Å
21E33.3Very low37.4Very low177 Ų177146.6 Ų146.683%0.82776%0.764SS**  trans-69.8121.2170.4-162.3172.5-161.900109.1
22V40.8Very low37.6Very low92 Ų92147.5 Ų147.556%0.55876%0.764SS**  trans-103.2111.2172.7-177.90000107.2R20 Y227R20-V22 PolarHBondContact O-N 3.46Å; V22-Y227 PolarHBondContact O-OH 3.15Å
23M35.7Very low37.5Very low167 Ų167146.5 Ų146.582%0.82377%0.77SS**  trans-69.9129.7173-91.2-159153.100110.3
24P36.9Very low37.2Very low115 Ų115144.5 Ų144.575%0.74777%0.769SS**  trans-70.1130.1168.128.3-30000109.4E26P24-E26 PolarHBondContact O-N 3.42Å; P24-E26 VanDerWaalsContact O-N 3.14Å
25L37.8Very low36.9Very low169 Ų169145.8 Ų145.889%0.88578%0.775SS**  trans-67.8103.6173.2-158.493.9000108.4R27L25-R27 PolarHBondContact O-N 3Å
26E37.4Very low36.5Very low172 Ų172147.2 Ų147.280%0.80479%0.786SS**  trans-61119.1168.1-92174.9137.800109P24P24-E26 PolarHBondContact O-N 3.42Å; P24-E26 VanDerWaalsContact O-N 3.14Å
27R37.2Very low36.5Very low243 Ų243144 Ų14492%0.91778%0.779SS**  trans-102.292.8170.3-154.9178.6-167.6164.12.3106.7L25L25-R27 PolarHBondContact O-N 3Å
28D33.7Very low36.1Very low129 Ų129145.2 Ų145.269%0.6979%0.786SS**  trans-64.4141.7174.2-80.5-37.6000112
29S34.8Very low35.7Very low104 Ų104146.1 Ų146.173%0.72779%0.786SS**  trans73.6113.8143.753.10000121.3
30L37.7Very low35.8Very low165 Ų165146.9 Ų146.986%0.86478%0.78SS**  trans147.383.8137.3-82.3155.3000110.5
31E39.6Very low35.4Very low175 Ų175144.1 Ų144.182%0.81878%0.779SS**  55.5114.892.1-100.8-168.212100117.3
32S34.3Very low35.5Very low113 Ų113144 Ų14479%0.7978%0.778SS**  trans85.2117.4133.5-60.90000120.7
33G32.9Very low35Very low83 Ų83147.5 Ų147.586%0.85679%0.794SS**  trans165.686.3161.500000114.7
34S29.3Very low34.7Very low119 Ų119143.9 Ų143.983%0.83278%0.784SS**  trans-70.814117561.70000113.4
35F30.8Very low34.5Very low192 Ų192144.8 Ų144.884%0.84279%0.788SS**  trans-153.3132.2147.9-162.7-108.9000112.4V37F35-V37 HydrophobicContact CD1-CG2 4.08Å; F35-V37 HydrophobicContact CE1-CG2 3.62Å
36V32.7Very low34.1Very low108 Ų108139.5 Ų139.566%0.65577%0.774SS**  trans-95.7133.5-175.4169.10000109.1
37V38.2Very low33.9Very low126 Ų126142 Ų14276%0.76478%0.778SS**  trans-147.8109.4152.8-175.90000108.4F35F35-V37 HydrophobicContact CD1-CG2 4.08Å; F35-V37 HydrophobicContact CE1-CG2 3.62Å
38D31.7Very low33.5Very low142 Ų142139.3 Ų139.376%0.75978%0.776SS**  trans-72.5137.7159.6-76.4-59000109.4
39D38.1Very low33.4Very low144 Ų144139.6 Ų139.677%0.7778%0.782SS**  trans-160.6130.3132-133-10.7000113.4
40E37.9Very low33.3Very low157 Ų157143.4 Ų143.473%0.73479%0.789SS**  trans-1.3128.6155.7-75.4-170.888.200119.4
41L32.8Very low32.9Very low135 Ų135142.5 Ų142.571%0.70779%0.794SS**  108.3124.171.8-171.188.9000109.1
42Q34.4Very low32.5Very low173 Ų173139.3 Ų139.381%0.80880%0.798SS**  trans148.492.9144.7-80.8175.745.800108.9
43L31.1Very low32.4Very low167 Ų167137.1 Ų137.187%0.87479%0.793SS**  73.6116.285-156.791.9000112.5
44S29.1Very low32.6Very low90 Ų90141.2 Ų141.263%0.62979%0.79SS**  trans111.1116.6138.4-144.90000117.4
45T32.3Very low32.8Very low134 Ų134144.7 Ų144.782%0.82279%0.793SS**  trans68.3108.5136.738.60000119.2
46G30.4Very low33.2Very low58 Ų58142.3 Ų142.360%0.59878%0.784SS**  trans148.5137.3150.100000113
47Y32.7Very low33.5Very low226 Ų226141.6 Ų141.689%0.88677%0.774SS**  trans89.771.4161.2-45.6-74.6000117
48E28.7Very low33.3Very low185 Ų185144.8 Ų144.886%0.86477%0.772SS**  -50.8156.3128.8-66.4178.9129.400109.2
49T31.9Very low33.6Very low135 Ų135139.9 Ų139.983%0.82875%0.749SS**  trans75.182-175.226.50000117.4
50Q32.1Very low34Very low185 Ų185137.6 Ų137.686%0.86474%0.736SS**  trans-175.79.8143.4-107.3170.119.100117.9A52Q50-A52 VanDerWaalsContact C-N 3.26Å; Q50-A52 PolarHBondContact O-N 3.25Å; Q50-A52 VanDerWaalsContact O-N 3.15Å
51C30.6Very low34.1Very low145 Ų145133 Ų13398%0.9872%0.715SS**THydrogen-bonded Turntrans-8013.1-177.3-78.20000116.3
52A31.2Very low34.8Very low108 Ų108129 Ų12989%0.89370%0.696SS**THydrogen-bonded Turntrans-104.513.6175.100000114Q50Q50-A52 VanDerWaalsContact C-N 3.26Å; Q50-A52 PolarHBondContact O-N 3.25Å; Q50-A52 VanDerWaalsContact O-N 3.15Å
53G31.8Very low35.5Very low67 Ų67126.5 Ų126.569%0.69169%0.688SS**  trans-109.36.2-17400000116.5
54Q36.5Very low36.5Very low169 Ų169120.8 Ų120.879%0.7966%0.661SS**  trans-114.436.2-172.5-72.1-168.3-22.200114.1H56Q54-H56 PolarHBondContact O-N 3.43Å
55Q33.3Very low37.9Very low193 Ų193118 Ų11890%0.90264%0.638SS**  trans-67.190.1153-89-169.4-4100107.2E57Q55-E57 VanDerWaalsContact C-N 3.25Å; Q55-E57 PolarHBondContact O-N 3.28Å
56H39.3Very low39.1Very low141 Ų141116.6 Ų116.665%0.65363%0.63SS**  trans-60.788179.9-158.442.8000108.6Q54 R58Q54-H56 PolarHBondContact O-N 3.43Å; H56-R58 PolarHBondContact O-N 3.38Å
57E39.1Very low40.7Very low94 Ų94114.7 Ų114.744%0.43961%0.605SS.*  trans-63.376.8171.2-165.8180-132.400107.2Q55 S59 N243 R245Q55-E57 VanDerWaalsContact C-N 3.25Å; Q55-E57 PolarHBondContact O-N 3.28Å; E57-S59 VanDerWaalsContact C-N 3.3Å; E57-S59 PolarHBondContact O-N 3.27Å; E57-N243 HydrophobicContact CG-CB 4.03Å; E57-N243 PolarHBondContact OE1-ND2 2.81Å; E57-R245 IonicContact OE2-CZ 3.45Å; E57-R245 IonicContact OE2-NH1 2.72Å; E57-R245 PolarHBondContact OE2-NH1 3.45Å; E57-R245 IonicContact OE2-NH2 3.52Å
58R35.3Very low42Very low192 Ų192108.4 Ų108.473%0.72558%0.58SS**  trans-58.6101.6168.5-91.6-174.9178.91760.2105.7H56 M242H56-R58 PolarHBondContact O-N 3.38Å; R58-M242 HydrophobicContact CB-CE 4.45Å; R58-M242 WeakPolarHBondContact O-CE 3.42Å; R58-M242 VanDerWaalsContact O-CG 3.28Å; R58-M242 WeakPolarHBondContact O-CG 3.42Å
59S37.5Very low44Very low39 Ų39104.4 Ų104.427%0.27356%0.561SS.*  trans-95.7103.9169.31540000106.9E57 M61 N243E57-S59 VanDerWaalsContact C-N 3.3Å; E57-S59 PolarHBondContact O-N 3.27Å; S59-M61 PolarHBondContact O-N 3.27Å; S59-M61 VanDerWaalsContact O-N 3.15Å; S59-N243 VanDerWaalsContact CA-O 3.32Å; S59-N243 WeakPolarHBondContact CA-O 3.34Å; S59-N243 WeakPolarHBondContact CB-O 3.23Å
60I45.1Very low46.1Very low96 Ų96100.9 Ų100.949%0.49254%0.541SS..  trans-76.8101.8165.8-65.1157.4000103.5T62 M242I60-T62 HydrophobicContact CG2-CG2 3.86Å; I60-T62 PolarHBondContact O-N 3.3Å; I60-M242 HydrophobicContact CB-CE 3.4Å; I60-M242 HydrophobicContact CD1-CE 3.34Å; I60-M242 HydrophobicContact CD1-SD 3.79Å; I60-M242 HydrophobicContact CG1-CE 3.16Å; I60-M242 HydrophobicContact CG1-SD 4.28Å
61M41.2Very low48.6Very low62 Ų6299.2 Ų99.231%0.30553%0.526SS..  trans-6997.8170.8-91.8163.4153.600108.5S59 R245 A248 T253 L256S59-M61 PolarHBondContact O-N 3.27Å; S59-M61 VanDerWaalsContact O-N 3.15Å; M61-R245 VanDerWaalsContact CA-O 3.3Å; M61-R245 WeakPolarHBondContact CA-O 3.12Å; M61-R245 WeakPolarHBondContact CG-O 3.06Å; M61-A248 HydrophobicContact CE-CB 3.37Å; M61-A248 HydrophobicContact SD-CB 3.44Å; M61-A248 WeakPolarHBondContact SD-CB 3.48Å; M61-T253 HydrophobicContact CB-CG2 4.49Å; M61-L256 HydrophobicContact SD-CD1 4.26Å
62T47.1Very low51.2Low49 Ų4994.9 Ų94.930%0.30150%0.498SS..  trans-89.5129.6171.5540000109I60 T64 V244 T246I60-T62 HydrophobicContact CG2-CG2 3.86Å; I60-T62 PolarHBondContact O-N 3.3Å; T62-T64 VanDerWaalsContact CB-OG1 3.28Å; T62-T64 WeakPolarHBondContact CB-OG1 3.28Å; T62-T64 PolarHBondContact O-N 3.05Å; T62-T64 PolarHBondContact OG1-OG1 3.36Å; T62-V244 WeakPolarHBondContact OG1-CG1 3.43Å; T62-T246 WeakPolarHBondContact O-CG2 3.49Å
63D48.6Very low53.8Low121 Ų12190 Ų9065%0.64746%0.457SS*.SBendtrans-72.517.6174.4-150.916.3000113
64T52.4Low56.5Low48 Ų4890 Ų9029%0.29444%0.441SS..BIsolated β-bridgetrans-104.8116-175.558.20000109.4T62 V66 P127 T246T62-T64 VanDerWaalsContact CB-OG1 3.28Å; T62-T64 WeakPolarHBondContact CB-OG1 3.28Å; T62-T64 PolarHBondContact O-N 3.05Å; T62-T64 PolarHBondContact OG1-OG1 3.36Å; T64-V66 PolarHBondContact O-N 2.78Å; T64-P127 WeakPolarHBondContact CA-O 3.41Å; T64-T246 WeakPolarHBondContact O-CG2 3.29Å
65I58.7Low59.1Low31 Ų3187.7 Ų87.716%0.15943%0.433CS..  trans-75.8119.1172.2-62.1177.7000107.6L67 P127 R129 L132I65-L67 PolarHBondContact O-N 2.84Å; I65-L67 VanDerWaalsContact O-N 3.09Å; I65-P127 PolarHBondContact N-O 2.74Å; I65-P127 WeakPolarHBondContact O-CB 2.86Å; I65-P127 WeakPolarHBondContact O-CG 3.41Å; I65-R129 HydrophobicContact CD1-CB 3.79Å; I65-R129 HydrophobicContact CD1-CG 3.88Å; I65-R129 HydrophobicContact CG1-CB 4.31Å; I65-L132 HydrophobicContact CD1-CD2 3.66Å
66V57.2Low61.8Low105 Ų10579.2 Ų79.264%0.63640%0.395SS*.  trans-71.4104.6169.8-1780000107.7T64 R68T64-V66 PolarHBondContact O-N 2.78Å; V66-R68 PolarHBondContact O-N 2.78Å
67L63.5Low64.3Low17 Ų1772.5 Ų72.59%0.08936%0.364CS..  trans-59.8121.7169.9-97.370.2000108.1I65 H69 P70 V73 V123 P127I65-L67 PolarHBondContact O-N 2.84Å; I65-L67 VanDerWaalsContact O-N 3.09Å; L67-H69 PolarHBondContact O-N 3.29Å; L67-P70 HydrophobicContact CB-CB 4.48Å; L67-P70 WeakPolarHBondContact O-CD 3.36Å; L67-V73 HydrophobicContact CD2-CB 4.19Å; L67-V73 HydrophobicContact CD2-CG1 4.24Å; L67-V73 HydrophobicContact CD2-CG2 4.02Å; L67-V123 HydrophobicContact CD2-CG2 4.32Å; L67-P127 HydrophobicContact CD1-CB 3.68Å; L67-P127 HydrophobicContact CD1-CG 4.33Å
68R61.7Low66.9Low95 Ų9570 Ų7036%0.35836%0.359SS..SBendtrans-57.9-37.5179.1-81.3-175.5169.6147.1-7.5112.9V66 N214 T217 E221V66-R68 PolarHBondContact O-N 2.78Å; R68-N214 PolarHBondContact N-OD1 3.4Å; R68-T217 PolarHBondContact NH1-OG1 2.64Å; R68-E221 IonicContact CZ-OE2 2.63Å; R68-E221 IonicContact NE-OE2 3.22Å; R68-E221 IonicContact NH2-OE2 3.64Å; R68-E221 PolarHBondContact NH2-OE2 3.49Å
69H70Confident69.8Low101 Ų10162.8 Ų62.847%0.46834%0.34SS..  trans-134.775-175.8-59.6-55.7000111.1L67 R71 S72 V73L67-H69 PolarHBondContact O-N 3.29Å; H69-R71 VanDerWaalsContact C-N 3.26Å; H69-R71 PolarHBondContact O-N 3.17Å; H69-S72 PolarHBondContact O-N 3.05Å; H69-V73 PolarHBondContact O-N 3.18Å
70P76.9Confident72.5Confident61 Ų6160.9 Ų60.940%0.39633%0.327SS..Hα-helixtrans-64.5-33.9-178.227.1-33.5000111.4L67 L74 V123L67-P70 HydrophobicContact CB-CB 4.48Å; L67-P70 WeakPolarHBondContact O-CD 3.36Å; P70-L74 VanDerWaalsContact O-CB 3.29Å; P70-L74 WeakPolarHBondContact O-CB 3.44Å; P70-L74 PolarHBondContact O-N 3.25Å; P70-V123 HydrophobicContact CB-CG1 4.26Å
71R83.8Confident74.9Confident149 Ų14958.3 Ų58.356%0.56231%0.314SS*.Hα-helixtrans-62.6-45177-65.4-174.9-177.4162.44.8111.6N15 D17 H69 L74 I75N15-R71 PolarHBondContact OD1-NH2 3.38Å; D17-R71 IonicContact OD2-NH2 3.76Å; D17-R71 PolarHBondContact OD2-NH2 2.75Å; D17-R71 VanDerWaalsContact OD2-NH2 3.13Å; H69-R71 VanDerWaalsContact C-N 3.26Å; H69-R71 PolarHBondContact O-N 3.17Å; R71-L74 PolarHBondContact O-N 3.46Å; R71-I75 VanDerWaalsContact O-CG1 3.26Å; R71-I75 WeakPolarHBondContact O-CG1 3.38Å; R71-I75 PolarHBondContact O-N 3.41Å
72S85.2Confident77.5Confident55 Ų5559.1 Ų59.139%0.38533%0.325SS..Hα-helixtrans-66.7-41.6-179.8-51.90000112.3H69 L74 I75 C76H69-S72 PolarHBondContact O-N 3.05Å; S72-L74 VanDerWaalsContact C-N 3.34Å; S72-I75 PolarHBondContact O-N 3.38Å; S72-C76 WeakPolarHBondContact O-CB 3.32Å; S72-C76 PolarHBondContact O-N 3.01Å
73V84.9Confident79.7Confident6 Ų658 Ų584%0.03632%0.317CS..Hα-helixtrans-63.6-42.4174.91770000110.6L67 H69 C76 A77 V123 L210L67-V73 HydrophobicContact CD2-CB 4.19Å; L67-V73 HydrophobicContact CD2-CG1 4.24Å; L67-V73 HydrophobicContact CD2-CG2 4.02Å; H69-V73 PolarHBondContact O-N 3.18Å; V73-C76 PolarHBondContact O-N 2.7Å; V73-A77 WeakPolarHBondContact O-CB 3.28Å; V73-A77 PolarHBondContact O-N 3.29Å; V73-V123 HydrophobicContact CB-CG2 4.19Å; V73-V123 HydrophobicContact CG1-CG2 3.78Å; V73-L210 HydrophobicContact CG2-CB 4.44Å; V73-L210 HydrophobicContact CG2-CD1 4.32Å
74L88.8Confident81.9Confident67 Ų6752.2 Ų52.235%0.35129%0.286SS..Hα-helixtrans-63-45.1177.7-173.367.8000112.3P70 R71 S72 C76 A77 A78 I120 V123P70-L74 VanDerWaalsContact O-CB 3.29Å; P70-L74 WeakPolarHBondContact O-CB 3.44Å; P70-L74 PolarHBondContact O-N 3.25Å; R71-L74 PolarHBondContact O-N 3.46Å; S72-L74 VanDerWaalsContact C-N 3.34Å; L74-C76 VanDerWaalsContact C-N 3.33Å; L74-C76 PolarHBondContact O-N 3.49Å; L74-A77 PolarHBondContact O-N 2.88Å; L74-A78 WeakPolarHBondContact O-CB 3.06Å; L74-A78 PolarHBondContact O-N 2.82Å; L74-I120 HydrophobicContact CD1-CG1 4.48Å; L74-I120 HydrophobicContact CD1-CG2 4.38Å; L74-V123 HydrophobicContact CB-CG1 4.33Å; L74-V123 HydrophobicContact CD1-CB 4.38Å; L74-V123 HydrophobicContact CD1-CG1 4.32Å
75I91.1Very high83.9Confident120 Ų12053 Ų5362%0.61529%0.291SS*.Hα-helixtrans-62-43.4177.1-68.6163.9000110.2R71 S72 A78 A79R71-I75 VanDerWaalsContact O-CG1 3.26Å; R71-I75 WeakPolarHBondContact O-CG1 3.38Å; R71-I75 PolarHBondContact O-N 3.41Å; S72-I75 PolarHBondContact O-N 3.38Å; I75-A78 PolarHBondContact O-N 2.84Å; I75-A79 WeakPolarHBondContact O-CB 3.03Å; I75-A79 PolarHBondContact O-N 2.72Å
76C91.6Very high85.6Confident15 Ų1555.2 Ų55.210%0.10130%0.3CS..Hα-helixtrans-65.1-43.8178.9-159.40000111.8S72 V73 L74 A78 A79 Q80 C203 S207S72-C76 WeakPolarHBondContact O-CB 3.32Å; S72-C76 PolarHBondContact O-N 3.01Å; V73-C76 PolarHBondContact O-N 2.7Å; L74-C76 VanDerWaalsContact C-N 3.33Å; L74-C76 PolarHBondContact O-N 3.49Å; C76-A78 VanDerWaalsContact C-N 3.33Å; C76-A78 PolarHBondContact O-N 3.03Å; C76-A79 PolarHBondContact O-N 3.05Å; C76-Q80 WeakPolarHBondContact O-CG 3.4Å; C76-Q80 PolarHBondContact O-N 3.28Å; C76-C203 PolarHBondContact SG-O 2.89Å; C76-C203 VanDerWaalsContact SG-O 3.38Å; C76-S207 PolarHBondContact SG-OG 3.18Å
77A91.7Very high87.2Confident0 Ų050.2 Ų50.20%027%0.27CS..Hα-helixtrans-64.3-37.217600000112.2V73 L74 L81 I120V73-A77 WeakPolarHBondContact O-CB 3.28Å; V73-A77 PolarHBondContact O-N 3.29Å; L74-A77 PolarHBondContact O-N 2.88Å; A77-L81 WeakPolarHBondContact O-CB 3.39Å; A77-L81 PolarHBondContact O-N 3.49Å; A77-I120 HydrophobicContact CB-CG1 3.94Å
78A93.8Very high88.6Confident42 Ų4250.9 Ų50.935%0.34728%0.276SS..Hα-helixtrans-66-42.9173.900000112L74 I75 C76 L81 C82L74-A78 WeakPolarHBondContact O-CB 3.06Å; L74-A78 PolarHBondContact O-N 2.82Å; I75-A78 PolarHBondContact O-N 2.84Å; C76-A78 VanDerWaalsContact C-N 3.33Å; C76-A78 PolarHBondContact O-N 3.03Å; A78-L81 WeakPolarHBondContact O-CB 3.46Å; A78-L81 PolarHBondContact O-N 3.13Å; A78-C82 PolarHBondContact O-N 2.84Å; A78-C82 PolarHBondContact O-SG 3.47Å; A78-C82 VanDerWaalsContact O-SG 3.37Å
79A94.7Very high90Very high39 Ų3949.8 Ų49.832%0.32228%0.28SS..Hα-helixtrans-62.8-43.3175.800000111.8I75 C76 L81 C82 L83I75-A79 WeakPolarHBondContact O-CB 3.03Å; I75-A79 PolarHBondContact O-N 2.72Å; C76-A79 PolarHBondContact O-N 3.05Å; A79-L81 VanDerWaalsContact C-N 3.33Å; A79-L81 PolarHBondContact O-N 2.94Å; A79-C82 PolarHBondContact O-N 3.02Å; A79-L83 WeakPolarHBondContact O-CG 3.45Å; A79-L83 PolarHBondContact O-N 3.38Å
