A0A096MS17_PAPAN Loading...

Nedd4 family interacting protein 1

AlphaFold DB (Q9BT67), UniProt , Accession A0A096MS17, Species PAPAN (Papio anubis, Olive baboon), Gene NDFIP1, Length 221 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
1M47.4Very low48.1Very low183 Ų183100.6 Ų100.690%0.90165%0.652SS**  0-47.20-147.4171161.800112.8L3 A4 L5M1-L3 PolarHBondContact O-N 2.93Å; M1-A4 PolarHBondContact O-N 3.35Å; M1-L5 HydrophobicContact CE-CD1 4.34Å; M1-L5 HydrophobicContact CG-CD1 4.11Å; M1-L5 PolarHBondContact O-N 3.11Å
2A48.9Very low47.1Very low85 Ų85107.3 Ų107.370%0.70267%0.668SS**Hα-helixtrans-58.3-39.9179.500000114.8A6A2-A6 PolarHBondContact O-N 2.8Å; A2-A6 VanDerWaalsContact O-N 3.11Å
3L51.9Low46.5Very low130 Ų130107.1 Ų107.168%0.68167%0.669SS**Hα-helixtrans-73-29.7180-128.8104.9000113.7M1M1-L3 PolarHBondContact O-N 2.93Å
4A48.9Very low45.8Very low63 Ų63107.1 Ų107.152%0.52169%0.685SS.*Hα-helixtrans-79-35.6176.900000111.5M1 A7 L8M1-A4 PolarHBondContact O-N 3.35Å; A4-A7 PolarHBondContact O-N 3.27Å; A4-L8 PolarHBondContact O-N 2.74Å
5L51.3Low44.8Very low102 Ų102108.3 Ų108.353%0.53470%0.695SS.*Hα-helixtrans-64.5-39172.2-89.2158.9000112.3M1 A7 L8 A9M1-L5 HydrophobicContact CE-CD1 4.34Å; M1-L5 HydrophobicContact CG-CD1 4.11Å; M1-L5 PolarHBondContact O-N 3.11Å; L5-A7 VanDerWaalsContact C-N 3.27Å; L5-A7 PolarHBondContact O-N 3.02Å; L5-L8 PolarHBondContact O-N 2.94Å; L5-A9 PolarHBondContact O-N 3.49Å
6A51.6Low44Very low68 Ų68105.9 Ų105.956%0.56270%0.697SS**Hα-helixtrans-63.3-32.3177.200000113.1A2A2-A6 PolarHBondContact O-N 2.8Å; A2-A6 VanDerWaalsContact O-N 3.11Å
7A50.7Low43.7Very low53 Ų53106.6 Ų106.644%0.43871%0.705SS.*Hα-helixtrans-77.4-31.1178.900000113A4 L5A4-A7 PolarHBondContact O-N 3.27Å; L5-A7 VanDerWaalsContact C-N 3.27Å; L5-A7 PolarHBondContact O-N 3.02Å
8L44.2Very low43.1Very low131 Ų131112.9 Ų112.969%0.68671%0.712SS**Hα-helixtrans-78.9-26.9178.6-157.472.2000112.4A4 L5 A10A4-L8 PolarHBondContact O-N 2.74Å; L5-L8 PolarHBondContact O-N 2.94Å; L8-A10 VanDerWaalsContact C-N 3.27Å; L8-A10 PolarHBondContact O-N 2.93Å
9A45.5Very low42.3Very low85 Ų85118.1 Ų118.170%0.70272%0.718SS**THydrogen-bonded Turntrans-71.9-14.1-179.800000114.6L5L5-A9 PolarHBondContact O-N 3.49Å
10A47.9Very low42Very low88 Ų88121.3 Ų121.373%0.72773%0.725SS**THydrogen-bonded Turntrans-95.51.7-177.800000114.1L8L8-A10 VanDerWaalsContact C-N 3.27Å; L8-A10 PolarHBondContact O-N 2.93Å
11V41.3Very low41.5Very low119 Ų119122.5 Ų122.572%0.72172%0.723SS**  trans-118.262.2178.395.90000110.3
12E35.5Very low41Very low180 Ų180121.1 Ų121.184%0.84172%0.718SS**  trans-105.2133.9154.1-98.2-123.799.600108.9
13P39.2Very low40Very low105 Ų105123 Ų12368%0.68271%0.712SS**  trans-83.4124.5-163.933-31.7000110.3C15P13-C15 PolarHBondContact O-N 3.38Å
14A37.7Very low39.6Very low108 Ų108124.3 Ų124.389%0.89372%0.72SS**  trans-6793158.500000108.1
15C30.5Very low38.8Very low124 Ų124127.9 Ų127.984%0.83873%0.726SS**  trans-62.8127.6171.1-166.80000110P13P13-C15 PolarHBondContact O-N 3.38Å