80Q93.8Very high90.8Very high0 Ų046.7 Ų46.70%027%0.265CS..Hα-helixtrans-59.6-43.3173-72.3174.9-9.100111.7C76 C82 L83 A84 S116 C203 T204 S207C76-Q80 WeakPolarHBondContact O-CG 3.4Å; C76-Q80 PolarHBondContact O-N 3.28Å; Q80-C82 PolarHBondContact O-N 3.41Å; Q80-L83 PolarHBondContact O-N 3.15Å; Q80-A84 VanDerWaalsContact O-CB 3.23Å; Q80-A84 WeakPolarHBondContact O-CB 3.05Å; Q80-A84 PolarHBondContact O-N 3.14Å; Q80-S116 WeakPolarHBondContact CB-OG 3.35Å; Q80-C203 HydrophobicContact CG-CB 3.71Å; Q80-C203 PolarHBondContact NE2-O 3.22Å; Q80-T204 VanDerWaalsContact NE2-CA 3.32Å; Q80-S207 VanDerWaalsContact NE2-CB 3.29Å; Q80-S207 PolarHBondContact NE2-OG 3.16Å
81L95.6Very high91.3Very high41 Ų4143.8 Ų43.822%0.21525%0.246CC..Hα-helixtrans-60.6-45.7177.2-176.362.7000111.3A77 A78 A79 L83 A84 V85 I113 S116 M117 I120A77-L81 WeakPolarHBondContact O-CB 3.39Å; A77-L81 PolarHBondContact O-N 3.49Å; A78-L81 WeakPolarHBondContact O-CB 3.46Å; A78-L81 PolarHBondContact O-N 3.13Å; A79-L81 VanDerWaalsContact C-N 3.33Å; A79-L81 PolarHBondContact O-N 2.94Å; L81-L83 PolarHBondContact O-N 2.9Å; L81-A84 PolarHBondContact O-N 3.28Å; L81-V85 HydrophobicContact CD1-CG2 4.31Å; L81-V85 HydrophobicContact CG-CG2 4.5Å; L81-V85 WeakPolarHBondContact O-CB 3.28Å; L81-V85 VanDerWaalsContact O-CG2 3.23Å; L81-V85 WeakPolarHBondContact O-CG2 3.35Å; L81-V85 PolarHBondContact O-N 3.29Å; L81-I113 HydrophobicContact CD1-CG2 4.08Å; L81-S116 PolarHBondContact N-OG 2.8Å; L81-M117 HydrophobicContact CD1-CG 4.48Å; L81-M117 HydrophobicContact CD1-SD 4.29Å; L81-M117 HydrophobicContact CD2-SD 4.22Å; L81-I120 HydrophobicContact CD2-CD1 3.87Å
82C95.5Very high91.5Very high79 Ų7939.4 Ų39.453%0.53424%0.236SC..Hα-helixtrans-59.6-45.6177.1-69.60000112A78 A79 Q80 V85 Q86A78-C82 PolarHBondContact O-N 2.84Å; A78-C82 PolarHBondContact O-SG 3.47Å; A78-C82 VanDerWaalsContact O-SG 3.37Å; A79-C82 PolarHBondContact O-N 3.02Å; Q80-C82 PolarHBondContact O-N 3.41Å; C82-V85 PolarHBondContact O-N 3.04Å; C82-Q86 WeakPolarHBondContact O-CG 3.42Å; C82-Q86 PolarHBondContact O-N 3.06Å
83L94.8Very high91.5Very high25 Ų2539.1 Ų39.113%0.13123%0.229CC..Hα-helixtrans-66-42.5177.9-69.8169.3000111.8A79 Q80 L81 V85 Q86 I87 F196 A199 H200 C203A79-L83 WeakPolarHBondContact O-CG 3.45Å; A79-L83 PolarHBondContact O-N 3.38Å; Q80-L83 PolarHBondContact O-N 3.15Å; L81-L83 PolarHBondContact O-N 2.9Å; L83-V85 VanDerWaalsContact C-N 3.35Å; L83-V85 PolarHBondContact O-N 2.88Å; L83-Q86 PolarHBondContact O-N 2.72Å; L83-I87 VanDerWaalsContact O-CG1 3.29Å; L83-I87 WeakPolarHBondContact O-CG1 3.26Å; L83-I87 PolarHBondContact O-N 2.77Å; L83-F196 HydrophobicContact CD2-CD1 3.77Å; L83-F196 HydrophobicContact CD2-CE1 4.44Å; L83-A199 HydrophobicContact CD1-CB 4.29Å; L83-A199 HydrophobicContact CD2-CB 4.14Å; L83-H200 HydrophobicContact CB-CB 4.24Å; L83-H200 HydrophobicContact CD1-CB 4.37Å; L83-C203 HydrophobicContact CD1-CB 4.4Å
84A93.9Very high91.2Very high0 Ų039.2 Ų39.20%023%0.23CC..Hα-helixtrans-62.6-41.5177.300000111.8Q80 L81 I87 C88 F112 I113Q80-A84 VanDerWaalsContact O-CB 3.23Å; Q80-A84 WeakPolarHBondContact O-CB 3.05Å; Q80-A84 PolarHBondContact O-N 3.14Å; L81-A84 PolarHBondContact O-N 3.28Å; A84-I87 PolarHBondContact O-N 3.27Å; A84-C88 WeakPolarHBondContact O-CB 3.29Å; A84-C88 PolarHBondContact O-N 3.31Å; A84-F112 HydrophobicContact CB-CB 3.58Å; A84-I113 HydrophobicContact CB-CG1 3.86Å
85V95.1Very high91Very high66 Ų6640 Ų4040%0.423%0.232SC..Hα-helixtrans-63.7-42.6174.4170.20000110.9L81 C82 L83 C88 V89 I113L81-V85 HydrophobicContact CD1-CG2 4.31Å; L81-V85 HydrophobicContact CG-CG2 4.5Å; L81-V85 WeakPolarHBondContact O-CB 3.28Å; L81-V85 VanDerWaalsContact O-CG2 3.23Å; L81-V85 WeakPolarHBondContact O-CG2 3.35Å; L81-V85 PolarHBondContact O-N 3.29Å; C82-V85 PolarHBondContact O-N 3.04Å; L83-V85 VanDerWaalsContact C-N 3.35Å; L83-V85 PolarHBondContact O-N 2.88Å; V85-C88 WeakPolarHBondContact O-CB 3.48Å; V85-C88 PolarHBondContact O-N 3.23Å; V85-V89 HydrophobicContact CG1-CG2 4.37Å; V85-V89 WeakPolarHBondContact O-CG2 3.4Å; V85-V89 PolarHBondContact O-N 3.35Å; V85-I113 HydrophobicContact CG2-CD1 4.48Å
86Q93.9Very high90.6Very high76 Ų7642.1 Ų42.136%0.35524%0.237SC..Hα-helixtrans-61.3-47.8175.9-74.7174.2-1100111.8C82 L83 C88 V89 F90C82-Q86 WeakPolarHBondContact O-CG 3.42Å; C82-Q86 PolarHBondContact O-N 3.06Å; L83-Q86 PolarHBondContact O-N 2.72Å; Q86-C88 PolarHBondContact O-N 2.94Å; Q86-V89 PolarHBondContact O-N 3.23Å; Q86-F90 HydrophobicContact CB-CE2 4.24Å; Q86-F90 WeakPolarHBondContact O-CD2 3.43Å; Q86-F90 WeakPolarHBondContact O-CG 3.11Å; Q86-F90 PolarHBondContact O-N 3.46Å
87I91.7Very high89.7Confident0 Ų048.2 Ų48.20%026%0.259CS..Hα-helixtrans-58.8-38.8175.1-65.5166.1000110.6L83 A84 G91 F112 L149 H193 F196 H200L83-I87 VanDerWaalsContact O-CG1 3.29Å; L83-I87 WeakPolarHBondContact O-CG1 3.26Å; L83-I87 PolarHBondContact O-N 2.77Å; A84-I87 PolarHBondContact O-N 3.27Å; I87-G91 PolarHBondContact O-N 3.09Å; I87-F112 HydrophobicContact CD1-CD2 4.3Å; I87-F112 HydrophobicContact CD1-CE2 4.39Å; I87-L149 HydrophobicContact CG2-CD2 3.86Å; I87-H193 PolarHBondContact O-CE1 2.92Å; I87-F196 HydrophobicContact CG1-CB 4.06Å; I87-H200 HydrophobicContact CD1-CB 4.04Å
88C92.3Very high88.5Confident31 Ų3149.6 Ų49.621%0.20927%0.266CS..Hα-helixtrans-65.4-48.7177-1680000112A84 V85 Q86 F90 G91 V92 S109 I113A84-C88 WeakPolarHBondContact O-CB 3.29Å; A84-C88 PolarHBondContact O-N 3.31Å; V85-C88 WeakPolarHBondContact O-CB 3.48Å; V85-C88 PolarHBondContact O-N 3.23Å; Q86-C88 PolarHBondContact O-N 2.94Å; C88-F90 VanDerWaalsContact C-N 3.34Å; C88-F90 PolarHBondContact O-N 3.22Å; C88-G91 CarbonylContact O-C 3.6Å; C88-G91 WeakPolarHBondContact O-CA 3.28Å; C88-G91 PolarHBondContact O-N 3.39Å; C88-G91 VanDerWaalsContact O-N 3.13Å; C88-V92 WeakPolarHBondContact O-CG2 3.45Å; C88-V92 PolarHBondContact O-N 2.94Å; C88-S109 PolarHBondContact SG-OG 3.24Å; C88-S109 VanDerWaalsContact SG-OG 3.39Å; C88-I113 HydrophobicContact CB-CD1 4.06Å
89V91.5Very high86.7Confident73 Ų7351.6 Ų51.644%0.44229%0.291SS..Hα-helixtrans-57.9-47.6178.9169.20000110.7V85 Q86 V92 I93V85-V89 HydrophobicContact CG1-CG2 4.37Å; V85-V89 WeakPolarHBondContact O-CG2 3.4Å; V85-V89 PolarHBondContact O-N 3.35Å; Q86-V89 PolarHBondContact O-N 3.23Å; V89-V92 PolarHBondContact O-N 3.46Å; V89-I93 HydrophobicContact CG1-CD1 4.03Å; V89-I93 WeakPolarHBondContact O-CG1 3.33Å; V89-I93 PolarHBondContact O-N 3.29Å
90F87Confident84.6Confident35 Ų3554.1 Ų54.115%0.15431%0.305CS..Hα-helixtrans-67.1-36.9176.9-64.4-47.9000112.2Q86 C88 V92 I93 C94 M189 L192 H193 F196Q86-F90 HydrophobicContact CB-CE2 4.24Å; Q86-F90 WeakPolarHBondContact O-CD2 3.43Å; Q86-F90 WeakPolarHBondContact O-CG 3.11Å; Q86-F90 PolarHBondContact O-N 3.46Å; C88-F90 VanDerWaalsContact C-N 3.34Å; C88-F90 PolarHBondContact O-N 3.22Å; F90-V92 VanDerWaalsContact C-N 3.32Å; F90-V92 PolarHBondContact O-N 3.47Å; F90-I93 HydrophobicContact CD1-CD1 4.32Å; F90-I93 PolarHBondContact O-N 3.27Å; F90-C94 WeakPolarHBondContact O-CB 3.3Å; F90-C94 PolarHBondContact O-N 3.34Å; F90-C94 PolarHBondContact O-SG 3.23Å; F90-M189 HydrophobicContact CD1-CE 4.45Å; F90-M189 HydrophobicContact CD1-SD 3.35Å; F90-M189 WeakPolarHBondContact CD1-SD 3.44Å; F90-M189 HydrophobicContact CE1-SD 3.84Å; F90-M189 HydrophobicContact CG-SD 4.23Å; F90-L192 HydrophobicContact CE1-CD1 3.93Å; F90-L192 HydrophobicContact CE2-CB 4.38Å; F90-L192 HydrophobicContact CZ-CD1 3.92Å; F90-H193 VanDerWaalsContact CB-CD2 3.41Å; F90-H193 WeakPolarHBondContact CB-CD2 3.46Å; F90-H193 WeakPolarHBondContact CB-NE2 2.92Å; F90-F196 HydrophobicContact CD2-CD2 4.21Å; F90-F196 HydrophobicContact CD2-CE2 4.46Å; F90-F196 AromaticContact CE2-CD2 3.65Å; F90-F196 HydrophobicContact CE2-CD2 3.65Å; F90-F196 AromaticContact CE2-CE2 3.48Å; F90-F196 HydrophobicContact CE2-CE2 3.48Å; F90-F196 VanDerWaalsContact CE2-CE2 3.48Å; F90-F196 HydrophobicContact CE2-CZ 4.47Å; F90-F196 HydrophobicContact CZ-CE2 4.1Å
91G86Confident83Confident0 Ų058 Ų580%033%0.331CS..Hα-helixtrans-60.6-38.4171.800000113.5I87 C88 H95 H193I87-G91 PolarHBondContact O-N 3.09Å; C88-G91 CarbonylContact O-C 3.6Å; C88-G91 WeakPolarHBondContact O-CA 3.28Å; C88-G91 PolarHBondContact O-N 3.39Å; C88-G91 VanDerWaalsContact O-N 3.13Å; G91-H95 WeakPolarHBondContact O-CB 3.49Å; G91-H95 PolarHBondContact O-N 2.67Å; G91-H193 PolarHBondContact N-NE2 2.94Å
92V88Confident81.6Confident58 Ų5856.2 Ų56.235%0.35232%0.321SS..Hα-helixtrans-67.8-45.1174.9171.90000110.8C88 V89 F90 C94 H95 F96 L106C88-V92 WeakPolarHBondContact O-CG2 3.45Å; C88-V92 PolarHBondContact O-N 2.94Å; V89-V92 PolarHBondContact O-N 3.46Å; F90-V92 VanDerWaalsContact C-N 3.32Å; F90-V92 PolarHBondContact O-N 3.47Å; V92-C94 PolarHBondContact O-N 2.91Å; V92-H95 WeakPolarHBondContact O-CB 3.19Å; V92-H95 PolarHBondContact O-N 3.38Å; V92-H95 VanDerWaalsContact O-N 3.15Å; V92-F96 HydrophobicContact CG1-CD2 3.85Å; V92-F96 HydrophobicContact CG1-CE2 3.6Å; V92-F96 VanDerWaalsContact O-CD2 3.22Å; V92-F96 WeakPolarHBondContact O-CD2 3.5Å; V92-F96 PolarHBondContact O-N 3.37Å; V92-F96 VanDerWaalsContact O-N 3.15Å; V92-L106 HydrophobicContact CB-CD2 4.39Å; V92-L106 HydrophobicContact CG2-CD2 3.61Å
93I85.5Confident80.6Confident49 Ų4959.9 Ų59.925%0.25133%0.328SS..Hα-helixtrans-57.7-51.4174.7-67.9167.2000109.4V89 F90 H95 F96 Y97 M189V89-I93 HydrophobicContact CG1-CD1 4.03Å; V89-I93 WeakPolarHBondContact O-CG1 3.33Å; V89-I93 PolarHBondContact O-N 3.29Å; F90-I93 HydrophobicContact CD1-CD1 4.32Å; F90-I93 PolarHBondContact O-N 3.27Å; I93-H95 PolarHBondContact O-N 3.39Å; I93-F96 PolarHBondContact O-N 2.94Å; I93-Y97 HydrophobicContact CG2-CD2 3.64Å; I93-Y97 HydrophobicContact CG2-CE2 3.83Å; I93-Y97 VanDerWaalsContact O-CD2 3.28Å; I93-Y97 WeakPolarHBondContact O-CD2 3.35Å; I93-Y97 PolarHBondContact O-N 2.95Å; I93-M189 HydrophobicContact CG2-CE 4.31Å; I93-M189 HydrophobicContact CG2-CG 4.33Å; I93-M189 HydrophobicContact CG2-SD 4.4Å
94C80Confident79.9Confident7 Ų759.8 Ų59.85%0.04733%0.329CS..Hα-helixtrans-55.9-38.9176.5-70.80000112.3F90 V92 F96 Y97 D98 Y102F90-C94 WeakPolarHBondContact O-CB 3.3Å; F90-C94 PolarHBondContact O-N 3.34Å; F90-C94 PolarHBondContact O-SG 3.23Å; V92-C94 PolarHBondContact O-N 2.91Å; C94-F96 VanDerWaalsContact C-N 3.32Å; C94-F96 PolarHBondContact O-N 3.19Å; C94-Y97 PolarHBondContact O-N 3.21Å; C94-D98 WeakPolarHBondContact O-CA 3.36Å; C94-D98 VanDerWaalsContact O-CB 3.23Å; C94-D98 WeakPolarHBondContact O-CB 3.31Å; C94-D98 PolarHBondContact O-N 2.73Å; C94-Y102 HydrophobicContact CB-CD1 3.51Å; C94-Y102 HydrophobicContact CB-CE1 4.03Å; C94-Y102 HydrophobicContact CB-CG 4.22Å
95H83.4Confident79.4Confident84 Ų8459.8 Ų59.839%0.38933%0.329SS..Hα-helixtrans-63.4-35.1177.4-17653.9000113.5G91 V92 I93 L106G91-H95 WeakPolarHBondContact O-CB 3.49Å; G91-H95 PolarHBondContact O-N 2.67Å; V92-H95 WeakPolarHBondContact O-CB 3.19Å; V92-H95 PolarHBondContact O-N 3.38Å; V92-H95 VanDerWaalsContact O-N 3.15Å; I93-H95 PolarHBondContact O-N 3.39Å; H95-L106 HydrophobicContact CB-CD1 3.99Å
96F82.8Confident79.1Confident165 Ų16558.9 Ų58.972%0.72432%0.322SS*.Hα-helixtrans-79.3-35.2178.3-78.3-68.2000113.4V92 I93 C94V92-F96 HydrophobicContact CG1-CD2 3.85Å; V92-F96 HydrophobicContact CG1-CE2 3.6Å; V92-F96 VanDerWaalsContact O-CD2 3.22Å; V92-F96 WeakPolarHBondContact O-CD2 3.5Å; V92-F96 PolarHBondContact O-N 3.37Å; V92-F96 VanDerWaalsContact O-N 3.15Å; I93-F96 PolarHBondContact O-N 2.94Å; C94-F96 VanDerWaalsContact C-N 3.32Å; C94-F96 PolarHBondContact O-N 3.19Å
97Y73.2Confident79Confident142 Ų14261.8 Ų61.856%0.55733%0.33SS*.Hα-helixtrans-88.5-24.2-177.2-75.6-82.7000113.7I93 C94 I182I93-Y97 HydrophobicContact CG2-CD2 3.64Å; I93-Y97 HydrophobicContact CG2-CE2 3.83Å; I93-Y97 VanDerWaalsContact O-CD2 3.28Å; I93-Y97 WeakPolarHBondContact O-CD2 3.35Å; I93-Y97 PolarHBondContact O-N 2.95Å; C94-Y97 PolarHBondContact O-N 3.21Å; Y97-I182 HydrophobicContact CD1-CG1 4.23Å; Y97-I182 HydrophobicContact CD1-CG2 4.16Å; Y97-I182 HydrophobicContact CE1-CG1 4.35Å
98D66.1Low78.9Confident29 Ų2961.8 Ų61.816%0.15533%0.33CS..  trans-123.4101.8-172.7-147.615.5000109.2C94 C100 K186 Y190C94-D98 WeakPolarHBondContact O-CA 3.36Å; C94-D98 VanDerWaalsContact O-CB 3.23Å; C94-D98 WeakPolarHBondContact O-CB 3.31Å; C94-D98 PolarHBondContact O-N 2.73Å; D98-C100 PolarHBondContact O-N 2.83Å; D98-K186 VanDerWaalsContact CG-NZ 3.3Å; D98-K186 IonicContact OD1-NZ 3.05Å; D98-K186 PolarHBondContact OD1-NZ 2.89Å; D98-K186 WeakPolarHBondContact OD2-CE 3.16Å; D98-K186 IonicContact OD2-NZ 3.26Å; D98-K186 PolarHBondContact OD2-NZ 3.17Å; D98-Y190 PolarHBondContact OD2-OH 3.16Å
99G56Low78.9Confident85 Ų8560.3 Ų60.388%0.87632%0.32SS*.  trans-66.116.7-179.300000115.7
100C51Low78.9Confident91 Ų9159 Ų5962%0.61532%0.316SS*.SBendtrans-155.6178.3-173.5-99.20000111.2D98 Y102D98-C100 PolarHBondContact O-N 2.83Å; C100-Y102 PolarHBondContact O-N 3.06Å
101P60.1Low79.3Confident83 Ų8358.9 Ų58.954%0.53932%0.322SS..SBend-65.216.6-102.840.8-35.9000117.8K103 L156P101-K103 PolarHBondContact O-N 2.8Å; P101-L156 HydrophobicContact CG-CD2 4.16Å
102Y66.8Low79.7Confident2 Ų258.9 Ų58.91%0.00832%0.322CS..THydrogen-bonded Turntrans-73.214.5-173.2-145-116000115.7C94 C100 S104 S105 T153 L156 Y190 H193C94-Y102 HydrophobicContact CB-CD1 3.51Å; C94-Y102 HydrophobicContact CB-CE1 4.03Å; C94-Y102 HydrophobicContact CB-CG 4.22Å; C100-Y102 PolarHBondContact O-N 3.06Å; Y102-S104 PolarHBondContact O-N 2.89Å; Y102-S104 VanDerWaalsContact O-N 3.09Å; Y102-S105 WeakPolarHBondContact CE1-OG 2.97Å; Y102-S105 PolarHBondContact O-N 3.5Å; Y102-S105 PolarHBondContact OH-OG 3.34Å; Y102-T153 PolarHBondContact OH-OG1 3.39Å; Y102-L156 HydrophobicContact CD2-CD1 3.63Å; Y102-L156 HydrophobicContact CE2-CD1 3.84Å; Y102-Y190 HydrophobicContact CE2-CE1 4.5Å; Y102-H193 AromaticContact CE1-CE1 3.74Å; Y102-H193 AromaticContact CZ-CE1 3.85Å; Y102-H193 AromaticContact CZ-ND1 3.87Å; Y102-H193 PolarHBondContact OH-CE1 2.95Å; Y102-H193 PolarHBondContact OH-ND1 3.42Å
103K73.1Confident80Confident157 Ų15758.3 Ų58.368%0.68332%0.316SS*.Hα-helixtrans-56.7-25.6171.3-69.1-174.4178.3178.50111.7P101 S105 W107P101-K103 PolarHBondContact O-N 2.8Å; K103-S105 VanDerWaalsContact C-N 3.32Å; K103-S105 PolarHBondContact O-N 3.21Å; K103-W107 VanDerWaalsContact O-CD1 3.3Å
104S80Confident80.5Confident22 Ų2261.9 Ų61.915%0.15434%0.335CS..Hα-helixtrans-65.7-35.8-178.767.60000113.3Y102 L106 W107 M108Y102-S104 PolarHBondContact O-N 2.89Å; Y102-S104 VanDerWaalsContact O-N 3.09Å; S104-L106 PolarHBondContact O-N 3.35Å; S104-W107 VanDerWaalsContact CA-CD1 3.49Å; S104-W107 VanDerWaalsContact O-CD1 3.27Å; S104-W107 PolarHBondContact O-NE1 3.4Å; S104-M108 VanDerWaalsContact C-CE 3.43Å; S104-M108 WeakPolarHBondContact O-CB 3.37Å; S104-M108 WeakPolarHBondContact O-CE 3.46Å; S104-M108 WeakPolarHBondContact O-CG 3.39Å; S104-M108 PolarHBondContact O-N 2.89Å; S104-M108 VanDerWaalsContact O-N 3.16Å