16G32.3Very low37.7Very low70 Ų70132.1 Ų132.172%0.72274%0.743SS**  trans65.4100.1140.400000119.1
17S38.2Very low36.6Very low119 Ų119137.8 Ų137.883%0.83276%0.758SS**  trans-15294.7136.7-142.60000108
18R32.8Very low35.5Very low219 Ų219140.7 Ų140.783%0.82678%0.775SS**  7993.581.8-163.6-177.3176.4127-2.4111.8
19Y28.4Very low35.1Very low211 Ų211138.2 Ų138.283%0.82778%0.782SS**  trans39.5125.6148.5-57.8-91.2000121
20Q36.2Very low34.6Very low183 Ų183142.8 Ų142.886%0.85579%0.788SS**  -148.595.8125.6-124.21802.100110.2
21Q30.8Very low34Very low147 Ų147143.9 Ų143.969%0.68779%0.788SS**  trans-81.6115.2164.6175.8177.2-47.800106.7Q23Q21-Q23 PolarHBondContact O-N 2.97Å
22L36.7Very low33.4Very low154 Ų154146 Ų14681%0.80679%0.79SS**  trans-87.696.4169-77.8167.8000108.1
23Q27.6Very low33.1Very low123 Ų123145.5 Ų145.558%0.57579%0.788SS**  trans-93.2103.3164.9-173.6166.1-14.200106Q21 E25Q21-Q23 PolarHBondContact O-N 2.97Å; Q23-E25 VanDerWaalsContact CD-OE2 3.22Å; Q23-E25 HydrophobicContact CG-CG 4.39Å; Q23-E25 WeakPolarHBondContact CG-OE2 3.21Å; Q23-E25 PolarHBondContact NE2-OE2 3.16Å
24N44Very low32.8Very low158 Ų158144.8 Ų144.885%0.84579%0.791SS**  trans-97.5102160-114.9-86.3000105.5
25E32.8Very low32.7Very low139 Ų139144.5 Ų144.565%0.6579%0.788SS**  trans-65.8147.5167.3-94.1144.267.700110.6Q23Q23-E25 VanDerWaalsContact CD-OE2 3.22Å; Q23-E25 HydrophobicContact CG-CG 4.39Å; Q23-E25 WeakPolarHBondContact CG-OE2 3.21Å; Q23-E25 PolarHBondContact NE2-OE2 3.16Å
26E28.3Very low32.8Very low191 Ų191142.2 Ų142.289%0.89379%0.786SS**  trans-25.4141.7152.5-79.8163.67600114.3
27E28.4Very low33.4Very low186 Ų186147 Ų14787%0.86980%0.795SS**  -171.8122.1109.6-171.8147.76500112.3
28S28.1Very low33.8Very low114 Ų114145.5 Ų145.580%0.79779%0.79SS**  trans43.5123.7139.2-149.50000121.8
29G35.1Very low34.7Very low80 Ų80140.6 Ų140.683%0.82579%0.786SS**  trans-166.45916500000112.4
30E34.1Very low35.6Very low181 Ų181135.8 Ų135.885%0.84678%0.781SS**  trans-86.9145.3145.3-100.5152.865.400106.8
31P36.6Very low36.4Very low111 Ų111133.2 Ų133.272%0.72178%0.78SS**  -141.915053.423.12.5000116.3
32E27.2Very low37.1Very low163 Ų163137.6 Ų137.676%0.76279%0.792SS**  56.2134.7115.8-129.2177.110700121.7
33Q29.6Very low37.7Very low169 Ų169135.4 Ų135.479%0.7979%0.79SS**  trans113.7112146-65.9-169.9-21.200119.8
34A32.8Very low38.6Very low91 Ų91134.7 Ų134.775%0.75280%0.798SS**  95.7103.9122.700000118.7
35A35.2Very low38.8Very low101 Ų101135.2 Ų135.284%0.83580%0.799SS**  65.3103.9119.800000118.2
36G34.5Very low39.4Very low76 Ų76133.3 Ų133.378%0.78480%0.801SS**  81.897120.200000116.4
37D42.9Very low40.6Very low171 Ų171129.2 Ų129.291%0.91480%0.8SS**  trans-121.495.3147.2-116.8-29.2000108
38A46.7Very low41.6Very low88 Ų88129.1 Ų129.173%0.72780%0.8SS**PPolyproline II helixtrans-69.8133.6173.300000109.3
39P51.6Low42.4Very low115 Ų115129.1 Ų129.175%0.74780%0.799SS**PPolyproline II helixtrans-70151.5172.128.6-31.7000110.5
40P48.4Very low42.8Very low111 Ų111129.9 Ų129.972%0.72180%0.798SS**PPolyproline II helixtrans-66.2154.4-17027.8-35.1000112.5Y42P40-Y42 PolarHBondContact O-N 3.18Å
41P53.7Low43.1Very low128 Ų128124.8 Ų124.883%0.83179%0.787SS**PPolyproline II helixtrans-64.1124.217826.6-32.4000109.9S43P41-S43 PolarHBondContact O-N 3.33Å; P41-S43 VanDerWaalsContact O-N 3.13Å
42Y44.4Very low43.2Very low239 Ų239128.7 Ų128.794%0.93779%0.789SS**  trans-67.9111.8169.2-127.6-96.3000108.2P40 S44P40-Y42 PolarHBondContact O-N 3.18Å; Y42-S44 PolarHBondContact O-N 3.35Å; Y42-S44 VanDerWaalsContact O-N 3.16Å
43S50.7Low44.2Very low109 Ų109129.8 Ų129.876%0.76279%0.791SS**  trans-54.7119.4173.1-1330000109P41 I45P41-S43 PolarHBondContact O-N 3.33Å; P41-S43 VanDerWaalsContact O-N 3.13Å; S43-I45 PolarHBondContact O-N 3.32Å
44S45.3Very low44.8Very low108 Ų108126.5 Ų126.576%0.75578%0.779SS**  trans-57.1106.3171.650.10000109.3Y42 S46Y42-S44 PolarHBondContact O-N 3.35Å; Y42-S44 VanDerWaalsContact O-N 3.16Å; S44-S46 PolarHBondContact O-N 3.38Å
45I48.8Very low45.2Very low169 Ų169131.5 Ų131.587%0.86778%0.78SS**  trans-80.6118.5165.7-157.7151.3000107.2S43S43-I45 PolarHBondContact O-N 3.32Å
46S44.1Very low45.6Very low98 Ų98134.8 Ų134.869%0.68578%0.775SS**  trans-52.4142.8-173.6-53.60000112.3S44 E48S44-S46 PolarHBondContact O-N 3.38Å; S46-E48 PolarHBondContact O-N 3.09Å
47A53.6Low46.2Very low105 Ų105137.1 Ų137.187%0.86877%0.77SS**SBendtrans-69.139-175.200000114.9
48E50.4Low46.3Very low185 Ų185137.7 Ų137.786%0.86477%0.767SS**  trans-126.122.7-173.2-131.1169.3156.400115.1S46S46-E48 PolarHBondContact O-N 3.09Å
49S44.9Very low46.7Very low113 Ų113136.5 Ų136.579%0.7975%0.753SS**  trans-121.754.4161-1480000111.2A51S49-A51 PolarHBondContact O-N 3.41Å
50A42.6Very low46.9Very low97 Ų97134.9 Ų134.980%0.80276%0.758SS**  trans-80.834.6167.500000111.9Y52A50-Y52 VanDerWaalsContact C-N 3.28Å; A50-Y52 PolarHBondContact O-N 3.05Å; A50-Y52 VanDerWaalsContact O-N 3.11Å
51A40.5Very low47.1Very low74 Ų74137.8 Ų137.861%0.61276%0.759SS**  trans-85.577.2171.800000109.3S49 F53S49-A51 PolarHBondContact O-N 3.41Å; A51-F53 PolarHBondContact O-N 3.2Å; A51-F53 VanDerWaalsContact O-N 3.13Å
52Y40.5Very low47.6Very low193 Ų193137.3 Ų137.376%0.75776%0.757SS**  trans38.167.4134.8-145.6-105.4000116.3A50 D54A50-Y52 VanDerWaalsContact C-N 3.28Å; A50-Y52 PolarHBondContact O-N 3.05Å; A50-Y52 VanDerWaalsContact O-N 3.11Å; Y52-D54 HydrophobicContact CD1-CB 3.58Å; Y52-D54 HydrophobicContact CE1-CB 3.33Å; Y52-D54 HydrophobicContact CG-CB 4.42Å; Y52-D54 PolarHBondContact O-N 3.01Å; Y52-D54 VanDerWaalsContact O-N 3.08Å
53F47.2Very low48.3Very low185 Ų185135.2 Ų135.281%0.81175%0.752SS**  trans-79.176.6153.4-89.5-81.1000108.3A51 Y55A51-F53 PolarHBondContact O-N 3.2Å; A51-F53 VanDerWaalsContact O-N 3.13Å; F53-Y55 AromaticContact CD1-CD2 3.85Å; F53-Y55 HydrophobicContact CD1-CD2 3.85Å; F53-Y55 AromaticContact CD1-CE2 3.74Å; F53-Y55 HydrophobicContact CD1-CE2 3.74Å; F53-Y55 HydrophobicContact CE1-CE2 4.06Å; F53-Y55 PolarHBondContact O-N 3.48Å