105S85Confident81.1Confident0 Ų061.8 Ų61.80%033%0.334CS..Hα-helixtrans-67.5-36.8-178.5-167.40000113Y102 K103 M108 S109 H193Y102-S105 WeakPolarHBondContact CE1-OG 2.97Å; Y102-S105 PolarHBondContact O-N 3.5Å; Y102-S105 PolarHBondContact OH-OG 3.34Å; K103-S105 VanDerWaalsContact C-N 3.32Å; K103-S105 PolarHBondContact O-N 3.21Å; S105-M108 PolarHBondContact O-N 3.08Å; S105-S109 VanDerWaalsContact O-CB 3.29Å; S105-S109 WeakPolarHBondContact O-CB 3.4Å; S105-S109 PolarHBondContact O-N 2.99Å; S105-S109 PolarHBondContact O-OG 3.38Å; S105-H193 PolarHBondContact OG-CE1 3.23Å
106L88.8Confident81.6Confident48 Ų4857.8 Ų57.825%0.25132%0.316SS..Hα-helixtrans-61.5-50.8179.4-70.8178.3000111.8V92 H95 S104 M108 S109 A110V92-L106 HydrophobicContact CB-CD2 4.39Å; V92-L106 HydrophobicContact CG2-CD2 3.61Å; H95-L106 HydrophobicContact CB-CD1 3.99Å; S104-L106 PolarHBondContact O-N 3.35Å; L106-M108 PolarHBondContact O-N 2.91Å; L106-S109 PolarHBondContact O-N 3.45Å; L106-S109 PolarHBondContact O-OG 3.29Å; L106-A110 PolarHBondContact O-N 3.37Å
107W90Very high82.1Confident137 Ų13754.5 Ų54.552%0.51930%0.304SS..Hα-helixtrans-69.5-34.3179.969.9-105.7000112.3K103 S104 A110 A111 L145K103-W107 VanDerWaalsContact O-CD1 3.3Å; S104-W107 VanDerWaalsContact CA-CD1 3.49Å; S104-W107 VanDerWaalsContact O-CD1 3.27Å; S104-W107 PolarHBondContact O-NE1 3.4Å; W107-A110 PolarHBondContact O-N 3Å; W107-A111 PolarHBondContact O-N 3.38Å; W107-L145 HydrophobicContact CH2-CD2 3.66Å; W107-L145 HydrophobicContact CZ3-CD1 4.34Å; W107-L145 HydrophobicContact CZ3-CD2 3.64Å
108M90.9Very high82.9Confident0 Ų049.6 Ų49.60%029%0.287CS..Hα-helixtrans-65-42.7174.1-74.6-171.4-83.400111.8S104 S105 L106 A110 A111 F112 L145 F148 L149 I152S104-M108 VanDerWaalsContact C-CE 3.43Å; S104-M108 WeakPolarHBondContact O-CB 3.37Å; S104-M108 WeakPolarHBondContact O-CE 3.46Å; S104-M108 WeakPolarHBondContact O-CG 3.39Å; S104-M108 PolarHBondContact O-N 2.89Å; S104-M108 VanDerWaalsContact O-N 3.16Å; S105-M108 PolarHBondContact O-N 3.08Å; L106-M108 PolarHBondContact O-N 2.91Å; M108-A110 VanDerWaalsContact C-N 3.34Å; M108-A110 PolarHBondContact O-N 3.46Å; M108-A111 WeakPolarHBondContact O-CB 3.45Å; M108-A111 PolarHBondContact O-N 3.04Å; M108-A111 VanDerWaalsContact O-N 3.17Å; M108-F112 WeakPolarHBondContact O-CG 3.43Å; M108-F112 PolarHBondContact O-N 3.31Å; M108-L145 HydrophobicContact CG-CD2 4.28Å; M108-L145 HydrophobicContact SD-CD2 4.45Å; M108-F148 HydrophobicContact CE-CD1 4.3Å; M108-F148 HydrophobicContact SD-CD1 3.85Å; M108-L149 HydrophobicContact CE-CB 4.1Å; M108-L149 HydrophobicContact CE-CD1 3.45Å; M108-L149 VanDerWaalsContact CE-CD1 3.45Å; M108-L149 HydrophobicContact CE-CG 4.36Å; M108-L149 HydrophobicContact SD-CB 3.85Å; M108-L149 HydrophobicContact SD-CD1 4.23Å; M108-I152 HydrophobicContact CE-CD1 4.22Å
109S91.6Very high84Confident0 Ų048.2 Ų48.20%028%0.28CS..Hα-helixtrans-63.9-39176.373.30000112C88 S105 L106 A111 F112 I113C88-S109 PolarHBondContact SG-OG 3.24Å; C88-S109 VanDerWaalsContact SG-OG 3.39Å; S105-S109 VanDerWaalsContact O-CB 3.29Å; S105-S109 WeakPolarHBondContact O-CB 3.4Å; S105-S109 PolarHBondContact O-N 2.99Å; S105-S109 PolarHBondContact O-OG 3.38Å; L106-S109 PolarHBondContact O-N 3.45Å; L106-S109 PolarHBondContact O-OG 3.29Å; S109-A111 VanDerWaalsContact C-N 3.32Å; S109-A111 PolarHBondContact O-N 3.35Å; S109-F112 WeakPolarHBondContact O-CB 3.48Å; S109-F112 PolarHBondContact O-N 2.88Å; S109-I113 WeakPolarHBondContact O-CG1 3.46Å; S109-I113 PolarHBondContact O-N 3.46Å
110A92.5Very high85.7Confident45 Ų4545.6 Ų45.637%0.37225%0.245SC..Hα-helixtrans-61.8-40.8173.100000111.6L106 W107 M108 F112 I113 L114L106-A110 PolarHBondContact O-N 3.37Å; W107-A110 PolarHBondContact O-N 3Å; M108-A110 VanDerWaalsContact C-N 3.34Å; M108-A110 PolarHBondContact O-N 3.46Å; A110-F112 VanDerWaalsContact C-N 3.34Å; A110-F112 PolarHBondContact O-N 3.45Å; A110-I113 PolarHBondContact O-N 3.25Å; A110-L114 WeakPolarHBondContact O-CG 3.38Å; A110-L114 PolarHBondContact O-N 3.02Å
111A94.2Very high87.4Confident32 Ų3242.6 Ų42.626%0.26423%0.227SC..Hα-helixtrans-62.4-39.1174.200000112.3W107 M108 S109 L114 N115 L145W107-A111 PolarHBondContact O-N 3.38Å; M108-A111 WeakPolarHBondContact O-CB 3.45Å; M108-A111 PolarHBondContact O-N 3.04Å; M108-A111 VanDerWaalsContact O-N 3.17Å; S109-A111 VanDerWaalsContact C-N 3.32Å; S109-A111 PolarHBondContact O-N 3.35Å; A111-L114 PolarHBondContact O-N 3.46Å; A111-N115 WeakPolarHBondContact O-CB 3.42Å; A111-N115 PolarHBondContact O-N 3.06Å; A111-L145 HydrophobicContact CB-CD1 3.92Å
112F94.5Very high88.7Confident0 Ų038.7 Ų38.70%020%0.202CC..Hα-helixtrans-65.9-40.1175.1-61.1-24.7000112.9A84 I87 M108 S109 A110 N115 S116 S142 L145 L149 H200A84-F112 HydrophobicContact CB-CB 3.58Å; I87-F112 HydrophobicContact CD1-CD2 4.3Å; I87-F112 HydrophobicContact CD1-CE2 4.39Å; M108-F112 WeakPolarHBondContact O-CG 3.43Å; M108-F112 PolarHBondContact O-N 3.31Å; S109-F112 WeakPolarHBondContact O-CB 3.48Å; S109-F112 PolarHBondContact O-N 2.88Å; A110-F112 VanDerWaalsContact C-N 3.34Å; A110-F112 PolarHBondContact O-N 3.45Å; F112-N115 PolarHBondContact O-N 3.24Å; F112-S116 WeakPolarHBondContact O-CB 3.4Å; F112-S116 PolarHBondContact O-N 2.86Å; F112-S116 PolarHBondContact O-OG 2.91Å; F112-S142 WeakPolarHBondContact CD1-OG 3.29Å; F112-S142 WeakPolarHBondContact CE1-O 3.46Å; F112-L145 HydrophobicContact CE1-CB 3.66Å; F112-L145 HydrophobicContact CZ-CB 4.02Å; F112-L149 HydrophobicContact CE2-CD2 3.9Å; F112-H200 AromaticContact CD1-CE1 3.59Å; F112-H200 AromaticContact CD2-CE1 4Å; F112-H200 AromaticContact CG-CE1 3.54Å; F112-H200 AromaticContact CG-NE2 3.9Å
113I95.4Very high89.5Confident46 Ų4640.4 Ų40.424%0.23621%0.212CC..Hα-helixtrans-62.4-47.4174.6-67.4168.8000109.7L81 A84 V85 C88 S109 A110 N115 S116 M117L81-I113 HydrophobicContact CD1-CG2 4.08Å; A84-I113 HydrophobicContact CB-CG1 3.86Å; V85-I113 HydrophobicContact CG2-CD1 4.48Å; C88-I113 HydrophobicContact CB-CD1 4.06Å; S109-I113 WeakPolarHBondContact O-CG1 3.46Å; S109-I113 PolarHBondContact O-N 3.46Å; A110-I113 PolarHBondContact O-N 3.25Å; I113-N115 VanDerWaalsContact C-N 3.34Å; I113-N115 PolarHBondContact O-N 3.38Å; I113-S116 PolarHBondContact O-N 3.19Å; I113-M117 HydrophobicContact CG2-CG 4.27Å; I113-M117 WeakPolarHBondContact O-CB 3.33Å; I113-M117 VanDerWaalsContact O-CG 3.26Å; I113-M117 WeakPolarHBondContact O-CG 3.46Å; I113-M117 PolarHBondContact O-N 3Å
114L95Very high90Very high124 Ų12440.8 Ų40.865%0.64921%0.214SC*.Hα-helixtrans-60.5-41.9177.5-72172000112.1A110 A111 M117 L118A110-L114 WeakPolarHBondContact O-CG 3.38Å; A110-L114 PolarHBondContact O-N 3.02Å; A111-L114 PolarHBondContact O-N 3.46Å; L114-M117 PolarHBondContact O-N 3.15Å; L114-L118 WeakPolarHBondContact O-CB 3.42Å; L114-L118 PolarHBondContact O-N 3.21Å
115N93.4Very high89.7Confident6 Ų645.3 Ų45.33%0.03224%0.235CC..Hα-helixtrans-60.3-45.9175.2-174.367.8000111.6A111 F112 I113 M117 L118 G119 T138 N139A111-N115 WeakPolarHBondContact O-CB 3.42Å; A111-N115 PolarHBondContact O-N 3.06Å; F112-N115 PolarHBondContact O-N 3.24Å; I113-N115 VanDerWaalsContact C-N 3.34Å; I113-N115 PolarHBondContact O-N 3.38Å; N115-M117 PolarHBondContact O-N 2.87Å; N115-L118 WeakPolarHBondContact O-CB 3.46Å; N115-L118 PolarHBondContact O-N 3.35Å; N115-G119 PolarHBondContact O-N 3.46Å; N115-T138 VanDerWaalsContact OD1-CB 3.28Å; N115-T138 WeakPolarHBondContact OD1-CB 3.31Å; N115-T138 PolarHBondContact OD1-O 3.09Å; N115-T138 PolarHBondContact OD1-OG1 3.22Å; N115-N139 PolarHBondContact ND2-OD1 3.32Å; N115-N139 PolarHBondContact OD1-N 2.87Å
116S92.4Very high88.8Confident0 Ų052.2 Ų52.20%026%0.263CS..Hα-helixtrans-65.6-40.4179.3-52.60000111.9Q80 L81 F112 I113 L118 G119 I120Q80-S116 WeakPolarHBondContact CB-OG 3.35Å; L81-S116 PolarHBondContact N-OG 2.8Å; F112-S116 WeakPolarHBondContact O-CB 3.4Å; F112-S116 PolarHBondContact O-N 2.86Å; F112-S116 PolarHBondContact O-OG 2.91Å; I113-S116 PolarHBondContact O-N 3.19Å; S116-L118 VanDerWaalsContact C-N 3.34Å; S116-L118 PolarHBondContact O-N 2.8Å; S116-G119 PolarHBondContact O-N 2.95Å; S116-I120 WeakPolarHBondContact O-CG1 3.32Å; S116-I120 PolarHBondContact O-N 3.37Å
117M93.4Very high87.9Confident96 Ų9651.3 Ų51.347%0.47326%0.26SS..Hα-helixtrans-64.4-38.3174.9-71.1-58.4-65.200111.9L81 I113 L114 N115 G119 I120 A121L81-M117 HydrophobicContact CD1-CG 4.48Å; L81-M117 HydrophobicContact CD1-SD 4.29Å; L81-M117 HydrophobicContact CD2-SD 4.22Å; I113-M117 HydrophobicContact CG2-CG 4.27Å; I113-M117 WeakPolarHBondContact O-CB 3.33Å; I113-M117 VanDerWaalsContact O-CG 3.26Å; I113-M117 WeakPolarHBondContact O-CG 3.46Å; I113-M117 PolarHBondContact O-N 3Å; L114-M117 PolarHBondContact O-N 3.15Å; N115-M117 PolarHBondContact O-N 2.87Å; M117-G119 VanDerWaalsContact C-N 3.32Å; M117-G119 PolarHBondContact O-N 2.97Å; M117-I120 PolarHBondContact O-N 2.97Å; M117-I120 HydrophobicContact SD-CD1 4.44Å; M117-A121 VanDerWaalsContact O-CB 3.26Å; M117-A121 WeakPolarHBondContact O-CB 3.47Å; M117-A121 PolarHBondContact O-N 3.24Å
118L91.7Very high87.2Confident39 Ų3951.2 Ų51.220%0.20426%0.263CS..Hα-helixtrans-63.5-38.4174.1-175.664.6000111.5L114 N115 S116 A121 L122 L131 I134 Y135 T138L114-L118 WeakPolarHBondContact O-CB 3.42Å; L114-L118 PolarHBondContact O-N 3.21Å; N115-L118 WeakPolarHBondContact O-CB 3.46Å; N115-L118 PolarHBondContact O-N 3.35Å; S116-L118 VanDerWaalsContact C-N 3.34Å; S116-L118 PolarHBondContact O-N 2.8Å; L118-A121 PolarHBondContact O-N 3.34Å; L118-L122 WeakPolarHBondContact O-CB 3.37Å; L118-L122 PolarHBondContact O-N 3.05Å; L118-L131 HydrophobicContact CD1-CD1 3.77Å; L118-I134 HydrophobicContact CD2-CG2 3.94Å; L118-Y135 HydrophobicContact CB-CD2 4.37Å; L118-Y135 HydrophobicContact CD2-CD2 4.23Å; L118-Y135 HydrophobicContact CG-CD2 4.14Å; L118-T138 HydrophobicContact CD2-CG2 4.02Å; L118-T138 WeakPolarHBondContact CD2-OG1 3.47Å
119G88.7Confident86.3Confident0 Ų058.2 Ų58.20%029%0.289CS..Hα-helixtrans-63-43.9173.700000113.1N115 S116 M117 L122 V123N115-G119 PolarHBondContact O-N 3.46Å; S116-G119 PolarHBondContact O-N 2.95Å; M117-G119 VanDerWaalsContact C-N 3.32Å; M117-G119 PolarHBondContact O-N 2.97Å; G119-L122 PolarHBondContact O-N 2.76Å; G119-V123 PolarHBondContact O-N 3.27Å
120I90.3Very high85.7Confident30 Ų3064.3 Ų64.315%0.15432%0.321CS..Hα-helixtrans-65.5-41.4174.7-64168.9000110.7L74 A77 L81 S116 M117 L122 V123 K124L74-I120 HydrophobicContact CD1-CG1 4.48Å; L74-I120 HydrophobicContact CD1-CG2 4.38Å; A77-I120 HydrophobicContact CB-CG1 3.94Å; L81-I120 HydrophobicContact CD2-CD1 3.87Å; S116-I120 WeakPolarHBondContact O-CG1 3.32Å; S116-I120 PolarHBondContact O-N 3.37Å; M117-I120 PolarHBondContact O-N 2.97Å; M117-I120 HydrophobicContact SD-CD1 4.44Å; I120-L122 VanDerWaalsContact C-N 3.35Å; I120-L122 PolarHBondContact O-N 3.32Å; I120-V123 PolarHBondContact O-N 3.35Å; I120-K124 HydrophobicContact CG2-CD 4.35Å; I120-K124 PolarHBondContact O-N 2.86Å; I120-K124 VanDerWaalsContact O-N 3.08Å
121A88.1Confident85.3Confident28 Ų2864.1 Ų64.123%0.23131%0.314CS..Hα-helixtrans-62-41.7177.300000111.4M117 L118 V123 K124 L125M117-A121 VanDerWaalsContact O-CB 3.26Å; M117-A121 WeakPolarHBondContact O-CB 3.47Å; M117-A121 PolarHBondContact O-N 3.24Å; L118-A121 PolarHBondContact O-N 3.34Å; A121-V123 VanDerWaalsContact C-N 3.27Å; A121-V123 PolarHBondContact O-N 3.5Å; A121-K124 PolarHBondContact O-N 3.4Å; A121-L125 HydrophobicContact CB-CD1 3.89Å; A121-L125 WeakPolarHBondContact O-CA 3.33Å; A121-L125 WeakPolarHBondContact O-CB 3.36Å; A121-L125 PolarHBondContact O-N 3.34Å
122L86.1Confident84.8Confident1 Ų162.7 Ų62.71%0.00530%0.302CS..Hα-helixtrans-58.1-37.8176.1176.769.7000112.8L118 G119 I120 P127 L131 L132 Y135L118-L122 WeakPolarHBondContact O-CB 3.37Å; L118-L122 PolarHBondContact O-N 3.05Å; G119-L122 PolarHBondContact O-N 2.76Å; I120-L122 VanDerWaalsContact C-N 3.35Å; I120-L122 PolarHBondContact O-N 3.32Å; L122-P127 HydrophobicContact CD1-CB 4.45Å; L122-L131 HydrophobicContact CB-CD2 4.16Å; L122-L131 HydrophobicContact CB-CG 4.44Å; L122-L131 HydrophobicContact CD1-CB 3.87Å; L122-L131 HydrophobicContact CD1-CD2 3.75Å; L122-L131 HydrophobicContact CD1-CG 3.73Å; L122-L132 HydrophobicContact CD1-CB 4.38Å; L122-L132 HydrophobicContact CD2-CD1 3.83Å; L122-Y135 HydrophobicContact CD2-CD1 3.6Å; L122-Y135 HydrophobicContact CD2-CE1 4.29Å; L122-Y135 HydrophobicContact CD2-CG 4.03Å
123V84.1Confident84.3Confident37 Ų3765.8 Ų65.822%0.22432%0.32CS..Hα-helixtrans-76.2-35.9178.7179.30000111.7L67 P70 V73 L74 G119 I120 A121L67-V123 HydrophobicContact CD2-CG2 4.32Å; P70-V123 HydrophobicContact CB-CG1 4.26Å; V73-V123 HydrophobicContact CB-CG2 4.19Å; V73-V123 HydrophobicContact CG1-CG2 3.78Å; L74-V123 HydrophobicContact CB-CG1 4.33Å; L74-V123 HydrophobicContact CD1-CB 4.38Å; L74-V123 HydrophobicContact CD1-CG1 4.32Å; G119-V123 PolarHBondContact O-N 3.27Å; I120-V123 PolarHBondContact O-N 3.35Å; A121-V123 VanDerWaalsContact C-N 3.27Å; A121-V123 PolarHBondContact O-N 3.5Å
124K84.5Confident84.1Confident166 Ų16667.1 Ų67.172%0.72233%0.327SS*.Hα-helixtrans-87-41.5-176.2-75.9-168.9170.9179.90114.5I120 A121I120-K124 HydrophobicContact CG2-CD 4.35Å; I120-K124 PolarHBondContact O-N 2.86Å; I120-K124 VanDerWaalsContact O-N 3.08Å; A121-K124 PolarHBondContact O-N 3.4Å
125L73.7Confident83.8Confident116 Ų11661.2 Ų61.261%0.60730%0.296SS*.SBendtrans-99102.6-178.1-68.5136.9000107.2A121A121-L125 HydrophobicContact CB-CD1 3.89Å; A121-L125 WeakPolarHBondContact O-CA 3.33Å; A121-L125 WeakPolarHBondContact O-CB 3.36Å; A121-L125 PolarHBondContact O-N 3.34Å
126Y66.3Low83.6Confident146 Ų14661.8 Ų61.857%0.57330%0.301SS*.  trans5.7110.6174.6-65.1-80.9000115.3R20 K128R20-Y126 PolarHBondContact NH1-OH 3.2Å; Y126-K128 VanDerWaalsContact C-N 3.34Å; Y126-K128 PolarHBondContact O-N 2.83Å
127P68.6Low83.6Confident29 Ų2965.4 Ų65.419%0.18833%0.326CS..  trans-65.989.4-172.927.8-36.4000111.5T64 I65 L67 L122T64-P127 WeakPolarHBondContact CA-O 3.41Å; I65-P127 PolarHBondContact N-O 2.74Å; I65-P127 WeakPolarHBondContact O-CB 2.86Å; I65-P127 WeakPolarHBondContact O-CG 3.41Å; L67-P127 HydrophobicContact CD1-CB 3.68Å; L67-P127 HydrophobicContact CD1-CG 4.33Å; L122-P127 HydrophobicContact CD1-CB 4.45Å
128K75.9Confident83.5Confident134 Ų13462.8 Ų62.858%0.58332%0.315SS*.BIsolated β-bridgetrans-75.2140.8170.4-68.9-173.9177.6-176.90109.1Y126 L130 L131 L132Y126-K128 VanDerWaalsContact C-N 3.34Å; Y126-K128 PolarHBondContact O-N 2.83Å; K128-L130 PolarHBondContact O-N 2.91Å; K128-L131 HydrophobicContact CB-CB 4.27Å; K128-L131 WeakPolarHBondContact O-CB 3.41Å; K128-L131 PolarHBondContact O-N 3.47Å; K128-L132 PolarHBondContact O-N 3.03Å; K128-L132 VanDerWaalsContact O-N 3.13Å
129R72Confident83.5Confident148 Ų14861 Ų6156%0.55831%0.306SS*.Hα-helixtrans-54-40.9176.2-177.4168.2-175.9-169.32.1112.7I65 L131 L132 V133I65-R129 HydrophobicContact CD1-CB 3.79Å; I65-R129 HydrophobicContact CD1-CG 3.88Å; I65-R129 HydrophobicContact CG1-CB 4.31Å; R129-L131 VanDerWaalsContact C-N 3.32Å; R129-L131 PolarHBondContact O-N 3.27Å; R129-L132 PolarHBondContact O-N 3.22Å; R129-V133 WeakPolarHBondContact O-CG2 3.33Å; R129-V133 PolarHBondContact O-N 3.43Å; R129-V133 VanDerWaalsContact O-N 3.1Å
130L78.9Confident83.7Confident127 Ų12765.7 Ų65.767%0.66533%0.331SS*.Hα-helixtrans-61.1-41.2176.4-17467.2000112K128 L132 V133 I134K128-L130 PolarHBondContact O-N 2.91Å; L130-L132 VanDerWaalsContact C-N 3.34Å; L130-L132 PolarHBondContact O-N 3.03Å; L130-V133 PolarHBondContact O-N 3.13Å; L130-I134 HydrophobicContact CD2-CD1 4.47Å; L130-I134 HydrophobicContact CG-CD1 3.94Å; L130-I134 VanDerWaalsContact O-CG1 3.25Å; L130-I134 WeakPolarHBondContact O-CG1 3.15Å; L130-I134 PolarHBondContact O-N 3.31Å
131L83.9Confident83.9Confident41 Ų4169 Ų6922%0.21535%0.348CS..Hα-helixtrans-67.3-37.4-179.5-166.366.8000111.3L118 L122 K128 R129 I134 Y135L118-L131 HydrophobicContact CD1-CD1 3.77Å; L122-L131 HydrophobicContact CB-CD2 4.16Å; L122-L131 HydrophobicContact CB-CG 4.44Å; L122-L131 HydrophobicContact CD1-CB 3.87Å; L122-L131 HydrophobicContact CD1-CD2 3.75Å; L122-L131 HydrophobicContact CD1-CG 3.73Å; K128-L131 HydrophobicContact CB-CB 4.27Å; K128-L131 WeakPolarHBondContact O-CB 3.41Å; K128-L131 PolarHBondContact O-N 3.47Å; R129-L131 VanDerWaalsContact C-N 3.32Å; R129-L131 PolarHBondContact O-N 3.27Å; L131-I134 PolarHBondContact O-N 3.46Å; L131-Y135 VanDerWaalsContact O-CB 3.31Å; L131-Y135 WeakPolarHBondContact O-CB 3.49Å; L131-Y135 PolarHBondContact O-N 2.94Å
132L83.3Confident84.2Confident3 Ų367.8 Ų67.82%0.01634%0.338CS..Hα-helixtrans-63.3-42.4173.9-175.269.2000111.7I65 L122 K128 R129 L130 Y135 A136 N214 L215I65-L132 HydrophobicContact CD1-CD2 3.66Å; L122-L132 HydrophobicContact CD1-CB 4.38Å; L122-L132 HydrophobicContact CD2-CD1 3.83Å; K128-L132 PolarHBondContact O-N 3.03Å; K128-L132 VanDerWaalsContact O-N 3.13Å; R129-L132 PolarHBondContact O-N 3.22Å; L130-L132 VanDerWaalsContact C-N 3.34Å; L130-L132 PolarHBondContact O-N 3.03Å; L132-Y135 PolarHBondContact O-N 2.96Å; L132-A136 WeakPolarHBondContact O-CB 3.31Å; L132-A136 PolarHBondContact O-N 2.97Å; L132-N214 HydrophobicContact CD2-CB 4.33Å; L132-L215 HydrophobicContact CD2-CD2 3.55Å; L132-L215 HydrophobicContact CD2-CG 3.9Å; L132-L215 HydrophobicContact CG-CD2 4.06Å; L132-L215 HydrophobicContact CG-CG 4.33Å
133V85.1Confident84.6Confident64 Ų6470 Ų7039%0.38835%0.35SS..Hα-helixtrans-65.2-45.3176.6174.30000111R129 L130 Y135 A136 C137 L215R129-V133 WeakPolarHBondContact O-CG2 3.33Å; R129-V133 PolarHBondContact O-N 3.43Å; R129-V133 VanDerWaalsContact O-N 3.1Å; L130-V133 PolarHBondContact O-N 3.13Å; V133-Y135 VanDerWaalsContact C-N 3.29Å; V133-Y135 PolarHBondContact O-N 3.5Å; V133-A136 PolarHBondContact O-N 3.04Å; V133-C137 PolarHBondContact O-N 3.23Å; V133-C137 PolarHBondContact O-SG 3.41Å; V133-C137 VanDerWaalsContact O-SG 3.36Å; V133-L215 HydrophobicContact CG2-CD2 4.42Å
134I89.7Confident85.1Confident75 Ų7573.7 Ų73.739%0.38537%0.367SS..Hα-helixtrans-59.9-43175.5-65165.5000110.1L118 L130 L131 C137 T138L118-I134 HydrophobicContact CD2-CG2 3.94Å; L130-I134 HydrophobicContact CD2-CD1 4.47Å; L130-I134 HydrophobicContact CG-CD1 3.94Å; L130-I134 VanDerWaalsContact O-CG1 3.25Å; L130-I134 WeakPolarHBondContact O-CG1 3.15Å; L130-I134 PolarHBondContact O-N 3.31Å; L131-I134 PolarHBondContact O-N 3.46Å; I134-C137 PolarHBondContact O-N 3.1Å; I134-T138 HydrophobicContact CG2-CG2 4.32Å; I134-T138 WeakPolarHBondContact O-CB 3.33Å; I134-T138 WeakPolarHBondContact O-CG2 3.46Å; I134-T138 PolarHBondContact O-N 3.33Å; I134-T138 PolarHBondContact O-OG1 2.88Å
135Y89.8Confident85.5Confident0 Ų066.9 Ų66.90%034%0.339CS..Hα-helixtrans-64.2-38.6177-176-121.1000112.5L118 L122 L131 L132 V133 T138 N139 C211L118-Y135 HydrophobicContact CB-CD2 4.37Å; L118-Y135 HydrophobicContact CD2-CD2 4.23Å; L118-Y135 HydrophobicContact CG-CD2 4.14Å; L122-Y135 HydrophobicContact CD2-CD1 3.6Å; L122-Y135 HydrophobicContact CD2-CE1 4.29Å; L122-Y135 HydrophobicContact CD2-CG 4.03Å; L131-Y135 VanDerWaalsContact O-CB 3.31Å; L131-Y135 WeakPolarHBondContact O-CB 3.49Å; L131-Y135 PolarHBondContact O-N 2.94Å; L132-Y135 PolarHBondContact O-N 2.96Å; V133-Y135 VanDerWaalsContact C-N 3.29Å; V133-Y135 PolarHBondContact O-N 3.5Å; Y135-T138 WeakPolarHBondContact CA-OG1 3.24Å; Y135-T138 PolarHBondContact O-OG1 3.2Å; Y135-N139 WeakPolarHBondContact CD1-ND2 3.26Å; Y135-N139 WeakPolarHBondContact CE1-ND2 3.43Å; Y135-N139 VanDerWaalsContact CE2-ND2 3.33Å; Y135-N139 WeakPolarHBondContact CE2-ND2 3.26Å; Y135-N139 WeakPolarHBondContact O-CB 3.25Å; Y135-N139 PolarHBondContact O-N 3.28Å; Y135-N139 PolarHBondContact O-ND2 3.49Å; Y135-C211 WeakPolarHBondContact CD1-SG 3.22Å; Y135-C211 WeakPolarHBondContact CE1-SG 3.45Å
136A88.9Confident86.4Confident17 Ų1761.4 Ų61.414%0.1431%0.31CS..Hα-helixtrans-63.9-46.2174.300000111.7L132 V133 T138 N139 L140 L215L132-A136 WeakPolarHBondContact O-CB 3.31Å; L132-A136 PolarHBondContact O-N 2.97Å; V133-A136 PolarHBondContact O-N 3.04Å; A136-T138 PolarHBondContact O-N 3.5Å; A136-N139 PolarHBondContact O-N 3.1Å; A136-L140 WeakPolarHBondContact O-CG 3.42Å; A136-L140 PolarHBondContact O-N 3.44Å; A136-L215 HydrophobicContact CB-CD1 4.17Å
137C91.7Very high87.7Confident76 Ų7658.2 Ų58.251%0.51431%0.306SS..Hα-helixtrans-62.4-43.1177.2-68.40000112.4V133 I134 L140 L141V133-C137 PolarHBondContact O-N 3.23Å; V133-C137 PolarHBondContact O-SG 3.41Å; V133-C137 VanDerWaalsContact O-SG 3.36Å; I134-C137 PolarHBondContact O-N 3.1Å; C137-L140 PolarHBondContact O-N 2.86Å; C137-L141 PolarHBondContact O-N 3.26Å
138T93.2Very high88.8Confident41 Ų4162 Ų6225%0.25232%0.319SS..Hα-helixtrans-68.3-34.7178.2470000112.2N115 L118 I134 Y135 A136 L141 S142N115-T138 VanDerWaalsContact OD1-CB 3.28Å; N115-T138 WeakPolarHBondContact OD1-CB 3.31Å; N115-T138 PolarHBondContact OD1-O 3.09Å; N115-T138 PolarHBondContact OD1-OG1 3.22Å; L118-T138 HydrophobicContact CD2-CG2 4.02Å; L118-T138 WeakPolarHBondContact CD2-OG1 3.47Å; I134-T138 HydrophobicContact CG2-CG2 4.32Å; I134-T138 WeakPolarHBondContact O-CB 3.33Å; I134-T138 WeakPolarHBondContact O-CG2 3.46Å; I134-T138 PolarHBondContact O-N 3.33Å; I134-T138 PolarHBondContact O-OG1 2.88Å; Y135-T138 WeakPolarHBondContact CA-OG1 3.24Å; Y135-T138 PolarHBondContact O-OG1 3.2Å; A136-T138 PolarHBondContact O-N 3.5Å; T138-L141 PolarHBondContact O-N 3.43Å; T138-S142 VanDerWaalsContact O-CB 3.3Å; T138-S142 WeakPolarHBondContact O-CB 3.46Å; T138-S142 PolarHBondContact O-N 2.94Å
139N91.7Very high89.5Confident2 Ų255.6 Ų55.61%0.01129%0.292CS..Hα-helixtrans-63.7-42.4171.3-82.4-51000112.7N115 Y135 A136 L141 S142 L143N115-N139 PolarHBondContact ND2-OD1 3.32Å; N115-N139 PolarHBondContact OD1-N 2.87Å; Y135-N139 WeakPolarHBondContact CD1-ND2 3.26Å; Y135-N139 WeakPolarHBondContact CE1-ND2 3.43Å; Y135-N139 VanDerWaalsContact CE2-ND2 3.33Å; Y135-N139 WeakPolarHBondContact CE2-ND2 3.26Å; Y135-N139 WeakPolarHBondContact O-CB 3.25Å; Y135-N139 PolarHBondContact O-N 3.28Å; Y135-N139 PolarHBondContact O-ND2 3.49Å; A136-N139 PolarHBondContact O-N 3.1Å; N139-L141 VanDerWaalsContact C-N 3.35Å; N139-S142 WeakPolarHBondContact O-CB 3.37Å; N139-S142 PolarHBondContact O-N 3.35Å; N139-L143 WeakPolarHBondContact O-CB 3.23Å; N139-L143 PolarHBondContact O-N 2.9Å
140L93Very high90.5Very high98 Ų9852.4 Ų52.451%0.51328%0.282SS..Hα-helixtrans-62-44.7175.3-70.3173.9000111.1A136 C137 S142 L143 L144A136-L140 WeakPolarHBondContact O-CG 3.42Å; A136-L140 PolarHBondContact O-N 3.44Å; C137-L140 PolarHBondContact O-N 2.86Å; L140-S142 VanDerWaalsContact C-N 3.32Å; L140-S142 PolarHBondContact O-N 2.93Å; L140-L143 PolarHBondContact O-N 3.46Å; L140-L144 WeakPolarHBondContact O-CG 3.26Å; L140-L144 PolarHBondContact O-N 3.2Å
141L94.1Very high91.1Very high100 Ų10049.4 Ų49.452%0.52427%0.271SS..Hα-helixtrans-60.8-43.1174.2-178.461.8000111.5C137 T138 N139 L143 L144 L145C137-L141 PolarHBondContact O-N 3.26Å; T138-L141 PolarHBondContact O-N 3.43Å; N139-L141 VanDerWaalsContact C-N 3.35Å; L141-L143 VanDerWaalsContact C-N 3.29Å; L141-L143 PolarHBondContact O-N 2.91Å; L141-L144 PolarHBondContact O-N 3.42Å; L141-L145 HydrophobicContact CD1-CG 4.48Å; L141-L145 HydrophobicContact CG-CD1 4.27Å; L141-L145 WeakPolarHBondContact O-CB 3.45Å; L141-L145 WeakPolarHBondContact O-CG 3.4Å; L141-L145 PolarHBondContact O-N 2.97Å
142S94.1Very high91.4Very high3 Ų349.1 Ų49.12%0.02127%0.27CS..Hα-helixtrans-62.3-36.5177.1-173.70000112.2F112 T138 N139 L140 S146 H200F112-S142 WeakPolarHBondContact CD1-OG 3.29Å; F112-S142 WeakPolarHBondContact CE1-O 3.46Å; T138-S142 VanDerWaalsContact O-CB 3.3Å; T138-S142 WeakPolarHBondContact O-CB 3.46Å; T138-S142 PolarHBondContact O-N 2.94Å; N139-S142 WeakPolarHBondContact O-CB 3.37Å; N139-S142 PolarHBondContact O-N 3.35Å; L140-S142 VanDerWaalsContact C-N 3.32Å; L140-S142 PolarHBondContact O-N 2.93Å; S142-S146 WeakPolarHBondContact O-CB 3.43Å; S142-S146 PolarHBondContact O-N 3.5Å; S142-H200 PolarHBondContact OG-CE1 2.76Å
143L93.7Very high91.6Very high47 Ų4749 Ų4925%0.24627%0.269CS..Hα-helixtrans-66-45.9175.2-175.6149.2000111.1N139 L140 L141 L145 S146 V147 I205N139-L143 WeakPolarHBondContact O-CB 3.23Å; N139-L143 PolarHBondContact O-N 2.9Å; L140-L143 PolarHBondContact O-N 3.46Å; L141-L143 VanDerWaalsContact C-N 3.29Å; L141-L143 PolarHBondContact O-N 2.91Å; L143-L145 PolarHBondContact O-N 2.82Å; L143-S146 WeakPolarHBondContact O-CB 3.17Å; L143-S146 PolarHBondContact O-N 3.35Å; L143-S146 VanDerWaalsContact O-N 3.16Å; L143-V147 WeakPolarHBondContact O-CG2 3.2Å; L143-V147 PolarHBondContact O-N 3.19Å; L143-I205 HydrophobicContact CD1-CD1 4.32Å; L143-I205 HydrophobicContact CD1-CG1 3.48Å; L143-I205 VanDerWaalsContact CD1-CG1 3.48Å
144L94.5Very high91.8Very high114 Ų11447.5 Ų47.560%0.59726%0.263SS*.Hα-helixtrans-59.8-45.8175.8-68.7174.7000111.9L140 L141 S146 V147 F148L140-L144 WeakPolarHBondContact O-CG 3.26Å; L140-L144 PolarHBondContact O-N 3.2Å; L141-L144 PolarHBondContact O-N 3.42Å; L144-S146 VanDerWaalsContact C-N 3.28Å; L144-S146 PolarHBondContact O-N 2.8Å; L144-V147 PolarHBondContact O-N 3.23Å; L144-F148 WeakPolarHBondContact O-CB 3.48Å; L144-F148 PolarHBondContact O-N 3.29Å
145L93.7Very high91.8Very high24 Ų2450.5 Ų50.513%0.12627%0.27CS..Hα-helixtrans-62.2-36.2176-72178.3000112W107 M108 A111 F112 L141 L143 F148 L149W107-L145 HydrophobicContact CH2-CD2 3.66Å; W107-L145 HydrophobicContact CZ3-CD1 4.34Å; W107-L145 HydrophobicContact CZ3-CD2 3.64Å; M108-L145 HydrophobicContact CG-CD2 4.28Å; M108-L145 HydrophobicContact SD-CD2 4.45Å; A111-L145 HydrophobicContact CB-CD1 3.92Å; F112-L145 HydrophobicContact CE1-CB 3.66Å; F112-L145 HydrophobicContact CZ-CB 4.02Å; L141-L145 HydrophobicContact CD1-CG 4.48Å; L141-L145 HydrophobicContact CG-CD1 4.27Å; L141-L145 WeakPolarHBondContact O-CB 3.45Å; L141-L145 WeakPolarHBondContact O-CG 3.4Å; L141-L145 PolarHBondContact O-N 2.97Å; L143-L145 PolarHBondContact O-N 2.82Å; L145-F148 PolarHBondContact O-N 3.31Å; L145-L149 WeakPolarHBondContact O-CB 3.28Å; L145-L149 PolarHBondContact O-N 2.86Å
146S92.7Very high91.6Very high1 Ų151 Ų511%0.00727%0.272CS..Hα-helixtrans-65.3-42.5176.5-159.10000112.1S142 L143 L144 F148 L149 F150 T197S142-S146 WeakPolarHBondContact O-CB 3.43Å; S142-S146 PolarHBondContact O-N 3.5Å; L143-S146 WeakPolarHBondContact O-CB 3.17Å; L143-S146 PolarHBondContact O-N 3.35Å; L143-S146 VanDerWaalsContact O-N 3.16Å; L144-S146 VanDerWaalsContact C-N 3.28Å; L144-S146 PolarHBondContact O-N 2.8Å; S146-F148 VanDerWaalsContact C-N 3.33Å; S146-L149 PolarHBondContact O-N 3.47Å; S146-F150 WeakPolarHBondContact O-CB 3.49Å; S146-F150 PolarHBondContact O-N 2.93Å; S146-T197 WeakPolarHBondContact O-CG2 3.25Å; S146-T197 PolarHBondContact OG-O 2.87Å; S146-T197 VanDerWaalsContact OG-O 3.06Å
147V93.4Very high91.5Very high79 Ų7952.1 Ų52.148%0.47928%0.276SS..Hα-helixtrans-66.1-38.5175.7175.10000111.3L143 L144 F150 S151L143-V147 WeakPolarHBondContact O-CG2 3.2Å; L143-V147 PolarHBondContact O-N 3.19Å; L144-V147 PolarHBondContact O-N 3.23Å; V147-F150 PolarHBondContact O-N 3.46Å; V147-S151 WeakPolarHBondContact O-CB 3.45Å; V147-S151 PolarHBondContact O-N 2.96Å; V147-S151 PolarHBondContact O-OG 3.47Å
148F92.3Very high91.3Very high107 Ų10751.4 Ų51.447%0.46927%0.267SS..Hα-helixtrans-66.2-46.1176.6-173.3-110.6000111.8M108 L144 L145 S146 F150 S151 I152M108-F148 HydrophobicContact CE-CD1 4.3Å; M108-F148 HydrophobicContact SD-CD1 3.85Å; L144-F148 WeakPolarHBondContact O-CB 3.48Å; L144-F148 PolarHBondContact O-N 3.29Å; L145-F148 PolarHBondContact O-N 3.31Å; S146-F148 VanDerWaalsContact C-N 3.33Å; F148-F150 VanDerWaalsContact C-N 3.31Å; F148-F150 PolarHBondContact O-N 2.89Å; F148-S151 PolarHBondContact O-N 3.5Å; F148-I152 HydrophobicContact CD1-CD1 3.66Å; F148-I152 HydrophobicContact CE1-CD1 3.22Å; F148-I152 HydrophobicContact CE1-CG1 4.3Å; F148-I152 HydrophobicContact CE2-CD1 4.26Å; F148-I152 HydrophobicContact CG-CD1 4.36Å; F148-I152 HydrophobicContact CZ-CD1 3.57Å; F148-I152 HydrophobicContact CZ-CG1 4.32Å; F148-I152 WeakPolarHBondContact O-CG1 3.44Å; F148-I152 PolarHBondContact O-N 3.25Å
149L90.8Very high90.9Very high0 Ų052.8 Ų52.80%027%0.271CS..Hα-helixtrans-60.2-41.3175.2-178.165.9000111.6I87 M108 F112 L145 S146 I152 T153 T197I87-L149 HydrophobicContact CG2-CD2 3.86Å; M108-L149 HydrophobicContact CE-CB 4.1Å; M108-L149 HydrophobicContact CE-CD1 3.45Å; M108-L149 VanDerWaalsContact CE-CD1 3.45Å; M108-L149 HydrophobicContact CE-CG 4.36Å; M108-L149 HydrophobicContact SD-CB 3.85Å; M108-L149 HydrophobicContact SD-CD1 4.23Å; F112-L149 HydrophobicContact CE2-CD2 3.9Å; L145-L149 WeakPolarHBondContact O-CB 3.28Å; L145-L149 PolarHBondContact O-N 2.86Å; S146-L149 PolarHBondContact O-N 3.47Å; L149-I152 PolarHBondContact O-N 3.46Å; L149-T153 WeakPolarHBondContact O-CB 3.39Å; L149-T153 PolarHBondContact O-N 3.02Å; L149-T153 PolarHBondContact O-OG1 2.87Å; L149-T197 HydrophobicContact CB-CG2 4.14Å; L149-T197 HydrophobicContact CD2-CG2 4.06Å; L149-T197 HydrophobicContact CG-CG2 4.19Å