54D41.6Very low48.8Very low101 Ų101135.4 Ų135.454%0.5475%0.751SS.*  trans-69.877.2160.3-17668.3000108Y52 K56Y52-D54 HydrophobicContact CD1-CB 3.58Å; Y52-D54 HydrophobicContact CE1-CB 3.33Å; Y52-D54 HydrophobicContact CG-CB 4.42Å; Y52-D54 PolarHBondContact O-N 3.01Å; Y52-D54 VanDerWaalsContact O-N 3.08Å; D54-K56 PolarHBondContact O-N 3.49Å
55Y42Very low49.5Very low195 Ų195135.2 Ų135.277%0.76575%0.747SS**  trans-84.287.9155-91.3-81.5000107.2F53 D57F53-Y55 AromaticContact CD1-CD2 3.85Å; F53-Y55 HydrophobicContact CD1-CD2 3.85Å; F53-Y55 AromaticContact CD1-CE2 3.74Å; F53-Y55 HydrophobicContact CD1-CE2 3.74Å; F53-Y55 HydrophobicContact CE1-CE2 4.06Å; F53-Y55 PolarHBondContact O-N 3.48Å; Y55-D57 PolarHBondContact O-N 3.3Å
56K42.6Very low50.2Low170 Ų170130.8 Ų130.874%0.73973%0.731SS**  trans-45.290.1149.5-169.3-171.4-169.4-176.50109D54D54-K56 PolarHBondContact O-N 3.49Å
57D48.1Very low50.9Low125 Ų125135 Ų13567%0.66873%0.733SS**  trans-122.697.3162.8-160.118.1000108.3Y55 S59Y55-D57 PolarHBondContact O-N 3.3Å; D57-S59 PolarHBondContact O-N 2.86Å
58E45Very low51.3Low183 Ų183135.4 Ų135.486%0.85572%0.721SS**  trans-63.961.7159.9-78.1-176.510400109.3G60E58-G60 PolarHBondContact O-N 2.84Å
59S55.6Low51.8Low63 Ų63131.2 Ų131.244%0.44171%0.708SS.*  trans-9095.1166.767.20000106.4D57 F61D57-S59 PolarHBondContact O-N 2.86Å; S59-F61 PolarHBondContact O-N 3.45Å
60G55.8Low52.7Low82 Ų82129.8 Ų129.885%0.84570%0.702SS**  trans-63.236.8173.500000114.2E58E58-G60 PolarHBondContact O-N 2.84Å
61F52.3Low53.7Low171 Ų171128.5 Ų128.575%0.7569%0.685SS**PPolyproline II helixtrans-85.9120.2170.1-80.3-88.7000107.9S59 K63S59-F61 PolarHBondContact O-N 3.45Å; F61-K63 PolarHBondContact O-N 2.9Å
62P63.2Low54.6Low119 Ų119130 Ų13077%0.77369%0.686SS**PPolyproline II helixtrans-58.2117.8172.724.3-31000107.1
63K60.2Low55.8Low195 Ų195127.9 Ų127.985%0.84869%0.688SS**PPolyproline II helixtrans-52130.1174.8-85.2173.9177.8168.20107.5F61F61-K63 PolarHBondContact O-N 2.9Å
64P60.8Low56.8Low112 Ų112122.9 Ų122.973%0.72767%0.674SS**PPolyproline II helixtrans-55.2145.3177.123.5-32.6000108.9S66P64-S66 PolarHBondContact O-N 3.18Å
65P59.6Low58.3Low104 Ų104121.7 Ų121.768%0.67567%0.673SS**PPolyproline II helixtrans-53.2142179.822.3-32.2000109.6Y67 V69P65-Y67 PolarHBondContact O-N 2.91Å; P65-V69 HydrophobicContact CB-CB 4.47Å
66S62.7Low59.5Low76 Ų76120.8 Ų120.853%0.53167%0.67SS.*PPolyproline II helixtrans-50.1134.9179.2179.50000110.2P64 N68 V69P64-S66 PolarHBondContact O-N 3.18Å; S66-N68 PolarHBondContact O-N 3.18Å; S66-V69 WeakPolarHBondContact O-CB 3.42Å; S66-V69 WeakPolarHBondContact O-CG2 3.36Å; S66-V69 PolarHBondContact O-N 2.86Å
67Y60.3Low60.9Low186 Ų186117.8 Ų117.873%0.72966%0.662SS**Hα-helixtrans-52-28.3-172.7-166.3-99.6000113.5P65 V69 A70 T71P65-Y67 PolarHBondContact O-N 2.91Å; Y67-V69 PolarHBondContact O-N 3.06Å; Y67-A70 PolarHBondContact O-N 3.33Å; Y67-A70 VanDerWaalsContact O-N 3.14Å; Y67-T71 HydrophobicContact CD1-CG2 3.91Å; Y67-T71 HydrophobicContact CE1-CG2 3.56Å; Y67-T71 PolarHBondContact O-N 3.21Å; Y67-T71 PolarHBondContact O-OG1 2.9Å