150F92.5Very high90.4Very high82 Ų8253.6 Ų53.636%0.3627%0.274SS..Hα-helixtrans-61.7-47.8175.5-179.1-99000111.2S146 V147 F148 I152 T153 A154 M194 T197S146-F150 WeakPolarHBondContact O-CB 3.49Å; S146-F150 PolarHBondContact O-N 2.93Å; V147-F150 PolarHBondContact O-N 3.46Å; F148-F150 VanDerWaalsContact C-N 3.31Å; F148-F150 PolarHBondContact O-N 2.89Å; F150-I152 PolarHBondContact O-N 2.81Å; F150-T153 PolarHBondContact O-N 3.3Å; F150-A154 WeakPolarHBondContact O-CB 3.44Å; F150-A154 PolarHBondContact O-N 3.39Å; F150-M194 HydrophobicContact CD2-SD 3.87Å; F150-M194 HydrophobicContact CE2-CE 4.32Å; F150-M194 HydrophobicContact CE2-SD 3.59Å; F150-M194 VanDerWaalsContact CE2-SD 3.59Å; F150-M194 HydrophobicContact CZ-CE 4.39Å; F150-M194 HydrophobicContact CZ-SD 4.2Å; F150-T197 HydrophobicContact CB-CG2 3.9Å
151S91.4Very high89.9Confident63 Ų6353.1 Ų53.144%0.44127%0.27SS..Hα-helixtrans-59.3-44177.6-57.80000112.5V147 F148 W155V147-S151 WeakPolarHBondContact O-CB 3.45Å; V147-S151 PolarHBondContact O-N 2.96Å; V147-S151 PolarHBondContact O-OG 3.47Å; F148-S151 PolarHBondContact O-N 3.5Å; S151-W155 WeakPolarHBondContact O-CB 3.21Å; S151-W155 PolarHBondContact O-N 3.35Å
152I89.2Confident89.4Confident36 Ų3653.5 Ų53.519%0.18527%0.267CS..Hα-helixtrans-63.7-46.6176.3-71.5172.9000110.9M108 F148 L149 F150 A154 W155 L156M108-I152 HydrophobicContact CE-CD1 4.22Å; F148-I152 HydrophobicContact CD1-CD1 3.66Å; F148-I152 HydrophobicContact CE1-CD1 3.22Å; F148-I152 HydrophobicContact CE1-CG1 4.3Å; F148-I152 HydrophobicContact CE2-CD1 4.26Å; F148-I152 HydrophobicContact CG-CD1 4.36Å; F148-I152 HydrophobicContact CZ-CD1 3.57Å; F148-I152 HydrophobicContact CZ-CG1 4.32Å; F148-I152 WeakPolarHBondContact O-CG1 3.44Å; F148-I152 PolarHBondContact O-N 3.25Å; L149-I152 PolarHBondContact O-N 3.46Å; F150-I152 PolarHBondContact O-N 2.81Å; I152-A154 VanDerWaalsContact C-N 3.32Å; I152-A154 PolarHBondContact O-N 3.22Å; I152-W155 PolarHBondContact O-N 2.91Å; I152-L156 HydrophobicContact CG2-CD1 3.87Å; I152-L156 HydrophobicContact CG2-CG 4.38Å; I152-L156 WeakPolarHBondContact O-CG 3.34Å; I152-L156 PolarHBondContact O-N 2.9Å
153T88Confident88.7Confident0 Ų057.4 Ų57.40%029%0.285CS..Hα-helixtrans-64.9-39.8-178.1-53.50000110.7Y102 L149 F150 L156 L157 H193 M194Y102-T153 PolarHBondContact OH-OG1 3.39Å; L149-T153 WeakPolarHBondContact O-CB 3.39Å; L149-T153 PolarHBondContact O-N 3.02Å; L149-T153 PolarHBondContact O-OG1 2.87Å; F150-T153 PolarHBondContact O-N 3.3Å; T153-L156 PolarHBondContact O-N 3.49Å; T153-L157 WeakPolarHBondContact O-CB 3.05Å; T153-L157 PolarHBondContact O-N 3.3Å; T153-H193 HydrophobicContact CG2-CB 3.77Å; T153-M194 HydrophobicContact CG2-CG 3.82Å; T153-M194 HydrophobicContact CG2-SD 4.09Å
154A89.6Confident87.8Confident32 Ų3257.3 Ų57.326%0.26428%0.284SS..Hα-helixtrans-62.3-43.8174.400000112.3F150 I152 L157 D158 M194F150-A154 WeakPolarHBondContact O-CB 3.44Å; F150-A154 PolarHBondContact O-N 3.39Å; I152-A154 VanDerWaalsContact C-N 3.32Å; I152-A154 PolarHBondContact O-N 3.22Å; A154-L157 PolarHBondContact O-N 3.44Å; A154-D158 PolarHBondContact O-N 2.94Å; A154-M194 VanDerWaalsContact CA-CE 3.5Å; A154-M194 HydrophobicContact CB-CE 3.53Å; A154-M194 HydrophobicContact CB-SD 4.03Å
155W89.3Confident87Confident139 Ų13960.6 Ų60.653%0.52729%0.289SS..Hα-helixtrans-64.3-42.5176.9178.178.3000112.4S151 I152 D158 Q159S151-W155 WeakPolarHBondContact O-CB 3.21Å; S151-W155 PolarHBondContact O-N 3.35Å; I152-W155 PolarHBondContact O-N 2.91Å; W155-D158 PolarHBondContact O-N 3.35Å; W155-Q159 VanDerWaalsContact CH2-NE2 3.28Å; W155-Q159 HydrophobicContact CZ2-CG 4.42Å; W155-Q159 WeakPolarHBondContact O-CG 3.5Å; W155-Q159 PolarHBondContact O-N 3.48Å
156L86.6Confident86.2Confident9 Ų967.6 Ų67.65%0.04732%0.321CS..Hα-helixtrans-64.1-40.1175.9-73.2170.3000112P101 Y102 I152 T153 Q159 Q160 Y190P101-L156 HydrophobicContact CG-CD2 4.16Å; Y102-L156 HydrophobicContact CD2-CD1 3.63Å; Y102-L156 HydrophobicContact CE2-CD1 3.84Å; I152-L156 HydrophobicContact CG2-CD1 3.87Å; I152-L156 HydrophobicContact CG2-CG 4.38Å; I152-L156 WeakPolarHBondContact O-CG 3.34Å; I152-L156 PolarHBondContact O-N 2.9Å; T153-L156 PolarHBondContact O-N 3.49Å; L156-Q159 PolarHBondContact O-N 2.92Å; L156-Q160 WeakPolarHBondContact O-CG 3.38Å; L156-Q160 PolarHBondContact O-N 3.41Å; L156-Y190 HydrophobicContact CB-CE2 4.34Å
157L85.9Confident85Confident41 Ų4173.9 Ų73.922%0.21535%0.35CS..Hα-helixtrans-63.9-41.9177.1-17265.7000111.6T153 A154 Q159 Q160 E161 T191 M194T153-L157 WeakPolarHBondContact O-CB 3.05Å; T153-L157 PolarHBondContact O-N 3.3Å; A154-L157 PolarHBondContact O-N 3.44Å; L157-Q159 VanDerWaalsContact C-N 3.34Å; L157-Q159 PolarHBondContact O-N 3.43Å; L157-Q160 PolarHBondContact O-N 3.28Å; L157-E161 WeakPolarHBondContact O-CB 3.07Å; L157-E161 PolarHBondContact O-N 3.34Å; L157-T191 HydrophobicContact CD1-CG2 4.47Å; L157-M194 HydrophobicContact CD2-CE 4.2Å; L157-M194 HydrophobicContact CD2-CG 4.47Å
158D87.9Confident83.4Confident62 Ų6271.9 Ų71.933%0.33235%0.345SS..Hα-helixtrans-63.5-37.6174.9176.462.4000112.1A154 W155 E161 K162A154-D158 PolarHBondContact O-N 2.94Å; W155-D158 PolarHBondContact O-N 3.35Å; D158-E161 PolarHBondContact O-N 3.36Å; D158-K162 WeakPolarHBondContact O-CB 3.4Å; D158-K162 VanDerWaalsContact O-CG 3.28Å; D158-K162 WeakPolarHBondContact O-CG 3.48Å; D158-K162 PolarHBondContact O-N 3.25Å; D158-K162 WeakPolarHBondContact OD1-CE 3.34Å; D158-K162 IonicContact OD1-NZ 2.65Å; D158-K162 VanDerWaalsContact OD2-CE 3.27Å; D158-K162 WeakPolarHBondContact OD2-CE 3.34Å; D158-K162 IonicContact OD2-NZ 2.89Å; D158-K162 PolarHBondContact OD2-NZ 3.25Å
159Q85.2Confident81.9Confident70 Ų7077.4 Ų77.433%0.32736%0.363SS..Hα-helixtrans-63.7-46.7173.4-73.1-166-33.400112.3W155 L156 L157 E161 K162 E163W155-Q159 VanDerWaalsContact CH2-NE2 3.28Å; W155-Q159 HydrophobicContact CZ2-CG 4.42Å; W155-Q159 WeakPolarHBondContact O-CG 3.5Å; W155-Q159 PolarHBondContact O-N 3.48Å; L156-Q159 PolarHBondContact O-N 2.92Å; L157-Q159 VanDerWaalsContact C-N 3.34Å; L157-Q159 PolarHBondContact O-N 3.43Å; Q159-E161 VanDerWaalsContact C-N 3.33Å; Q159-E161 PolarHBondContact O-N 2.96Å; Q159-K162 PolarHBondContact O-N 3.01Å; Q159-E163 WeakPolarHBondContact O-CG 3.42Å; Q159-E163 PolarHBondContact O-N 2.77Å
160Q80.7Confident80.2Confident18 Ų1884.4 Ų84.48%0.08440%0.396CS..Hα-helixtrans-63-40.6177.2-68.1-62.7-82.200111.7L156 L157 K162 E163 I164 Y190L156-Q160 WeakPolarHBondContact O-CG 3.38Å; L156-Q160 PolarHBondContact O-N 3.41Å; L157-Q160 PolarHBondContact O-N 3.28Å; Q160-K162 VanDerWaalsContact C-N 3.33Å; Q160-K162 PolarHBondContact O-N 2.89Å; Q160-E163 PolarHBondContact NE2-OE2 3Å; Q160-E163 PolarHBondContact O-N 3.36Å; Q160-I164 WeakPolarHBondContact O-CD1 3.3Å; Q160-I164 VanDerWaalsContact O-CG1 3.29Å; Q160-I164 WeakPolarHBondContact O-CG1 3.47Å; Q160-I164 PolarHBondContact O-N 3.06Å; Q160-Y190 HydrophobicContact CG-CD2 4.26Å; Q160-Y190 HydrophobicContact CG-CE2 3.81Å
161E82.5Confident78.5Confident89 Ų8986.3 Ų86.342%0.41642%0.416SS..Hα-helixtrans-63.9-39.7177-171.4177.2-178.100111.8L157 D158 Q159 I164 R165L157-E161 WeakPolarHBondContact O-CB 3.07Å; L157-E161 PolarHBondContact O-N 3.34Å; D158-E161 PolarHBondContact O-N 3.36Å; Q159-E161 VanDerWaalsContact C-N 3.33Å; Q159-E161 PolarHBondContact O-N 2.96Å; E161-I164 PolarHBondContact O-N 3.4Å; E161-R165 WeakPolarHBondContact O-CB 3.47Å; E161-R165 VanDerWaalsContact O-CG 3.25Å; E161-R165 WeakPolarHBondContact O-CG 3.46Å; E161-R165 PolarHBondContact O-N 2.87Å; E161-R165 IonicContact OE1-CZ 3.89Å; E161-R165 VanDerWaalsContact OE1-CZ 3.26Å; E161-R165 IonicContact OE1-NE 3.13Å; E161-R165 PolarHBondContact OE1-NE 3Å; E161-R165 IonicContact OE1-NH2 2.89Å; E161-R165 PolarHBondContact OE1-NH2 3.47Å
162K84.3Confident76.5Confident108 Ų10887 Ų8747%0.4742%0.421SS..Hα-helixtrans-63.3-41.7174.2-76.6168.2178.9165.50112.1D158 Q159 Q160 R165 Q166D158-K162 WeakPolarHBondContact O-CB 3.4Å; D158-K162 VanDerWaalsContact O-CG 3.28Å; D158-K162 WeakPolarHBondContact O-CG 3.48Å; D158-K162 PolarHBondContact O-N 3.25Å; D158-K162 WeakPolarHBondContact OD1-CE 3.34Å; D158-K162 IonicContact OD1-NZ 2.65Å; D158-K162 VanDerWaalsContact OD2-CE 3.27Å; D158-K162 WeakPolarHBondContact OD2-CE 3.34Å; D158-K162 IonicContact OD2-NZ 2.89Å; D158-K162 PolarHBondContact OD2-NZ 3.25Å; Q159-K162 PolarHBondContact O-N 3.01Å; Q160-K162 VanDerWaalsContact C-N 3.33Å; Q160-K162 PolarHBondContact O-N 2.89Å; K162-R165 PolarHBondContact O-N 3.36Å; K162-Q166 WeakPolarHBondContact O-CB 3.5Å; K162-Q166 WeakPolarHBondContact O-CG 3.35Å; K162-Q166 PolarHBondContact O-N 3.06Å
163E79.4Confident74.7Confident85 Ų8592.1 Ų92.140%0.39744%0.444SS..Hα-helixtrans-60.3-47.3176.5-74.2172.1-179.400111.2Q159 Q160 R165 Q166 Q167Q159-E163 WeakPolarHBondContact O-CG 3.42Å; Q159-E163 PolarHBondContact O-N 2.77Å; Q160-E163 PolarHBondContact NE2-OE2 3Å; Q160-E163 PolarHBondContact O-N 3.36Å; E163-R165 PolarHBondContact O-N 3.29Å; E163-Q166 PolarHBondContact O-N 3.36Å; E163-Q167 WeakPolarHBondContact O-CG 3.23Å; E163-Q167 PolarHBondContact O-N 2.96Å
164I75Confident73Confident44 Ų4497.8 Ų97.823%0.22648%0.484CS..Hα-helixtrans-63.6-40.7178.1-64.4163.2000111.3Q160 E161 G168 I187Q160-I164 WeakPolarHBondContact O-CD1 3.3Å; Q160-I164 VanDerWaalsContact O-CG1 3.29Å; Q160-I164 WeakPolarHBondContact O-CG1 3.47Å; Q160-I164 PolarHBondContact O-N 3.06Å; E161-I164 PolarHBondContact O-N 3.4Å; I164-G168 PolarHBondContact O-N 3.24Å; I164-G168 VanDerWaalsContact O-N 3.14Å; I164-I187 HydrophobicContact CD1-CD1 3.61Å; I164-I187 HydrophobicContact CD1-CG1 4.49Å
165R77.3Confident71.2Confident184 Ų184102.6 Ų102.669%0.69450%0.504SS*.Hα-helixtrans-67.4-36.3177.9-73.8175.2-177.6-157.44.7112.7E161 K162 E163E161-R165 WeakPolarHBondContact O-CB 3.47Å; E161-R165 VanDerWaalsContact O-CG 3.25Å; E161-R165 WeakPolarHBondContact O-CG 3.46Å; E161-R165 PolarHBondContact O-N 2.87Å; E161-R165 IonicContact OE1-CZ 3.89Å; E161-R165 VanDerWaalsContact OE1-CZ 3.26Å; E161-R165 IonicContact OE1-NE 3.13Å; E161-R165 PolarHBondContact OE1-NE 3Å; E161-R165 IonicContact OE1-NH2 2.89Å; E161-R165 PolarHBondContact OE1-NH2 3.47Å; K162-R165 PolarHBondContact O-N 3.36Å; E163-R165 PolarHBondContact O-N 3.29Å
166Q76.6Confident69.8Low170 Ų17098.3 Ų98.379%0.79449%0.494SS*.Hα-helixtrans-74.8-40.2179.4-76.1-1791.700112.5K162 E163 G168K162-Q166 WeakPolarHBondContact O-CB 3.5Å; K162-Q166 WeakPolarHBondContact O-CG 3.35Å; K162-Q166 PolarHBondContact O-N 3.06Å; E163-Q166 PolarHBondContact O-N 3.36Å; Q166-G168 VanDerWaalsContact C-N 3.25Å; Q166-G168 PolarHBondContact O-N 3.07Å
167Q67.9Low68.7Low133 Ų133103.9 Ų103.962%0.62152%0.52SS*.Hα-helixtrans-76.8-16.2-179.6-66.7-178.311.300112.1E163 H170E163-Q167 WeakPolarHBondContact O-CG 3.23Å; E163-Q167 PolarHBondContact O-N 2.96Å; Q167-H170 PolarHBondContact O-CD2 3.34Å
168G59.8Low67.8Low37 Ų37107.5 Ų107.538%0.38154%0.539SS..  trans65.9156.7-170.300000110.7I164 Q166 H170I164-G168 PolarHBondContact O-N 3.24Å; I164-G168 VanDerWaalsContact O-N 3.14Å; Q166-G168 VanDerWaalsContact C-N 3.25Å; Q166-G168 PolarHBondContact O-N 3.07Å; G168-H170 PolarHBondContact O-N 3.25Å
169W60.7Low66.9Low223 Ų223109.1 Ų109.185%0.84555%0.547SS*.  trans-69.477.6169.8-81.778.4000108.7P171W169-P171 WeakPolarHBondContact O-CD 3.43Å
170H55.2Low66.2Low147 Ų147112 Ų11268%0.68156%0.555SS**  trans-81.9107.2178.6-101-63.7000109.7Q167 G168 S172Q167-H170 PolarHBondContact O-CD2 3.34Å; G168-H170 PolarHBondContact O-N 3.25Å; H170-S172 PolarHBondContact O-N 2.79Å; H170-S172 VanDerWaalsContact O-N 3.12Å
171P55.6Low66.1Low122 Ų122116 Ų11679%0.79258%0.576SS**  trans-83.221.4-173.435.4-34.6000113.6W169W169-P171 WeakPolarHBondContact O-CD 3.43Å
172S50.9Low65.8Low78 Ų78114.2 Ų114.255%0.54557%0.569SS.*  trans-123.779-162.861.10000113.6H170H170-S172 PolarHBondContact O-N 2.79Å; H170-S172 VanDerWaalsContact O-N 3.12Å
173Q51.4Low65.5Low143 Ų143112.7 Ų112.767%0.66856%0.563SS**  trans-171131.7153-105.9164.230.400110.2L175 T176Q173-L175 PolarHBondContact O-N 3.49Å; Q173-T176 HydrophobicContact CB-CG2 3.66Å; Q173-T176 WeakPolarHBondContact O-CA 3.02Å; Q173-T176 WeakPolarHBondContact O-CB 3.35Å; Q173-T176 WeakPolarHBondContact O-CG2 3.43Å; Q173-T176 PolarHBondContact O-N 3.06Å; Q173-T176 PolarHBondContact O-OG1 3.33Å
174S51.1Low65.6Low119 Ų119112.6 Ų112.683%0.83257%0.566SS**THydrogen-bonded Turntrans-70-15.5-177.947.70000114.6T176S174-T176 PolarHBondContact O-N 3.44Å
175L52.2Low66Low133 Ų133112.6 Ų112.670%0.69657%0.567SS**THydrogen-bonded Turntrans-72.1-6.1165.5-74.5103.1000112.9Q173 E177Q173-L175 PolarHBondContact O-N 3.49Å; L175-E177 PolarHBondContact O-N 2.86Å
176T59Low66.1Low50 Ų50105.8 Ų105.831%0.30754%0.543SS..Hα-helixtrans-74.6-18.6-178.562.30000113.6Q173 S174 L178 N179 R180Q173-T176 HydrophobicContact CB-CG2 3.66Å; Q173-T176 WeakPolarHBondContact O-CA 3.02Å; Q173-T176 WeakPolarHBondContact O-CB 3.35Å; Q173-T176 WeakPolarHBondContact O-CG2 3.43Å; Q173-T176 PolarHBondContact O-N 3.06Å; Q173-T176 PolarHBondContact O-OG1 3.33Å; S174-T176 PolarHBondContact O-N 3.44Å; T176-L178 PolarHBondContact O-N 2.89Å; T176-N179 PolarHBondContact O-N 3.03Å; T176-R180 WeakPolarHBondContact O-CA 3.39Å; T176-R180 WeakPolarHBondContact O-CB 3.32Å; T176-R180 PolarHBondContact O-N 3.26Å
177E64.9Low66.4Low126 Ų12699.9 Ų99.959%0.58952%0.516SS*.Hα-helixtrans-65.6-46.4-176.7-69.8-162.7158.800112.1L175 I181L175-E177 PolarHBondContact O-N 2.86Å; E177-I181 WeakPolarHBondContact O-CD1 3.5Å; E177-I181 VanDerWaalsContact O-CG1 3.23Å; E177-I181 WeakPolarHBondContact O-CG1 3.35Å; E177-I181 PolarHBondContact O-N 3.2Å
178L65.4Low67.3Low117 Ų11795.6 Ų95.661%0.61350%0.503SS*.Hα-helixtrans-67.4-45.4175.9-171.769.4000111.1T176 R180 I181 I182T176-L178 PolarHBondContact O-N 2.89Å; L178-R180 VanDerWaalsContact C-N 3.31Å; L178-R180 PolarHBondContact O-N 3.32Å; L178-I181 PolarHBondContact O-N 2.96Å; L178-I182 HydrophobicContact CD2-CD1 4.5Å; L178-I182 HydrophobicContact CG-CD1 3.96Å; L178-I182 VanDerWaalsContact O-CG1 3.27Å; L178-I182 WeakPolarHBondContact O-CG1 3.22Å; L178-I182 PolarHBondContact O-N 2.95Å
179N70.6Confident68.5Low96 Ų9695.2 Ų95.251%0.51349%0.492SS..Hα-helixtrans-63.1-37.8178.8-73.5-13.3000111.9T176 I182 E183T176-N179 PolarHBondContact O-N 3.03Å; N179-I182 PolarHBondContact O-N 3.45Å; N179-E183 WeakPolarHBondContact O-CB 3.44Å; N179-E183 PolarHBondContact O-N 3.19Å
180R69.9Low69.7Low131 Ų13184.8 Ų84.849%0.49445%0.453SS..Hα-helixtrans-67.8-40.1175.7-177.2-178.969.7171.1-1.7111.4T176 L178 I182 N184T176-R180 WeakPolarHBondContact O-CA 3.39Å; T176-R180 WeakPolarHBondContact O-CB 3.32Å; T176-R180 PolarHBondContact O-N 3.26Å; L178-R180 VanDerWaalsContact C-N 3.31Å; L178-R180 PolarHBondContact O-N 3.32Å; R180-I182 VanDerWaalsContact C-N 3.32Å; R180-N184 WeakPolarHBondContact O-CB 3.35Å; R180-N184 PolarHBondContact O-N 2.92Å; R180-N184 PolarHBondContact O-ND2 2.85Å
181I78.2Confident71.3Confident100 Ų10080.7 Ų80.751%0.51344%0.438SS..Hα-helixtrans-61.9-45.5173.6-69.9164.1000109.5E177 L178 T185E177-I181 WeakPolarHBondContact O-CD1 3.5Å; E177-I181 VanDerWaalsContact O-CG1 3.23Å; E177-I181 WeakPolarHBondContact O-CG1 3.35Å; E177-I181 PolarHBondContact O-N 3.2Å; L178-I181 PolarHBondContact O-N 2.96Å; I181-T185 VanDerWaalsContact O-CB 3.22Å; I181-T185 WeakPolarHBondContact O-CB 3.38Å; I181-T185 PolarHBondContact O-N 3.47Å; I181-T185 PolarHBondContact O-OG1 3.37Å
182I77.5Confident72.9Confident52 Ų5277.9 Ų77.927%0.26742%0.416SS..Hα-helixtrans-64-45.4179.2-67.1166.3000111Y97 L178 N179 R180 T185 K186Y97-I182 HydrophobicContact CD1-CG1 4.23Å; Y97-I182 HydrophobicContact CD1-CG2 4.16Å; Y97-I182 HydrophobicContact CE1-CG1 4.35Å; L178-I182 HydrophobicContact CD2-CD1 4.5Å; L178-I182 HydrophobicContact CG-CD1 3.96Å; L178-I182 VanDerWaalsContact O-CG1 3.27Å; L178-I182 WeakPolarHBondContact O-CG1 3.22Å; L178-I182 PolarHBondContact O-N 2.95Å; N179-I182 PolarHBondContact O-N 3.45Å; R180-I182 VanDerWaalsContact C-N 3.32Å; I182-T185 CarbonylContact O-C 3.6Å; I182-T185 WeakPolarHBondContact O-CB 3.35Å; I182-T185 PolarHBondContact O-N 2.96Å; I182-K186 WeakPolarHBondContact O-CB 3.45Å; I182-K186 PolarHBondContact O-N 3.03Å
183E76.9Confident74.7Confident77 Ų7774.2 Ų74.236%0.3639%0.39SS..Hα-helixtrans-68.8-45.1-178.3-166.7174.2-161.400111.9N179 T185 K186 I187N179-E183 WeakPolarHBondContact O-CB 3.44Å; N179-E183 PolarHBondContact O-N 3.19Å; E183-T185 VanDerWaalsContact C-N 3.26Å; E183-T185 PolarHBondContact O-N 2.9Å; E183-K186 WeakPolarHBondContact O-CB 3.2Å; E183-K186 PolarHBondContact O-N 3.33Å; E183-K186 VanDerWaalsContact O-N 3.14Å; E183-I187 HydrophobicContact CG-CD1 4.45Å; E183-I187 WeakPolarHBondContact O-CG1 3.34Å; E183-I187 PolarHBondContact O-N 3.42Å
184N81.2Confident76.4Confident83 Ų8369.7 Ų69.744%0.44437%0.37SS..Hα-helixtrans-60.5-38.9171.8-73.6-15.4000111.4R180 A188R180-N184 WeakPolarHBondContact O-CB 3.35Å; R180-N184 PolarHBondContact O-N 2.92Å; R180-N184 PolarHBondContact O-ND2 2.85Å; N184-A188 VanDerWaalsContact O-CB 3.25Å; N184-A188 WeakPolarHBondContact O-CB 3.39Å; N184-A188 PolarHBondContact O-N 3.41Å
185T83.7Confident78.4Confident43 Ų4368.5 Ų68.526%0.26436%0.357SS..Hα-helixtrans-64.9-43.5175.4-58.90000110.2I181 I182 E183 I187 A188 M189I181-T185 VanDerWaalsContact O-CB 3.22Å; I181-T185 WeakPolarHBondContact O-CB 3.38Å; I181-T185 PolarHBondContact O-N 3.47Å; I181-T185 PolarHBondContact O-OG1 3.37Å; I182-T185 CarbonylContact O-C 3.6Å; I182-T185 WeakPolarHBondContact O-CB 3.35Å; I182-T185 PolarHBondContact O-N 2.96Å; E183-T185 VanDerWaalsContact C-N 3.26Å; E183-T185 PolarHBondContact O-N 2.9Å; T185-I187 PolarHBondContact O-N 3.31Å; T185-A188 CarbonylContact O-C 3.59Å; T185-A188 WeakPolarHBondContact O-CB 3.39Å; T185-A188 PolarHBondContact O-N 2.94Å; T185-M189 HydrophobicContact CG2-CE 3.78Å; T185-M189 HydrophobicContact CG2-CG 4.26Å; T185-M189 VanDerWaalsContact O-CG 3.23Å; T185-M189 WeakPolarHBondContact O-CG 3.27Å; T185-M189 PolarHBondContact O-N 2.68Å
186K80.4Confident80.3Confident41 Ų4164.3 Ų64.318%0.17833%0.334CS..Hα-helixtrans-59-48.4177.4-178.5175.7176.7172.80111.9D98 I182 E183 A188 M189 Y190D98-K186 VanDerWaalsContact CG-NZ 3.3Å; D98-K186 IonicContact OD1-NZ 3.05Å; D98-K186 PolarHBondContact OD1-NZ 2.89Å; D98-K186 WeakPolarHBondContact OD2-CE 3.16Å; D98-K186 IonicContact OD2-NZ 3.26Å; D98-K186 PolarHBondContact OD2-NZ 3.17Å; I182-K186 WeakPolarHBondContact O-CB 3.45Å; I182-K186 PolarHBondContact O-N 3.03Å; E183-K186 WeakPolarHBondContact O-CB 3.2Å; E183-K186 PolarHBondContact O-N 3.33Å; E183-K186 VanDerWaalsContact O-N 3.14Å; K186-A188 VanDerWaalsContact C-N 3.34Å; K186-A188 PolarHBondContact O-N 3.23Å; K186-M189 PolarHBondContact O-N 3.48Å; K186-Y190 HydrophobicContact CD-CE2 4.3Å; K186-Y190 WeakPolarHBondContact CE-OH 3.33Å; K186-Y190 HydrophobicContact CG-CD2 4.28Å; K186-Y190 HydrophobicContact CG-CE2 3.76Å; K186-Y190 PolarHBondContact O-N 3Å
187I82.4Confident81.8Confident47 Ų4761.9 Ų61.924%0.24132%0.319CS..Hα-helixtrans-62.3-42.8176.2-61.8163.9000110.5I164 E183 T185 M189 Y190 T191I164-I187 HydrophobicContact CD1-CD1 3.61Å; I164-I187 HydrophobicContact CD1-CG1 4.49Å; E183-I187 HydrophobicContact CG-CD1 4.45Å; E183-I187 WeakPolarHBondContact O-CG1 3.34Å; E183-I187 PolarHBondContact O-N 3.42Å; T185-I187 PolarHBondContact O-N 3.31Å; I187-M189 VanDerWaalsContact C-N 3.33Å; I187-M189 PolarHBondContact O-N 2.97Å; I187-Y190 PolarHBondContact O-N 3.4Å; I187-T191 HydrophobicContact CG2-CG2 4.49Å; I187-T191 WeakPolarHBondContact O-CG2 3.49Å; I187-T191 PolarHBondContact O-N 2.84Å; I187-T191 PolarHBondContact O-OG1 3.37Å
188A86.8Confident83.1Confident42 Ų4258.1 Ų58.135%0.34731%0.305SS..Hα-helixtrans-61.4-39.9175.700000112.2N184 T185 K186 T191 L192N184-A188 VanDerWaalsContact O-CB 3.25Å; N184-A188 WeakPolarHBondContact O-CB 3.39Å; N184-A188 PolarHBondContact O-N 3.41Å; T185-A188 CarbonylContact O-C 3.59Å; T185-A188 WeakPolarHBondContact O-CB 3.39Å; T185-A188 PolarHBondContact O-N 2.94Å; K186-A188 VanDerWaalsContact C-N 3.34Å; K186-A188 PolarHBondContact O-N 3.23Å; A188-T191 WeakPolarHBondContact CA-OG1 3.34Å; A188-T191 PolarHBondContact O-OG1 2.94Å; A188-L192 WeakPolarHBondContact O-CB 3.34Å; A188-L192 VanDerWaalsContact O-CG 3.22Å; A188-L192 WeakPolarHBondContact O-CG 3.49Å; A188-L192 PolarHBondContact O-N 2.98Å
189M85.5Confident84.5Confident30 Ų3054.1 Ų54.115%0.14829%0.289CS..Hα-helixtrans-68.1-42.7178-66.6-55.6154.100112.1F90 I93 T185 K186 I187 L192 H193F90-M189 HydrophobicContact CD1-CE 4.45Å; F90-M189 HydrophobicContact CD1-SD 3.35Å; F90-M189 WeakPolarHBondContact CD1-SD 3.44Å; F90-M189 HydrophobicContact CE1-SD 3.84Å; F90-M189 HydrophobicContact CG-SD 4.23Å; I93-M189 HydrophobicContact CG2-CE 4.31Å; I93-M189 HydrophobicContact CG2-CG 4.33Å; I93-M189 HydrophobicContact CG2-SD 4.4Å; T185-M189 HydrophobicContact CG2-CE 3.78Å; T185-M189 HydrophobicContact CG2-CG 4.26Å; T185-M189 VanDerWaalsContact O-CG 3.23Å; T185-M189 WeakPolarHBondContact O-CG 3.27Å; T185-M189 PolarHBondContact O-N 2.68Å; K186-M189 PolarHBondContact O-N 3.48Å; I187-M189 VanDerWaalsContact C-N 3.33Å; I187-M189 PolarHBondContact O-N 2.97Å; M189-L192 PolarHBondContact O-N 3.48Å; M189-L192 HydrophobicContact SD-CD1 4.3Å; M189-H193 PolarHBondContact O-CD2 2.96Å; M189-H193 PolarHBondContact O-N 2.86Å
190Y85.3Confident85.5Confident3 Ų349.5 Ų49.51%0.01226%0.264CS..Hα-helixtrans-64.8-40.2176.3-66.5-22.4000112.4D98 Y102 L156 Q160 K186 I187 H193 M194D98-Y190 PolarHBondContact OD2-OH 3.16Å; Y102-Y190 HydrophobicContact CE2-CE1 4.5Å; L156-Y190 HydrophobicContact CB-CE2 4.34Å; Q160-Y190 HydrophobicContact CG-CD2 4.26Å; Q160-Y190 HydrophobicContact CG-CE2 3.81Å; K186-Y190 HydrophobicContact CD-CE2 4.3Å; K186-Y190 WeakPolarHBondContact CE-OH 3.33Å; K186-Y190 HydrophobicContact CG-CD2 4.28Å; K186-Y190 HydrophobicContact CG-CE2 3.76Å; K186-Y190 PolarHBondContact O-N 3Å; I187-Y190 PolarHBondContact O-N 3.4Å; Y190-H193 PolarHBondContact O-N 3.24Å; Y190-M194 VanDerWaalsContact O-CG 3.27Å; Y190-M194 WeakPolarHBondContact O-CG 3.41Å; Y190-M194 PolarHBondContact O-N 3.45Å
191T88.9Confident86.6Confident62 Ų6244 Ų4438%0.3825%0.247SC..Hα-helixtrans-65.5-39.4175.151.10000111.9L157 I187 A188 M194 V195L157-T191 HydrophobicContact CD1-CG2 4.47Å; I187-T191 HydrophobicContact CG2-CG2 4.49Å; I187-T191 WeakPolarHBondContact O-CG2 3.49Å; I187-T191 PolarHBondContact O-N 2.84Å; I187-T191 PolarHBondContact O-OG1 3.37Å; A188-T191 WeakPolarHBondContact CA-OG1 3.34Å; A188-T191 PolarHBondContact O-OG1 2.94Å; T191-M194 WeakPolarHBondContact O-CB 3.46Å; T191-M194 PolarHBondContact O-N 3.42Å; T191-V195 WeakPolarHBondContact O-CG2 2.97Å; T191-V195 PolarHBondContact O-N 2.97Å
192L88.2Confident87.4Confident63 Ų6344.4 Ų44.433%0.3325%0.249SC..Hα-helixtrans-62.8-43.4172.4-72.8167.2000111.8F90 A188 M189 M194 V195 F196F90-L192 HydrophobicContact CE1-CD1 3.93Å; F90-L192 HydrophobicContact CE2-CB 4.38Å; F90-L192 HydrophobicContact CZ-CD1 3.92Å; A188-L192 WeakPolarHBondContact O-CB 3.34Å; A188-L192 VanDerWaalsContact O-CG 3.22Å; A188-L192 WeakPolarHBondContact O-CG 3.49Å; A188-L192 PolarHBondContact O-N 2.98Å; M189-L192 PolarHBondContact O-N 3.48Å; M189-L192 HydrophobicContact SD-CD1 4.3Å; L192-M194 VanDerWaalsContact C-N 3.28Å; L192-M194 PolarHBondContact O-N 2.92Å; L192-V195 PolarHBondContact O-N 3.26Å; L192-F196 HydrophobicContact CB-CD2 4.27Å; L192-F196 HydrophobicContact CB-CE2 4.25Å; L192-F196 HydrophobicContact CD2-CE2 3.97Å; L192-F196 WeakPolarHBondContact O-CD2 3.34Å; L192-F196 PolarHBondContact O-N 3.29Å
193H88.6Confident88.1Confident1 Ų143.3 Ų43.31%0.00525%0.245CC..Hα-helixtrans-60.3-37.5174.1-92.8-112.4000112.6I87 F90 G91 Y102 S105 T153 M189 Y190 V195 F196 T197I87-H193 PolarHBondContact O-CE1 2.92Å; F90-H193 VanDerWaalsContact CB-CD2 3.41Å; F90-H193 WeakPolarHBondContact CB-CD2 3.46Å; F90-H193 WeakPolarHBondContact CB-NE2 2.92Å; G91-H193 PolarHBondContact N-NE2 2.94Å; Y102-H193 AromaticContact CE1-CE1 3.74Å; Y102-H193 AromaticContact CZ-CE1 3.85Å; Y102-H193 AromaticContact CZ-ND1 3.87Å; Y102-H193 PolarHBondContact OH-CE1 2.95Å; Y102-H193 PolarHBondContact OH-ND1 3.42Å; S105-H193 PolarHBondContact OG-CE1 3.23Å; T153-H193 HydrophobicContact CG2-CB 3.77Å; M189-H193 PolarHBondContact O-CD2 2.96Å; M189-H193 PolarHBondContact O-N 2.86Å; Y190-H193 PolarHBondContact O-N 3.24Å; H193-V195 PolarHBondContact O-N 2.85Å; H193-F196 PolarHBondContact O-N 3.43Å; H193-T197 WeakPolarHBondContact O-CB 3.29Å; H193-T197 PolarHBondContact O-N 3.13Å; H193-T197 PolarHBondContact O-OG1 3.48Å
194M88.7Confident88.8Confident47 Ų4739.7 Ų39.723%0.23223%0.229CC..Hα-helixtrans-65.4-20.8175.5-72.3-75.7-103.500112.9F150 T153 A154 L157 Y190 T191 L192 P198F150-M194 HydrophobicContact CD2-SD 3.87Å; F150-M194 HydrophobicContact CE2-CE 4.32Å; F150-M194 HydrophobicContact CE2-SD 3.59Å; F150-M194 VanDerWaalsContact CE2-SD 3.59Å; F150-M194 HydrophobicContact CZ-CE 4.39Å; F150-M194 HydrophobicContact CZ-SD 4.2Å; T153-M194 HydrophobicContact CG2-CG 3.82Å; T153-M194 HydrophobicContact CG2-SD 4.09Å; A154-M194 VanDerWaalsContact CA-CE 3.5Å; A154-M194 HydrophobicContact CB-CE 3.53Å; A154-M194 HydrophobicContact CB-SD 4.03Å; L157-M194 HydrophobicContact CD2-CE 4.2Å; L157-M194 HydrophobicContact CD2-CG 4.47Å; Y190-M194 VanDerWaalsContact O-CG 3.27Å; Y190-M194 WeakPolarHBondContact O-CG 3.41Å; Y190-M194 PolarHBondContact O-N 3.45Å; T191-M194 WeakPolarHBondContact O-CB 3.46Å; T191-M194 PolarHBondContact O-N 3.42Å; L192-M194 VanDerWaalsContact C-N 3.28Å; L192-M194 PolarHBondContact O-N 2.92Å; M194-P198 WeakPolarHBondContact O-CD 3.49Å; M194-P198 WeakPolarHBondContact O-CG 3.33Å
195V92.9Very high89.4Confident95 Ų9539.4 Ų39.458%0.57623%0.227SC*.Hα-helixtrans-90.7-46.3174.6176.80000111.6T191 L192 H193 P198 A199T191-V195 WeakPolarHBondContact O-CG2 2.97Å; T191-V195 PolarHBondContact O-N 2.97Å; L192-V195 PolarHBondContact O-N 3.26Å; H193-V195 PolarHBondContact O-N 2.85Å; V195-P198 WeakPolarHBondContact O-CD 3.33Å; V195-P198 WeakPolarHBondContact O-CG 3.47Å; V195-A199 PolarHBondContact O-N 2.85Å
196F92.1Very high89.8Confident44 Ų4440.7 Ų40.719%0.19323%0.234CC..Hα-helixtrans-75.2-32.2-175.4-70.7-62.6000113.8L83 I87 F90 L192 H193 A199 H200L83-F196 HydrophobicContact CD2-CD1 3.77Å; L83-F196 HydrophobicContact CD2-CE1 4.44Å; I87-F196 HydrophobicContact CG1-CB 4.06Å; F90-F196 HydrophobicContact CD2-CD2 4.21Å; F90-F196 HydrophobicContact CD2-CE2 4.46Å; F90-F196 AromaticContact CE2-CD2 3.65Å; F90-F196 HydrophobicContact CE2-CD2 3.65Å; F90-F196 AromaticContact CE2-CE2 3.48Å; F90-F196 HydrophobicContact CE2-CE2 3.48Å; F90-F196 VanDerWaalsContact CE2-CE2 3.48Å; F90-F196 HydrophobicContact CE2-CZ 4.47Å; F90-F196 HydrophobicContact CZ-CE2 4.1Å; L192-F196 HydrophobicContact CB-CD2 4.27Å; L192-F196 HydrophobicContact CB-CE2 4.25Å; L192-F196 HydrophobicContact CD2-CE2 3.97Å; L192-F196 WeakPolarHBondContact O-CD2 3.34Å; L192-F196 PolarHBondContact O-N 3.29Å; H193-F196 PolarHBondContact O-N 3.43Å; F196-A199 PolarHBondContact O-N 3.27Å; F196-H200 WeakPolarHBondContact O-CB 3.41Å; F196-H200 PolarHBondContact O-N 2.83Å
197T90.3Very high90.2Very high0 Ų038.9 Ų38.90%023%0.226CC..Hα-helixtrans-62-50.2177.9-53.50000112.7S146 L149 F150 H193 A199 H200 A201S146-T197 WeakPolarHBondContact O-CG2 3.25Å; S146-T197 PolarHBondContact OG-O 2.87Å; S146-T197 VanDerWaalsContact OG-O 3.06Å; L149-T197 HydrophobicContact CB-CG2 4.14Å; L149-T197 HydrophobicContact CD2-CG2 4.06Å; L149-T197 HydrophobicContact CG-CG2 4.19Å; F150-T197 HydrophobicContact CB-CG2 3.9Å; H193-T197 WeakPolarHBondContact O-CB 3.29Å; H193-T197 PolarHBondContact O-N 3.13Å; H193-T197 PolarHBondContact O-OG1 3.48Å; T197-A199 VanDerWaalsContact C-N 3.34Å; T197-H200 PolarHBondContact O-N 2.97Å; T197-A201 PolarHBondContact O-N 3.02Å
198P92.7Very high90.5Very high46 Ų4638.1 Ų38.130%0.29923%0.225SC..Hα-helixtrans-68-32.4175.124.8-32.6000112.7M194 V195 H200 A201 I202M194-P198 WeakPolarHBondContact O-CD 3.49Å; M194-P198 WeakPolarHBondContact O-CG 3.33Å; V195-P198 WeakPolarHBondContact O-CD 3.33Å; V195-P198 WeakPolarHBondContact O-CG 3.47Å; P198-H200 VanDerWaalsContact C-N 3.31Å; P198-H200 PolarHBondContact O-N 3.49Å; P198-A201 WeakPolarHBondContact O-CB 3.17Å; P198-A201 PolarHBondContact O-N 3.29Å; P198-I202 WeakPolarHBondContact O-CG1 3.48Å; P198-I202 PolarHBondContact O-N 3.47Å
199A93.1Very high90.6Very high33 Ų3340 Ų4027%0.27323%0.228SC..Hα-helixtrans-59-44.4172.400000111.3L83 V195 F196 T197 I202 C203L83-A199 HydrophobicContact CD1-CB 4.29Å; L83-A199 HydrophobicContact CD2-CB 4.14Å; V195-A199 PolarHBondContact O-N 2.85Å; F196-A199 PolarHBondContact O-N 3.27Å; T197-A199 VanDerWaalsContact C-N 3.34Å; A199-I202 PolarHBondContact O-N 3.23Å; A199-C203 PolarHBondContact O-N 3.41Å; A199-C203 VanDerWaalsContact O-N 3.1Å; A199-C203 PolarHBondContact O-SG 3.44Å; A199-C203 VanDerWaalsContact O-SG 3.41Å
200H92.9Very high90.6Very high0 Ų040.3 Ų40.30%023%0.231CC..Hα-helixtrans-62.3-43174.3-174.7-90.6000111.6L83 I87 F112 S142 F196 T197 P198 I202 C203 T204L83-H200 HydrophobicContact CB-CB 4.24Å; L83-H200 HydrophobicContact CD1-CB 4.37Å; I87-H200 HydrophobicContact CD1-CB 4.04Å; F112-H200 AromaticContact CD1-CE1 3.59Å; F112-H200 AromaticContact CD2-CE1 4Å; F112-H200 AromaticContact CG-CE1 3.54Å; F112-H200 AromaticContact CG-NE2 3.9Å; S142-H200 PolarHBondContact OG-CE1 2.76Å; F196-H200 WeakPolarHBondContact O-CB 3.41Å; F196-H200 PolarHBondContact O-N 2.83Å; T197-H200 PolarHBondContact O-N 2.97Å; P198-H200 VanDerWaalsContact C-N 3.31Å; P198-H200 PolarHBondContact O-N 3.49Å; H200-I202 VanDerWaalsContact C-N 3.35Å; H200-I202 PolarHBondContact O-N 3.37Å; H200-C203 PolarHBondContact O-N 2.91Å; H200-T204 WeakPolarHBondContact O-CG2 3.44Å; H200-T204 PolarHBondContact O-N 3.39Å; H200-T204 PolarHBondContact O-OG1 3.26Å