68N62.4Low61.8Low115 Ų115117 Ų11762%0.61565%0.654SS**Hα-helixtrans-63.2-24175.7-62.2-44.2000113.9S66 T72S66-N68 PolarHBondContact O-N 3.18Å; N68-T72 PolarHBondContact O-OG1 3Å
69V60.5Low63.1Low97 Ų97110.4 Ų110.459%0.58863%0.63SS**Hα-helixtrans-74.7-28.1177.1-176.80000111.3P65 S66 Y67P65-V69 HydrophobicContact CB-CB 4.47Å; S66-V69 WeakPolarHBondContact O-CB 3.42Å; S66-V69 WeakPolarHBondContact O-CG2 3.36Å; S66-V69 PolarHBondContact O-N 2.86Å; Y67-V69 PolarHBondContact O-N 3.06Å
70A62.7Low63.7Low82 Ų82112.9 Ų112.968%0.67864%0.635SS**Hα-helixtrans-89.6-19.9-177.400000113.5Y67Y67-A70 PolarHBondContact O-N 3.33Å; Y67-A70 VanDerWaalsContact O-N 3.14Å
71T63.3Low64.2Low71 Ų71117.2 Ų117.244%0.43663%0.626SS.*Hα-helixtrans-97.8-15.3-178.356.80000113.9Y67 L73Y67-T71 HydrophobicContact CD1-CG2 3.91Å; Y67-T71 HydrophobicContact CE1-CG2 3.56Å; Y67-T71 PolarHBondContact O-N 3.21Å; Y67-T71 PolarHBondContact O-OG1 2.9Å; T71-L73 PolarHBondContact O-N 3.29Å
72T60.9Low64.8Low105 Ų105113.3 Ų113.364%0.64462%0.616SS**  trans-7678.3168.553.10000108.7N68N68-T72 PolarHBondContact O-OG1 3Å
73L65.6Low64.8Low149 Ų149115.3 Ų115.378%0.7861%0.613SS**PPolyproline II helixtrans-54.3135.9162.5-70.6149.8000107.5T71 S75T71-L73 PolarHBondContact O-N 3.29Å; L73-S75 PolarHBondContact O-N 3.21Å
74P68Low64.5Low80 Ų80108.9 Ų108.952%0.51960%0.596SS.*PPolyproline II helixtrans-49.6133.8171.8-24.432.6000108.9Y76 E78 A79P74-Y76 PolarHBondContact O-N 2.76Å; P74-E78 HydrophobicContact CB-CB 4.47Å; P74-A79 HydrophobicContact CB-CB 4.41Å
75S71.8Confident64.2Low76 Ų76111.9 Ų111.953%0.53160%0.6SS.*PPolyproline II helixtrans-55.9141.7173-170.50000107.9L73 D77 E78 A79L73-S75 PolarHBondContact O-N 3.21Å; S75-D77 PolarHBondContact O-N 3.41Å; S75-E78 WeakPolarHBondContact O-CA 3.37Å; S75-E78 WeakPolarHBondContact O-CB 3.42Å; S75-E78 PolarHBondContact O-N 2.98Å; S75-A79 PolarHBondContact O-N 3.36Å
76Y68.2Low63.8Low176 Ų176110.7 Ų110.769%0.6960%0.599SS**Hα-helixtrans-48-40.4-174.8-179-93000111.8P74 E78 A79 E80P74-Y76 PolarHBondContact O-N 2.76Å; Y76-E78 VanDerWaalsContact C-N 3.3Å; Y76-E78 PolarHBondContact O-N 3.35Å; Y76-A79 PolarHBondContact O-N 3.13Å; Y76-E80 WeakPolarHBondContact CE1-OE2 3.3Å; Y76-E80 PolarHBondContact O-N 2.89Å
77D71.4Confident63.1Low107 Ų107110.5 Ų110.557%0.57260%0.595SS**Hα-helixtrans-64.2-28.3177.5-58.6-30.5000113.9S75 R81S75-D77 PolarHBondContact O-N 3.41Å; D77-R81 WeakPolarHBondContact O-CG 3.19Å; D77-R81 PolarHBondContact O-NE 3.46Å
78E68Low62.4Low109 Ų109108.8 Ų108.851%0.50960%0.597SS.*Hα-helixtrans-79.6-41.8176.1-171.6177.3-179.700111.7P74 S75 Y76 E80 R81 T82P74-E78 HydrophobicContact CB-CB 4.47Å; S75-E78 WeakPolarHBondContact O-CA 3.37Å; S75-E78 WeakPolarHBondContact O-CB 3.42Å; S75-E78 PolarHBondContact O-N 2.98Å; Y76-E78 VanDerWaalsContact C-N 3.3Å; Y76-E78 PolarHBondContact O-N 3.35Å; E78-E80 VanDerWaalsContact C-N 3.28Å; E78-E80 PolarHBondContact O-N 3.29Å; E78-R81 PolarHBondContact O-N 3.34Å; E78-T82 PolarHBondContact O-N 2.89Å; E78-T82 PolarHBondContact O-OG1 3.46Å
79A71.3Confident61.5Low43 Ų43108.8 Ų108.836%0.35560%0.603SS.*Hα-helixtrans-62.6-36.6174.900000111.7P74 S75 Y76 T82 K83P74-A79 HydrophobicContact CB-CB 4.41Å; S75-A79 PolarHBondContact O-N 3.36Å; Y76-A79 PolarHBondContact O-N 3.13Å; A79-T82 WeakPolarHBondContact CA-OG1 3.29Å; A79-T82 PolarHBondContact O-OG1 2.95Å; A79-K83 VanDerWaalsContact O-CB 3.31Å; A79-K83 WeakPolarHBondContact O-CB 3.06Å; A79-K83 PolarHBondContact O-N 2.82Å
80E68.7Low60.6Low116 Ų116111.5 Ų111.554%0.54261%0.614SS.*Hα-helixtrans-64.2-43.1176.3-166.8174.5132.600111.6Y76 E78 K83 A84Y76-E80 WeakPolarHBondContact CE1-OE2 3.3Å; Y76-E80 PolarHBondContact O-N 2.89Å; E78-E80 VanDerWaalsContact C-N 3.28Å; E78-E80 PolarHBondContact O-N 3.29Å; E80-K83 PolarHBondContact O-N 3Å; E80-A84 WeakPolarHBondContact O-CB 3.42Å; E80-A84 PolarHBondContact O-N 3.16Å
81R65.9Low59.6Low173 Ų173113.8 Ų113.865%0.65362%0.619SS**Hα-helixtrans-71.9-36.8179-7.9-172-145.7153.712.2112.5D77 E78 K83 A84 E85D77-R81 WeakPolarHBondContact O-CG 3.19Å; D77-R81 PolarHBondContact O-NE 3.46Å; E78-R81 PolarHBondContact O-N 3.34Å; R81-K83 VanDerWaalsContact C-N 3.32Å; R81-K83 PolarHBondContact O-N 2.86Å; R81-A84 PolarHBondContact O-N 3.35Å; R81-E85 PolarHBondContact O-N 3.21Å
82T64.8Low58.5Low88 Ų88116.7 Ų116.754%0.5464%0.639SS.*Hα-helixtrans-67.1-35.4175190000111.7E78 A79 A86E78-T82 PolarHBondContact O-N 2.89Å; E78-T82 PolarHBondContact O-OG1 3.46Å; A79-T82 WeakPolarHBondContact CA-OG1 3.29Å; A79-T82 PolarHBondContact O-OG1 2.95Å; T82-A86 PolarHBondContact O-N 2.91Å; T82-A86 VanDerWaalsContact O-N 3.14Å
83K63.1Low57.4Low161 Ų161114.8 Ų114.870%0.764%0.64SS**Hα-helixtrans-68-37172.8-163.1176.6-170.8-177.40111.9A79 E80 R81 T87A79-K83 VanDerWaalsContact O-CB 3.31Å; A79-K83 WeakPolarHBondContact O-CB 3.06Å; A79-K83 PolarHBondContact O-N 2.82Å; E80-K83 PolarHBondContact O-N 3Å; R81-K83 VanDerWaalsContact C-N 3.32Å; R81-K83 PolarHBondContact O-N 2.86Å; K83-T87 PolarHBondContact O-N 2.83Å; K83-T87 PolarHBondContact O-OG1 2.64Å
84A55.3Low56.2Low61 Ų61118.6 Ų118.650%0.50464%0.644SS.*Hα-helixtrans-69.2-37.6176.200000112.5E80 R81 T87E80-A84 WeakPolarHBondContact O-CB 3.42Å; E80-A84 PolarHBondContact O-N 3.16Å; R81-A84 PolarHBondContact O-N 3.35Å; A84-T87 WeakPolarHBondContact O-CA 3.04Å; A84-T87 VanDerWaalsContact O-CB 3.31Å; A84-T87 WeakPolarHBondContact O-CB 3.07Å; A84-T87 PolarHBondContact O-N 3.13Å
85E53.1Low55Low174 Ų174121.3 Ų121.381%0.81365%0.654SS**Hα-helixtrans-74.8-25.7178.2-162.4171.6174.700112.6R81R81-E85 PolarHBondContact O-N 3.21Å
86A52.7Low53.4Low79 Ų79125.4 Ų125.465%0.65367%0.665SS**THydrogen-bonded Turntrans-76.6-10.4165.600000113.3T82 I88T82-A86 PolarHBondContact O-N 2.91Å; T82-A86 VanDerWaalsContact O-N 3.14Å; A86-I88 PolarHBondContact O-N 3.26Å