201A92.7Very high90.6Very high16 Ų1640.4 Ų40.413%0.13223%0.232CC..Hα-helixtrans-59.7-40.8175.700000113T197 P198 T204 I205T197-A201 PolarHBondContact O-N 3.02Å; P198-A201 WeakPolarHBondContact O-CB 3.17Å; P198-A201 PolarHBondContact O-N 3.29Å; A201-T204 WeakPolarHBondContact CA-OG1 3.23Å; A201-T204 PolarHBondContact O-N 3.47Å; A201-T204 PolarHBondContact O-OG1 3.41Å; A201-I205 VanDerWaalsContact O-CG1 3.26Å; A201-I205 WeakPolarHBondContact O-CG1 3.04Å; A201-I205 PolarHBondContact O-N 3.02Å
202I94.1Very high90.3Very high108 Ų10843.5 Ų43.555%0.55424%0.24SC*.Hα-helixtrans-64.1-43.8176.3-66.8163.5000110.1P198 A199 H200 T204 I205 V206P198-I202 WeakPolarHBondContact O-CG1 3.48Å; P198-I202 PolarHBondContact O-N 3.47Å; A199-I202 PolarHBondContact O-N 3.23Å; H200-I202 VanDerWaalsContact C-N 3.35Å; H200-I202 PolarHBondContact O-N 3.37Å; I202-T204 VanDerWaalsContact C-N 3.33Å; I202-T204 PolarHBondContact O-N 3.49Å; I202-I205 PolarHBondContact O-N 3.4Å; I202-V206 WeakPolarHBondContact O-CG2 3.38Å; I202-V206 PolarHBondContact O-N 3.37Å
203C92.7Very high89.9Confident28 Ų2847.2 Ų47.219%0.18925%0.251CS..Hα-helixtrans-63-36.8175.9-67.30000112.7C76 Q80 L83 A199 H200 V206 S207C76-C203 PolarHBondContact SG-O 2.89Å; C76-C203 VanDerWaalsContact SG-O 3.38Å; Q80-C203 HydrophobicContact CG-CB 3.71Å; Q80-C203 PolarHBondContact NE2-O 3.22Å; L83-C203 HydrophobicContact CD1-CB 4.4Å; A199-C203 PolarHBondContact O-N 3.41Å; A199-C203 VanDerWaalsContact O-N 3.1Å; A199-C203 PolarHBondContact O-SG 3.44Å; A199-C203 VanDerWaalsContact O-SG 3.41Å; H200-C203 PolarHBondContact O-N 2.91Å; C203-V206 PolarHBondContact O-N 2.82Å; C203-S207 PolarHBondContact O-N 3.49Å; C203-S207 PolarHBondContact O-OG 3.48Å
204T91.9Very high89.3Confident1 Ų148.5 Ų48.51%0.00626%0.258CS..Hα-helixtrans-70.1-35175.258.90000112.4Q80 H200 A201 I202 S207 S208Q80-T204 VanDerWaalsContact NE2-CA 3.32Å; H200-T204 WeakPolarHBondContact O-CG2 3.44Å; H200-T204 PolarHBondContact O-N 3.39Å; H200-T204 PolarHBondContact O-OG1 3.26Å; A201-T204 WeakPolarHBondContact CA-OG1 3.23Å; A201-T204 PolarHBondContact O-N 3.47Å; A201-T204 PolarHBondContact O-OG1 3.41Å; I202-T204 VanDerWaalsContact C-N 3.33Å; I202-T204 PolarHBondContact O-N 3.49Å; T204-S207 PolarHBondContact O-N 2.77Å; T204-S208 VanDerWaalsContact O-CB 3.24Å; T204-S208 WeakPolarHBondContact O-CB 3.36Å; T204-S208 PolarHBondContact O-N 3.21Å
205I93.3Very high88.5Confident78 Ų7849.9 Ų49.940%0.427%0.266SS..Hα-helixtrans-61.5-48.8171.7-68.4164.7000110.6L143 A201 I202 S207 S208 I209L143-I205 HydrophobicContact CD1-CD1 4.32Å; L143-I205 HydrophobicContact CD1-CG1 3.48Å; L143-I205 VanDerWaalsContact CD1-CG1 3.48Å; A201-I205 VanDerWaalsContact O-CG1 3.26Å; A201-I205 WeakPolarHBondContact O-CG1 3.04Å; A201-I205 PolarHBondContact O-N 3.02Å; I202-I205 PolarHBondContact O-N 3.4Å; I205-S207 PolarHBondContact O-N 3.23Å; I205-S208 WeakPolarHBondContact O-CB 3.42Å; I205-S208 PolarHBondContact O-N 3.48Å; I205-S208 VanDerWaalsContact O-N 3.15Å; I205-I209 HydrophobicContact CG2-CD1 3.78Å; I205-I209 HydrophobicContact CG2-CG1 4.4Å; I205-I209 VanDerWaalsContact O-CG1 3.31Å; I205-I209 WeakPolarHBondContact O-CG1 3.38Å; I205-I209 PolarHBondContact O-N 3.4Å
206V91.8Very high87.4Confident70 Ų7048.5 Ų48.542%0.42426%0.258SS..Hα-helixtrans-60.6-45.5178.6174.40000111I202 C203 S208 I209 L210I202-V206 WeakPolarHBondContact O-CG2 3.38Å; I202-V206 PolarHBondContact O-N 3.37Å; C203-V206 PolarHBondContact O-N 2.82Å; V206-S208 VanDerWaalsContact C-N 3.33Å; V206-S208 PolarHBondContact O-N 3.09Å; V206-I209 PolarHBondContact O-N 3.45Å; V206-L210 HydrophobicContact CG1-CD1 4.32Å; V206-L210 WeakPolarHBondContact O-CG 3.22Å; V206-L210 PolarHBondContact O-N 2.9Å
207S89.6Confident85.8Confident2 Ų248.8 Ų48.81%0.01426%0.263CS..Hα-helixtrans-60.7-41.5174.1-81.90000112.6C76 Q80 C203 T204 I205 L210 C211C76-S207 PolarHBondContact SG-OG 3.18Å; Q80-S207 VanDerWaalsContact NE2-CB 3.29Å; Q80-S207 PolarHBondContact NE2-OG 3.16Å; C203-S207 PolarHBondContact O-N 3.49Å; C203-S207 PolarHBondContact O-OG 3.48Å; T204-S207 PolarHBondContact O-N 2.77Å; I205-S207 PolarHBondContact O-N 3.23Å; S207-L210 PolarHBondContact O-N 2.81Å; S207-C211 WeakPolarHBondContact O-CB 3.45Å; S207-C211 PolarHBondContact O-N 3.38Å; S207-C211 PolarHBondContact O-SG 3.03Å
208S89.3Confident83.8Confident31 Ų3152.9 Ų52.922%0.21729%0.29CS..Hα-helixtrans-63.8-42.7178.1-172.50000111.7T204 I205 V206 C211 F212T204-S208 VanDerWaalsContact O-CB 3.24Å; T204-S208 WeakPolarHBondContact O-CB 3.36Å; T204-S208 PolarHBondContact O-N 3.21Å; I205-S208 WeakPolarHBondContact O-CB 3.42Å; I205-S208 PolarHBondContact O-N 3.48Å; I205-S208 VanDerWaalsContact O-N 3.15Å; V206-S208 VanDerWaalsContact C-N 3.33Å; V206-S208 PolarHBondContact O-N 3.09Å; S208-C211 WeakPolarHBondContact O-CB 3.48Å; S208-C211 PolarHBondContact O-N 3.37Å; S208-F212 WeakPolarHBondContact O-CB 3.42Å; S208-F212 PolarHBondContact O-N 2.75Å
209I88.9Confident81.7Confident81 Ų8155.5 Ų55.542%0.41530%0.298SS..Hα-helixtrans-60.8-46.4174.5-69.9167.9000110.4I205 V206 C211 F212 Y213I205-I209 HydrophobicContact CG2-CD1 3.78Å; I205-I209 HydrophobicContact CG2-CG1 4.4Å; I205-I209 VanDerWaalsContact O-CG1 3.31Å; I205-I209 WeakPolarHBondContact O-CG1 3.38Å; I205-I209 PolarHBondContact O-N 3.4Å; V206-I209 PolarHBondContact O-N 3.45Å; I209-C211 PolarHBondContact O-N 3.39Å; I209-F212 PolarHBondContact O-N 2.92Å; I209-Y213 HydrophobicContact CG2-CD2 3.57Å; I209-Y213 HydrophobicContact CG2-CE2 3.34Å; I209-Y213 WeakPolarHBondContact O-CD2 3.39Å; I209-Y213 PolarHBondContact O-N 3.47Å
210L85.2Confident79.2Confident38 Ų3861.6 Ų61.620%0.19932%0.321CS..Hα-helixtrans-59.7-45.6175.5-70.8172.4000111.2V73 V206 S207 F212 Y213 N214V73-L210 HydrophobicContact CG2-CB 4.44Å; V73-L210 HydrophobicContact CG2-CD1 4.32Å; V206-L210 HydrophobicContact CG1-CD1 4.32Å; V206-L210 WeakPolarHBondContact O-CG 3.22Å; V206-L210 PolarHBondContact O-N 2.9Å; S207-L210 PolarHBondContact O-N 2.81Å; L210-F212 VanDerWaalsContact C-N 3.34Å; L210-F212 PolarHBondContact O-N 3.32Å; L210-Y213 PolarHBondContact O-N 3.48Å; L210-N214 PolarHBondContact O-N 3.04Å; L210-N214 PolarHBondContact O-ND2 3.22Å
211C84.1Confident76.5Confident4 Ų468.5 Ų68.53%0.02735%0.353CS..Hα-helixtrans-59.6-44175-71.70000111.8Y135 S207 S208 I209 N214 L215Y135-C211 WeakPolarHBondContact CD1-SG 3.22Å; Y135-C211 WeakPolarHBondContact CE1-SG 3.45Å; S207-C211 WeakPolarHBondContact O-CB 3.45Å; S207-C211 PolarHBondContact O-N 3.38Å; S207-C211 PolarHBondContact O-SG 3.03Å; S208-C211 WeakPolarHBondContact O-CB 3.48Å; S208-C211 PolarHBondContact O-N 3.37Å; I209-C211 PolarHBondContact O-N 3.39Å; C211-N214 CarbonylContact O-C 3.57Å; C211-N214 PolarHBondContact O-N 2.94Å; C211-L215 WeakPolarHBondContact O-CG 3.23Å; C211-L215 PolarHBondContact O-N 2.96Å
212F83.1Confident74Confident127 Ų12772.5 Ų72.556%0.55737%0.371SS*.Hα-helixtrans-63.4-43.9178.8-172.7-98.8000111.6S208 I209 L210 N214 L215 T216S208-F212 WeakPolarHBondContact O-CB 3.42Å; S208-F212 PolarHBondContact O-N 2.75Å; I209-F212 PolarHBondContact O-N 2.92Å; L210-F212 VanDerWaalsContact C-N 3.34Å; L210-F212 PolarHBondContact O-N 3.32Å; F212-N214 VanDerWaalsContact C-N 3.28Å; F212-N214 PolarHBondContact O-N 2.63Å; F212-L215 PolarHBondContact O-N 3.41Å; F212-T216 HydrophobicContact CD1-CG2 3.89Å; F212-T216 HydrophobicContact CD2-CG2 3.85Å; F212-T216 HydrophobicContact CE1-CG2 3.48Å; F212-T216 VanDerWaalsContact CE1-CG2 3.48Å; F212-T216 HydrophobicContact CE2-CG2 3.44Å; F212-T216 VanDerWaalsContact CE2-CG2 3.44Å; F212-T216 HydrophobicContact CG-CG2 4.08Å; F212-T216 HydrophobicContact CZ-CG2 3.26Å; F212-T216 WeakPolarHBondContact O-CB 3.28Å; F212-T216 PolarHBondContact O-N 3.27Å; F212-T216 PolarHBondContact O-OG1 3Å
213Y80.8Confident71.6Confident141 Ų14174.9 Ų74.955%0.55338%0.38SS*.Hα-helixtrans-60.6-37.4173.9-82.3-64.1000112.5I209 L210 L215 T217I209-Y213 HydrophobicContact CG2-CD2 3.57Å; I209-Y213 HydrophobicContact CG2-CE2 3.34Å; I209-Y213 WeakPolarHBondContact O-CD2 3.39Å; I209-Y213 PolarHBondContact O-N 3.47Å; L210-Y213 PolarHBondContact O-N 3.48Å; Y213-L215 VanDerWaalsContact C-N 3.31Å; Y213-T217 WeakPolarHBondContact O-CB 3.44Å; Y213-T217 PolarHBondContact O-N 2.91Å; Y213-T217 PolarHBondContact O-OG1 2.93Å
214N74.3Confident68.9Low29 Ų2982 Ų8216%0.15540%0.403CS..Hα-helixtrans-71.8-23.2175-74.4-79.7000112.9R68 L132 L210 C211 F212R68-N214 PolarHBondContact N-OD1 3.4Å; L132-N214 HydrophobicContact CD2-CB 4.33Å; L210-N214 PolarHBondContact O-N 3.04Å; L210-N214 PolarHBondContact O-ND2 3.22Å; C211-N214 CarbonylContact O-C 3.57Å; C211-N214 PolarHBondContact O-N 2.94Å; F212-N214 VanDerWaalsContact C-N 3.28Å; F212-N214 PolarHBondContact O-N 2.63Å
215L73.4Confident66.6Low75 Ų7584 Ų8439%0.39342%0.423SS..Hα-helixtrans-89.9-38.3178.4-73.9169.6000113.3L132 V133 A136 C211 F212 Y213L132-L215 HydrophobicContact CD2-CD2 3.55Å; L132-L215 HydrophobicContact CD2-CG 3.9Å; L132-L215 HydrophobicContact CG-CD2 4.06Å; L132-L215 HydrophobicContact CG-CG 4.33Å; V133-L215 HydrophobicContact CG2-CD2 4.42Å; A136-L215 HydrophobicContact CB-CD1 4.17Å; C211-L215 WeakPolarHBondContact O-CG 3.23Å; C211-L215 PolarHBondContact O-N 2.96Å; F212-L215 PolarHBondContact O-N 3.41Å; Y213-L215 VanDerWaalsContact C-N 3.31Å
216T70.3Confident64Low67 Ų6786.8 Ų86.841%0.41143%0.43SS..Hα-helixtrans-93.8-20.1-172.755.20000114.3F212 P218F212-T216 HydrophobicContact CD1-CG2 3.89Å; F212-T216 HydrophobicContact CD2-CG2 3.85Å; F212-T216 HydrophobicContact CE1-CG2 3.48Å; F212-T216 VanDerWaalsContact CE1-CG2 3.48Å; F212-T216 HydrophobicContact CE2-CG2 3.44Å; F212-T216 VanDerWaalsContact CE2-CG2 3.44Å; F212-T216 HydrophobicContact CG-CG2 4.08Å; F212-T216 HydrophobicContact CZ-CG2 3.26Å; F212-T216 WeakPolarHBondContact O-CB 3.28Å; F212-T216 PolarHBondContact O-N 3.27Å; F212-T216 PolarHBondContact O-OG1 3Å; T216-P218 WeakPolarHBondContact O-CD 2.92Å
217T57.5Low61.7Low50 Ų5088.2 Ų88.231%0.30743%0.428SS..SBendtrans-74.2114176.4-45.80000108.8R68 Y213R68-T217 PolarHBondContact NH1-OG1 2.64Å; Y213-T217 WeakPolarHBondContact O-CB 3.44Å; Y213-T217 PolarHBondContact O-N 2.91Å; Y213-T217 PolarHBondContact O-OG1 2.93Å
218P47.5Very low59.3Low86 Ų8691.9 Ų91.956%0.55845%0.451SS*.  trans-59.7150.3173.526.1-33.8000109.9T216 E220T216-P218 WeakPolarHBondContact O-CD 2.92Å; P218-E220 PolarHBondContact O-N 3.3Å
219Q49.8Very low57.1Low100 Ų10092.7 Ų92.747%0.46746%0.456SS..THydrogen-bonded Turntrans-59.724.8-172.1-155.2161.287.700115.9T246Q219-T246 PolarHBondContact NE2-O 2.92Å
220E40.1Very low54.7Low161 Ų16198.5 Ų98.575%0.75247%0.473SS*.THydrogen-bonded Turntrans-102.2-6.2-163.2-68.6-172.6160.800114.8P218 L222P218-E220 PolarHBondContact O-N 3.3Å; E220-L222 PolarHBondContact O-N 3.05Å
221E37.3Very low52.8Low145 Ų14599.7 Ų99.768%0.67848%0.482SS*.SBendtrans-85.472.1163.9-77.7179.8169.600110.1R68 H223R68-E221 IonicContact CZ-OE2 2.63Å; R68-E221 IonicContact NE-OE2 3.22Å; R68-E221 IonicContact NH2-OE2 3.64Å; R68-E221 PolarHBondContact NH2-OE2 3.49Å; E221-H223 VanDerWaalsContact C-N 3.35Å; E221-H223 PolarHBondContact O-N 3.04Å
222L40Very low51.1Low100 Ų100104.1 Ų104.152%0.52452%0.519SS..  trans-29.786.3159.6-13378.9000112.2E220 R224 N243E220-L222 PolarHBondContact O-N 3.05Å; L222-R224 VanDerWaalsContact C-N 3.28Å; L222-R224 PolarHBondContact O-N 3.23Å; L222-N243 HydrophobicContact CD1-CB 4.35Å; L222-N243 VanDerWaalsContact CD1-OD1 3.28Å; L222-N243 WeakPolarHBondContact CD1-OD1 3.22Å; L222-N243 WeakPolarHBondContact CD2-OD1 3.32Å; L222-N243 WeakPolarHBondContact CG-OD1 3.48Å
223H42.3Very low49.2Very low159 Ų159106.9 Ų106.974%0.73653%0.533SS*.  trans-68.997.1163.1-97.6-39.8000106.8E221 G225E221-H223 VanDerWaalsContact C-N 3.35Å; E221-H223 PolarHBondContact O-N 3.04Å; H223-G225 PolarHBondContact O-N 3.15Å
224R37.6Very low47.3Very low178 Ų178102.1 Ų102.167%0.67253%0.527SS*.  trans-52.288.5164.5-90.4-179.9170.5166.9-2.5108.5L222L222-R224 VanDerWaalsContact C-N 3.28Å; L222-R224 PolarHBondContact O-N 3.23Å
225G41.7Very low45.8Very low42 Ų42110.6 Ų110.643%0.43357%0.565SS.*EExtended strand (participates in β ladder)trans-81.7131.4159.200000107.6H223 M242H223-G225 PolarHBondContact O-N 3.15Å; G225-M242 PolarHBondContact O-N 3.09Å
226Y39.9Very low44.2Very low137 Ų137113.7 Ų113.754%0.53758%0.577SS.*EExtended strand (participates in β ladder)trans-92.5126167.2-61.6-87.9000108.5L239Y226-L239 HydrophobicContact CD1-CB 3.8Å; Y226-L239 HydrophobicContact CD1-CD2 4.13Å; Y226-L239 HydrophobicContact CG-CB 4.32Å; Y226-L239 HydrophobicContact CG-CD2 3.78Å
227Y42.3Very low43.1Very low99 Ų99114.3 Ų114.339%0.38858%0.581SS.*EExtended strand (participates in β ladder)trans-87.5136167.7-155.5-87.3000109.4V22 S229 V238 L239 L240V22-Y227 PolarHBondContact O-OH 3.15Å; Y227-S229 PolarHBondContact O-N 3.36Å; Y227-V238 VanDerWaalsContact O-O 3.07Å; Y227-L239 WeakPolarHBondContact O-CA 3.41Å; Y227-L240 PolarHBondContact N-O 2.95Å; Y227-L240 PolarHBondContact O-N 3.18Å
228V39.7Very low42.5Very low80 Ų80114.9 Ų114.949%0.48559%0.585SS.*EExtended strand (participates in β ladder)trans-88.897.2169.3177.10000107.5T237 L239V228-T237 HydrophobicContact CG1-CG2 3.5Å; V228-T237 VanDerWaalsContact CG1-CG2 3.5Å; V228-L239 HydrophobicContact CG2-CD2 4.37Å
229S42.8Very low42.4Very low48 Ų48115.8 Ų115.834%0.33658%0.584SS.*EExtended strand (participates in β ladder)trans-84.3121170.1175.10000108.9Y227 T237 V238Y227-S229 PolarHBondContact O-N 3.36Å; S229-T237 WeakPolarHBondContact O-CA 3.19Å; S229-V238 PolarHBondContact N-O 3.27Å; S229-V238 PolarHBondContact O-N 3.46Å
230R39.8Very low42.2Very low202 Ų202115.5 Ų115.576%0.76259%0.585SS**EExtended strand (participates in β ladder)trans-89.7123.8161.7-76.3-173.5-177.6179.23.6107.8T237R230-T237 HydrophobicContact CG-CG2 4.15Å
231T44.5Very low42.4Very low64 Ų64112 Ų11239%0.39358%0.577SS.*PPolyproline II helixtrans-69.8140.5172.652.40000109.5H233 G234T231-H233 PolarHBondContact O-N 2.86Å; T231-G234 PolarHBondContact O-N 2.78Å; T231-G234 WeakPolarHBondContact OG1-CA 3.39Å; T231-G234 PolarHBondContact OG1-N 3.14Å; T231-G234 PolarHBondContact OG1-O 2.81Å
232A49.5Very low43.1Very low97 Ų97106.4 Ų106.480%0.80255%0.551SS**THydrogen-bonded Turntrans-58.2-17.6179.200000113.4
233H41.7Very low43.2Very low185 Ų185103.4 Ų103.486%0.85654%0.535SS*.THydrogen-bonded Turntrans-137.571.9176.3-63.581.4000108.8T231T231-H233 PolarHBondContact O-N 2.86Å
234G41.2Very low43.4Very low40 Ų4098.8 Ų98.841%0.41252%0.518SS..  trans163.4137.5172.900000114.3T231 Q236T231-G234 PolarHBondContact O-N 2.78Å; T231-G234 WeakPolarHBondContact OG1-CA 3.39Å; T231-G234 PolarHBondContact OG1-N 3.14Å; T231-G234 PolarHBondContact OG1-O 2.81Å; G234-Q236 PolarHBondContact O-N 2.94Å