87T46.7Very low52.1Low73 Ų73124.5 Ų124.545%0.44867%0.672SS.*SBendtrans-87.889.5176.2-57.70000109K83 A84 L90K83-T87 PolarHBondContact O-N 2.83Å; K83-T87 PolarHBondContact O-OG1 2.64Å; A84-T87 WeakPolarHBondContact O-CA 3.04Å; A84-T87 VanDerWaalsContact O-CB 3.31Å; A84-T87 WeakPolarHBondContact O-CB 3.07Å; A84-T87 PolarHBondContact O-N 3.13Å; T87-L90 HydrophobicContact CG2-CD2 4.43Å; T87-L90 HydrophobicContact CG2-CG 4.48Å
88I45.9Very low50.6Low150 Ų150128.9 Ų128.977%0.76969%0.686SS**  trans-42.3134.5164.1-60.6168.6000109A86 L90A86-I88 PolarHBondContact O-N 3.26Å; I88-L90 PolarHBondContact O-N 2.88Å
89P42.8Very low49.5Very low115 Ų115129 Ų12975%0.74769%0.694SS**  trans-52128.4-163.8-28.633.8000115V91P89-V91 PolarHBondContact O-N 2.84Å; P89-V91 VanDerWaalsContact O-N 3.11Å
90L42.6Very low48.2Very low153 Ų153129.7 Ų129.780%0.80171%0.706SS**  trans-52.3103.2176.1-63.8154.2000111.8T87 I88T87-L90 HydrophobicContact CG2-CD2 4.43Å; T87-L90 HydrophobicContact CG2-CG 4.48Å; I88-L90 PolarHBondContact O-N 2.88Å
91V40.8Very low47.2Very low131 Ų131133.8 Ų133.879%0.79472%0.716SS**  trans-80.5119.6150.4176.90000105.9P89 G93P89-V91 PolarHBondContact O-N 2.84Å; P89-V91 VanDerWaalsContact O-N 3.11Å; V91-G93 PolarHBondContact O-N 3.43Å
92P42.1Very low46.5Very low132 Ų132130.6 Ų130.686%0.85771%0.712SS**SBendtrans-74.198.6-175.525.6-23.8000109
93G37.3Very low45.7Very low64 Ų64131.8 Ų131.866%0.6672%0.715SS**  trans-151.942177.400000110.4V91V91-G93 PolarHBondContact O-N 3.43Å
94R39.3Very low45Very low229 Ų229132.6 Ų132.686%0.86472%0.719SS**  trans-78.7113.1163.5178.2-179.2-172.8151.31.3105.6
95D42.6Very low44.9Very low137 Ų137131.8 Ų131.873%0.73371%0.706SS**SBendtrans162.665.9146.5-75.4-19.6000108.6
96E39.9Very low45.1Very low163 Ų163127.9 Ų127.976%0.76269%0.691SS**SBendtrans-171.6-12.7157.9-81.9-50.8108.600111.4
97D39.6Very low45Very low157 Ų157127.1 Ų127.184%0.8468%0.684SS**  trans-9818.2-176.1-63.4-32.4000114.8V99D97-V99 VanDerWaalsContact C-N 3.28Å; D97-V99 PolarHBondContact O-N 3.2Å
98F40.4Very low45.4Very low198 Ų198127.4 Ų127.487%0.86868%0.683SS**  trans-92.247.6172.2-160-99.4000112.2
99V45.7Very low46Very low112 Ų112123.2 Ų123.268%0.67966%0.661SS**SBendtrans-106.294.1158.4-173.40000105.6D97D97-V99 VanDerWaalsContact C-N 3.28Å; D97-V99 PolarHBondContact O-N 3.2Å
100G43.3Very low46.5Very low58 Ų58124.9 Ų124.960%0.59866%0.662SS**  trans-75.7157.7-162.900000116.4
101R47Very low47.4Very low202 Ų202126.1 Ų126.176%0.76266%0.656SS**  trans72.259.9148.9-152.182.7173.41461.4116.3D103R101-D103 IonicContact NH1-OD2 3.98Å; R101-D103 PolarHBondContact O-N 2.86Å; R101-D103 VanDerWaalsContact O-N 3.07Å
102D51.7Low48.1Very low105 Ų105125 Ų12556%0.56165%0.645SS**THydrogen-bonded Turntrans-66.37.8175.3-66.7-59.4000116.7
103D48.4Very low48.9Very low114 Ų114119.9 Ų119.961%0.6162%0.615SS**THydrogen-bonded Turntrans-79-24.7-177.8-68.9-56.8000113.7R101R101-D103 IonicContact NH1-OD2 3.98Å; R101-D103 PolarHBondContact O-N 2.86Å; R101-D103 VanDerWaalsContact O-N 3.07Å