235H43.7Very low43.8Very low207 Ų20796.6 Ų96.696%0.95851%0.51SS*.SBendtrans-70.112.5172.8-80.1-70.3000114T237H235-T237 PolarHBondContact O-N 3.48Å
236Q38.9Very low44.1Very low141 Ų14196.1 Ų96.166%0.65950%0.498SS*.  trans-91.1104.7-173.3-158.6169.811.500110.1G234 V238G234-Q236 PolarHBondContact O-N 2.94Å; Q236-V238 HydrophobicContact CG-CG2 4.15Å; Q236-V238 PolarHBondContact O-N 2.9Å
237T47.8Very low44.4Very low80 Ų8091.6 Ų91.649%0.49149%0.494SS..EExtended strand (participates in β ladder)trans-77.2107.116746.70000108.9V228 S229 R230 H235V228-T237 HydrophobicContact CG1-CG2 3.5Å; V228-T237 VanDerWaalsContact CG1-CG2 3.5Å; S229-T237 WeakPolarHBondContact O-CA 3.19Å; R230-T237 HydrophobicContact CG-CG2 4.15Å; H235-T237 PolarHBondContact O-N 3.48Å
238V45.5Very low44.4Very low62 Ų6288 Ų8838%0.37649%0.485SS..EExtended strand (participates in β ladder)trans-97.6122.9174.2-171.60000108.6Y227 S229 Q236 L240Y227-V238 VanDerWaalsContact O-O 3.07Å; S229-V238 PolarHBondContact N-O 3.27Å; S229-V238 PolarHBondContact O-N 3.46Å; Q236-V238 HydrophobicContact CG-CG2 4.15Å; Q236-V238 PolarHBondContact O-N 2.9Å; V238-L240 HydrophobicContact CB-CD1 3.87Å; V238-L240 HydrophobicContact CG1-CD1 3.57Å; V238-L240 HydrophobicContact CG1-CG 4.49Å; V238-L240 PolarHBondContact O-N 3.31Å
239L44.3Very low44.8Very low105 Ų10588.2 Ų88.255%0.5549%0.486SS..EExtended strand (participates in β ladder)trans-79.3102.2171.7-74.3145.9000108.1Y226 Y227 V228Y226-L239 HydrophobicContact CD1-CB 3.8Å; Y226-L239 HydrophobicContact CD1-CD2 4.13Å; Y226-L239 HydrophobicContact CG-CB 4.32Å; Y226-L239 HydrophobicContact CG-CD2 3.78Å; Y227-L239 WeakPolarHBondContact O-CA 3.41Å; V228-L239 HydrophobicContact CG2-CD2 4.37Å
240L46.6Very low45.2Very low93 Ų9390.2 Ų90.249%0.48750%0.5SS..EExtended strand (participates in β ladder)trans-93127.6173.4-82.786.4000109.9Y227 V238Y227-L240 PolarHBondContact N-O 2.95Å; Y227-L240 PolarHBondContact O-N 3.18Å; V238-L240 HydrophobicContact CB-CD1 3.87Å; V238-L240 HydrophobicContact CG1-CD1 3.57Å; V238-L240 HydrophobicContact CG1-CG 4.49Å; V238-L240 PolarHBondContact O-N 3.31Å
241P44.1Very low45.9Very low89 Ų8984 Ų8458%0.57849%0.487SS*.EExtended strand (participates in β ladder)trans-68.8133.4170.329.8-32.2000108.5
242M51Low46.6Very low26 Ų2685.5 Ų85.513%0.12849%0.49CS..EExtended strand (participates in β ladder)trans-124.3128.5-176.8-166.2167.2179.600111.9R58 I60 G225R58-M242 HydrophobicContact CB-CE 4.45Å; R58-M242 WeakPolarHBondContact O-CE 3.42Å; R58-M242 VanDerWaalsContact O-CG 3.28Å; R58-M242 WeakPolarHBondContact O-CG 3.42Å; I60-M242 HydrophobicContact CB-CE 3.4Å; I60-M242 HydrophobicContact CD1-CE 3.34Å; I60-M242 HydrophobicContact CD1-SD 3.79Å; I60-M242 HydrophobicContact CG1-CE 3.16Å; I60-M242 HydrophobicContact CG1-SD 4.28Å; G225-M242 PolarHBondContact O-N 3.09Å
243N42.7Very low46.9Very low37 Ų3783.3 Ų83.320%0.19847%0.467CS..  trans-90.7103.3170.4-79.2-7000109E57 S59 L222 R245E57-N243 HydrophobicContact CG-CB 4.03Å; E57-N243 PolarHBondContact OE1-ND2 2.81Å; S59-N243 VanDerWaalsContact CA-O 3.32Å; S59-N243 WeakPolarHBondContact CA-O 3.34Å; S59-N243 WeakPolarHBondContact CB-O 3.23Å; L222-N243 HydrophobicContact CD1-CB 4.35Å; L222-N243 VanDerWaalsContact CD1-OD1 3.28Å; L222-N243 WeakPolarHBondContact CD1-OD1 3.22Å; L222-N243 WeakPolarHBondContact CD2-OD1 3.32Å; L222-N243 WeakPolarHBondContact CG-OD1 3.48Å; N243-R245 PolarHBondContact O-N 2.9Å
244V47.3Very low47.7Very low63 Ų6381.2 Ų81.238%0.38246%0.457SS..  trans-83.6102.7173.4179.60000107.9T62T62-V244 WeakPolarHBondContact OG1-CG1 3.43Å
245R45Very low48.8Very low132 Ų13288.5 Ų88.550%0.49847%0.472SS..  trans-86.8133.9166.7-74.5-176.6170.8116.40.5109.1E57 M61 N243E57-R245 IonicContact OE2-CZ 3.45Å; E57-R245 IonicContact OE2-NH1 2.72Å; E57-R245 PolarHBondContact OE2-NH1 3.45Å; E57-R245 IonicContact OE2-NH2 3.52Å; M61-R245 VanDerWaalsContact CA-O 3.3Å; M61-R245 WeakPolarHBondContact CA-O 3.12Å; M61-R245 WeakPolarHBondContact CG-O 3.06Å; N243-R245 PolarHBondContact O-N 2.9Å
246T47.9Very low49.7Very low31 Ų3183.1 Ų83.119%0.1945%0.45CS..  trans-115.565.4-173.7-30.10000109.4T62 T64 Q219T62-T246 WeakPolarHBondContact O-CG2 3.49Å; T64-T246 WeakPolarHBondContact O-CG2 3.29Å; Q219-T246 PolarHBondContact NE2-O 2.92Å
247G47Very low51Low43 Ų4382.1 Ų82.144%0.44345%0.449SS..  trans-148.8-10.6-159.500000121
248A41Very low52Low24 Ų2480.9 Ų80.920%0.19845%0.447CS..  trans-87.1130.7-171.600000112.3M61 E252 T253M61-A248 HydrophobicContact CE-CB 3.37Å; M61-A248 HydrophobicContact SD-CB 3.44Å; M61-A248 WeakPolarHBondContact SD-CB 3.48Å; A248-E252 WeakPolarHBondContact CA-OE2 3.41Å; A248-E252 HydrophobicContact CB-CB 3.66Å; A248-T253 HydrophobicContact CB-CG2 4.34Å
249T48.2Very low53Low83 Ų8383.8 Ų83.851%0.50946%0.458SS..  trans-55.4148.8160.653.90000109.7S251 E252 T253T249-S251 PolarHBondContact O-N 3.02Å; T249-S251 PolarHBondContact OG1-OG 3.48Å; T249-E252 PolarHBondContact N-OE2 3.27Å; T249-E252 PolarHBondContact O-N 3.46Å; T249-E252 PolarHBondContact OG1-OE2 3.45Å; T249-E252 VanDerWaalsContact OG1-OE2 3.09Å; T249-T253 PolarHBondContact O-N 3Å; T249-T253 PolarHBondContact O-OG1 3.29Å
250S51.5Low53.9Low91 Ų9181.5 Ų81.564%0.63645%0.454SS*.Hα-helixtrans-45.6-35.8-177.4-169.50000113.6T253 E254S250-T253 WeakPolarHBondContact CA-OG1 3.47Å; S250-T253 PolarHBondContact O-OG1 3.03Å; S250-E254 PolarHBondContact O-N 2.97Å
251S55.4Low54.8Low70 Ų7082.8 Ų82.849%0.4946%0.457SS..Hα-helixtrans-67.9-30177.746.80000115.2T249 R255T249-S251 PolarHBondContact O-N 3.02Å; T249-S251 PolarHBondContact OG1-OG 3.48Å; S251-R255 WeakPolarHBondContact O-CB 3.25Å; S251-R255 WeakPolarHBondContact O-CG 3.4Å; S251-R255 PolarHBondContact O-N 3.37Å
252E58.5Low55.6Low96 Ų9685.1 Ų85.145%0.44946%0.46SS..Hα-helixtrans-79.3-36.2177.3-75.7172.5139.900111.3A248 T249 R255 L256A248-E252 WeakPolarHBondContact CA-OE2 3.41Å; A248-E252 HydrophobicContact CB-CB 3.66Å; T249-E252 PolarHBondContact N-OE2 3.27Å; T249-E252 PolarHBondContact O-N 3.46Å; T249-E252 PolarHBondContact OG1-OE2 3.45Å; T249-E252 VanDerWaalsContact OG1-OE2 3.09Å; E252-R255 PolarHBondContact O-N 3.14Å; E252-L256 WeakPolarHBondContact O-CB 3.43Å; E252-L256 VanDerWaalsContact O-CG 3.31Å; E252-L256 WeakPolarHBondContact O-CG 3.28Å; E252-L256 PolarHBondContact O-N 2.99Å
253T56.1Low55.9Low52 Ų5289 Ų8932%0.31948%0.479SS..Hα-helixtrans-61.3-46.4172.814.80000112M61 A248 T249 S250 R255 L256 L257M61-T253 HydrophobicContact CB-CG2 4.49Å; A248-T253 HydrophobicContact CB-CG2 4.34Å; T249-T253 PolarHBondContact O-N 3Å; T249-T253 PolarHBondContact O-OG1 3.29Å; S250-T253 WeakPolarHBondContact CA-OG1 3.47Å; S250-T253 PolarHBondContact O-OG1 3.03Å; T253-R255 VanDerWaalsContact C-N 3.34Å; T253-R255 PolarHBondContact O-N 2.99Å; T253-L256 PolarHBondContact O-N 3.27Å; T253-L257 WeakPolarHBondContact O-CB 3.46Å; T253-L257 PolarHBondContact O-N 2.65Å
254E58Low56.3Low140 Ų14090.4 Ų90.465%0.65449%0.491SS*.Hα-helixtrans-63.4-40.4177-73.8-179.5167.700111.9S250 L257 A258S250-E254 PolarHBondContact O-N 2.97Å; E254-L257 PolarHBondContact O-N 3.49Å; E254-A258 WeakPolarHBondContact O-CB 3.27Å; E254-A258 PolarHBondContact O-N 3.23Å
255R63.5Low56.4Low193 Ų19394 Ų9473%0.72850%0.503SS*.Hα-helixtrans-64-43.3176.1-84.4-178.1158.8177.3-4.2112.9S251 E252 T253 M259S251-R255 WeakPolarHBondContact O-CB 3.25Å; S251-R255 WeakPolarHBondContact O-CG 3.4Å; S251-R255 PolarHBondContact O-N 3.37Å; E252-R255 PolarHBondContact O-N 3.14Å; T253-R255 VanDerWaalsContact C-N 3.34Å; T253-R255 PolarHBondContact O-N 2.99Å; R255-M259 WeakPolarHBondContact O-CB 3.27Å; R255-M259 VanDerWaalsContact O-CG 3.28Å; R255-M259 WeakPolarHBondContact O-CG 3.02Å; R255-M259 PolarHBondContact O-N 3.47Å
256L62.7Low56.8Low94 Ų9493.5 Ų93.549%0.49251%0.509SS..Hα-helixtrans-71-34.4179.4-71.6171.8000112M61 E252 T253 M259 A260M61-L256 HydrophobicContact SD-CD1 4.26Å; E252-L256 WeakPolarHBondContact O-CB 3.43Å; E252-L256 VanDerWaalsContact O-CG 3.31Å; E252-L256 WeakPolarHBondContact O-CG 3.28Å; E252-L256 PolarHBondContact O-N 2.99Å; T253-L256 PolarHBondContact O-N 3.27Å; L256-M259 PolarHBondContact O-N 3.41Å; L256-A260 WeakPolarHBondContact O-CB 3.07Å; L256-A260 PolarHBondContact O-N 2.51Å
257L66.1Low56.9Low121 Ų12195.2 Ų95.263%0.63453%0.526SS*.Hα-helixtrans-68.3-42.6175.3-141.1132.3000111T253 E254 M259 A260 E261T253-L257 WeakPolarHBondContact O-CB 3.46Å; T253-L257 PolarHBondContact O-N 2.65Å; E254-L257 PolarHBondContact O-N 3.49Å; L257-M259 VanDerWaalsContact C-N 3.34Å; L257-M259 PolarHBondContact O-N 2.99Å; L257-A260 PolarHBondContact O-N 3.4Å; L257-E261 WeakPolarHBondContact O-CB 3.48Å; L257-E261 PolarHBondContact O-N 3.45Å
258A68.8Low56.8Low54 Ų54100 Ų10045%0.44654%0.542SS..Hα-helixtrans-61.7-40.2172.400000112.2E254 Q262E254-A258 WeakPolarHBondContact O-CB 3.27Å; E254-A258 PolarHBondContact O-N 3.23Å; A258-Q262 WeakPolarHBondContact O-CB 3.15Å; A258-Q262 PolarHBondContact O-N 2.89Å
259M67.6Low57Low123 Ų123108 Ų10861%0.60657%0.573SS**Hα-helixtrans-65.1-41.8174.8-77.1-179.8155.900112.4R255 L256 L257 Q262 Q263R255-M259 WeakPolarHBondContact O-CB 3.27Å; R255-M259 VanDerWaalsContact O-CG 3.28Å; R255-M259 WeakPolarHBondContact O-CG 3.02Å; R255-M259 PolarHBondContact O-N 3.47Å; L256-M259 PolarHBondContact O-N 3.41Å; L257-M259 VanDerWaalsContact C-N 3.34Å; L257-M259 PolarHBondContact O-N 2.99Å; M259-Q262 PolarHBondContact O-N 2.85Å; M259-Q263 WeakPolarHBondContact O-CB 3.32Å; M259-Q263 PolarHBondContact O-N 3.12Å
260A63.2Low56.7Low56 Ų56107.3 Ų107.346%0.46358%0.582SS.*Hα-helixtrans-67.4-38.3178.200000112.5L256 L257 Q263 S264L256-A260 WeakPolarHBondContact O-CB 3.07Å; L256-A260 PolarHBondContact O-N 2.51Å; L257-A260 PolarHBondContact O-N 3.4Å; A260-Q263 PolarHBondContact O-N 3.49Å; A260-S264 PolarHBondContact O-N 2.7Å
261E64.6Low56.2Low121 Ų121108.9 Ų108.957%0.56559%0.587SS**Hα-helixtrans-66-42.8176.8-163.9166.5-161.200111L257 Q263 S264 H265L257-E261 WeakPolarHBondContact O-CB 3.48Å; L257-E261 PolarHBondContact O-N 3.45Å; E261-Q263 VanDerWaalsContact C-N 3.32Å; E261-Q263 PolarHBondContact O-N 3.05Å; E261-S264 PolarHBondContact O-N 2.76Å; E261-S264 PolarHBondContact O-OG 3.29Å; E261-H265 PolarHBondContact O-N 3.45Å
262Q60.4Low55.2Low137 Ų137114.3 Ų114.364%0.6461%0.605SS**Hα-helixtrans-64.4-35.5176.2-156.9171.79.600112.2A258 M259 I266A258-Q262 WeakPolarHBondContact O-CB 3.15Å; A258-Q262 PolarHBondContact O-N 2.89Å; M259-Q262 PolarHBondContact O-N 2.85Å; Q262-I266 WeakPolarHBondContact O-CD1 3.43Å; Q262-I266 WeakPolarHBondContact O-CG1 3.45Å; Q262-I266 PolarHBondContact O-N 2.81Å
263Q58.6Low54.1Low109 Ų109116.1 Ų116.151%0.50962%0.623SS.*Hα-helixtrans-75.8-30.3178.1-144.4163.512.300112.7M259 A260 E261 I266 A267M259-Q263 WeakPolarHBondContact O-CB 3.32Å; M259-Q263 PolarHBondContact O-N 3.12Å; A260-Q263 PolarHBondContact O-N 3.49Å; E261-Q263 VanDerWaalsContact C-N 3.32Å; E261-Q263 PolarHBondContact O-N 3.05Å; Q263-I266 PolarHBondContact O-N 2.84Å; Q263-A267 PolarHBondContact O-N 3.46Å
264S49.9Very low53Low65 Ų65120.9 Ų120.946%0.45565%0.646SS.*Hα-helixtrans-66.4-36.3173.783.50000112.7A260 E261 I266 A267 N268A260-S264 PolarHBondContact O-N 2.7Å; E261-S264 PolarHBondContact O-N 2.76Å; E261-S264 PolarHBondContact O-OG 3.29Å; S264-I266 VanDerWaalsContact C-N 3.28Å; S264-I266 PolarHBondContact O-N 3.15Å; S264-A267 PolarHBondContact O-N 2.99Å; S264-N268 PolarHBondContact O-N 2.88Å
265H50.9Low51.7Low138 Ų138121.9 Ų121.964%0.63966%0.656SS**Hα-helixtrans-68.9-25.7175.5-99-72.1000113.3E261E261-H265 PolarHBondContact O-N 3.45Å
266I53.4Low50.7Low122 Ų122120.5 Ų120.563%0.62666%0.662SS**Hα-helixtrans-82.8-38.9177.2-62.9166.1000110.6Q262 Q263 S264Q262-I266 WeakPolarHBondContact O-CD1 3.43Å; Q262-I266 WeakPolarHBondContact O-CG1 3.45Å; Q262-I266 PolarHBondContact O-N 2.81Å; Q263-I266 PolarHBondContact O-N 2.84Å; S264-I266 VanDerWaalsContact C-N 3.28Å; S264-I266 PolarHBondContact O-N 3.15Å
267A50.4Low49.6Very low67 Ų67122.9 Ų122.955%0.55468%0.675SS**Hα-helixtrans-70.1-33.5179.600000113.4Q263 S264 K269 G270Q263-A267 PolarHBondContact O-N 3.46Å; S264-A267 PolarHBondContact O-N 2.99Å; A267-K269 PolarHBondContact O-N 2.96Å; A267-G270 PolarHBondContact O-N 3.33Å
268N44.2Very low48.1Very low145 Ų145122.2 Ų122.278%0.77568%0.68SS**THydrogen-bonded Turntrans-76-6.9-177.4-140.713.8000114.2S264S264-N268 PolarHBondContact O-N 2.88Å
269K45.4Very low46.6Very low192 Ų192128.5 Ų128.584%0.83570%0.698SS**THydrogen-bonded Turntrans-90.5-6.6173.1-78.6-174.3173.5-1740113.8A267A267-K269 PolarHBondContact O-N 2.96Å
270G42.3Very low45.3Very low68 Ų68129.7 Ų129.770%0.70171%0.705SS**SBendtrans-102.67.5-169.400000117.4A267A267-G270 PolarHBondContact O-N 3.33Å
271T40.1Very low44.1Very low123 Ų123132.2 Ų132.276%0.75572%0.715SS**  trans-129.528.3-165.2-29.80000115.4
272Q35.1Very low42.9Very low185 Ų185134.9 Ų134.986%0.86472%0.724SS**  trans-127.397167.6-79.7-171.86.200110.3
273T34.1Very low42Very low134 Ų134135.6 Ų135.682%0.82273%0.732SS**  trans-179.7145.3146.333.10000109.6
274N33.2Very low41.3Very low152 Ų152135 Ų13581%0.81375%0.746SS**  trans98.174.9173.3-52.8-21.8000116.9
275N32.3Very low41.1Very low161 Ų161136.2 Ų136.286%0.86176%0.76SS**  trans-170.188.5141-114-16000111
276I42.2Very low41.1Very low164 Ų164135.6 Ų135.684%0.84177%0.768SS**  trans-143.295151.1-56.8-175.4000108.7
277D38.8Very low40.5Very low143 Ų143139.5 Ų139.577%0.76578%0.781SS**  trans52.6104.1135.4-66.4-44.2000121.2K279D277-K279 PolarHBondContact O-N 3.25Å
278S33.8Very low40Very low108 Ų108148.5 Ų148.576%0.75581%0.811SS**  trans-59117.2140.167.20000110
279K38.8Very low39.8Very low185 Ų185148.7 Ų148.780%0.80481%0.813SS**  trans172.4143.8141.9-101.7164.9-173.2178.20111.4D277D277-K279 PolarHBondContact O-N 3.25Å
280I39.7Very low39.5Very low148 Ų148146.4 Ų146.476%0.75981%0.812SS**  trans86.390.5156.5-57146.7000113.6
281V38.7Very low39.4Very low110 Ų110150.8 Ų150.867%0.66782%0.818SS**  74.6116.178.4171.50000112.3
282K38.1Very low39.3Very low176 Ų176152.4 Ų152.477%0.76582%0.822SS**  trans64.9110.4150.9-71.3170.4-172.5179.50117.4
283N42.3Very low39.6Very low152 Ų152150.4 Ų150.481%0.81382%0.819SS**  168.1146.893.5-90.8-32.8000112.7
284A43.2Very low40Very low97 Ų97151.5 Ų151.580%0.80282%0.819SS**  trans72.7106.6148.800000119
285A46.4Very low40.5Very low90 Ų90151.4 Ų151.474%0.74482%0.82SS**PPolyproline II helixtrans-62.7158.2162.900000112.7
286P50Low41.1Very low126 Ų126150.7 Ų150.782%0.81882%0.816SS**PPolyproline II helixtrans-86.3141.8160.934-27.8000110.9
287F42.5Very low41Very low204 Ų204149.6 Ų149.690%0.89581%0.814SS**PPolyproline II helixtrans-52.2143.4176.4-84.5-105.5000114.4
288H39.8Very low41.2Very low256 Ų256150.2 Ų150.2100%1.18582%0.819SS**  trans-126.60132.4-130.2-55000108.5

Retrieved 288 of 288 residues in 532.3 ms (Link to these results)