104F47.3Very low50.5Low178 Ų178124 Ų12478%0.78162%0.623SS**THydrogen-bonded Turntrans-91.5-22.3177.8-102.7-91.9000112.9
105D54.7Low52.3Low43 Ų43114.9 Ų114.923%0.2359%0.591CS.*Hα-helixtrans-73.1-33.8-178.2-87.8-75000112.5A107 D108 Q109 A143D105-A107 VanDerWaalsContact C-N 3.31Å; D105-A107 PolarHBondContact O-N 3.49Å; D105-D108 PolarHBondContact O-N 3.39Å; D105-Q109 WeakPolarHBondContact O-CB 3.33Å; D105-Q109 PolarHBondContact O-N 3.45Å; D105-A143 PolarHBondContact OD1-N 3.38Å
106D56.6Low54.3Low93 Ų93110.1 Ų110.150%0.49757%0.574SS.*Hα-helixtrans-59.1-39.1179.6-82-26.2000112.6D108 Q109 L110D106-D108 PolarHBondContact O-N 2.95Å; D106-Q109 PolarHBondContact O-N 2.91Å; D106-Q109 PolarHBondContact OD1-OE1 2.89Å; D106-L110 WeakPolarHBondContact O-CB 3.41Å; D106-L110 PolarHBondContact O-N 3.18Å
107A50Low56.5Low62 Ų62103.2 Ų103.251%0.51254%0.542SS..Hα-helixtrans-68-35.2-175.800000113D105 R111D105-A107 VanDerWaalsContact C-N 3.31Å; D105-A107 PolarHBondContact O-N 3.49Å; A107-R111 WeakPolarHBondContact O-CB 3.44Å
108D56.4Low58.7Low79 Ų7995.9 Ų95.942%0.42250%0.503SS..Hα-helixtrans-86.1-29.3174.4-74.8-33000111.9D105 D106 R111 I112D105-D108 PolarHBondContact O-N 3.39Å; D106-D108 PolarHBondContact O-N 2.95Å; D108-R111 IonicContact OD1-CZ 3.49Å; D108-R111 IonicContact OD1-NH1 3.46Å; D108-R111 PolarHBondContact OD1-NH1 3.29Å; D108-R111 IonicContact OD1-NH2 2.7Å; D108-I112 WeakPolarHBondContact O-CB 3.5Å; D108-I112 WeakPolarHBondContact O-CG2 3.31Å; D108-I112 PolarHBondContact O-N 3.13Å; D108-I112 VanDerWaalsContact O-N 3.13Å
109Q56.9Low61Low63 Ų6389.5 Ų89.529%0.29448%0.476SS..Hα-helixtrans-66.5-42.5173.7-170.7178.130.800112.3D105 D106 A144D105-Q109 WeakPolarHBondContact O-CB 3.33Å; D105-Q109 PolarHBondContact O-N 3.45Å; D106-Q109 PolarHBondContact O-N 2.91Å; D106-Q109 PolarHBondContact OD1-OE1 2.89Å; Q109-A144 HydrophobicContact CG-CB 4.16Å
110L55Low63Low150 Ų15088.6 Ų88.679%0.78547%0.468SS*.Hα-helixtrans-71.8-36.8-179.7-154.7161.9000111.3D106D106-L110 WeakPolarHBondContact O-CB 3.41Å; D106-L110 PolarHBondContact O-N 3.18Å
111R60.1Low65.2Low179 Ų17986 Ų8668%0.67544%0.44SS*.Hα-helixtrans-79.6-32.2-176.8-156.5171.881.5-99.91.5113.8A107 D108A107-R111 WeakPolarHBondContact O-CB 3.44Å; D108-R111 IonicContact OD1-CZ 3.49Å; D108-R111 IonicContact OD1-NH1 3.46Å; D108-R111 PolarHBondContact OD1-NH1 3.29Å; D108-R111 IonicContact OD1-NH2 2.7Å
112I55.2Low67.2Low108 Ų10877.5 Ų77.555%0.55441%0.408SS*.Hα-helixtrans-97.1-4.4-170.1-143.968.6000114.9D108 I117D108-I112 WeakPolarHBondContact O-CB 3.5Å; D108-I112 WeakPolarHBondContact O-CG2 3.31Å; D108-I112 PolarHBondContact O-N 3.13Å; D108-I112 VanDerWaalsContact O-N 3.13Å; I112-I117 HydrophobicContact CG2-CB 3.97Å; I112-I117 HydrophobicContact CG2-CD1 4.31Å; I112-I117 HydrophobicContact CG2-CG1 4.15Å; I112-I117 HydrophobicContact CG2-CG2 4.44Å
113G59.9Low69Low23 Ų2377.6 Ų77.624%0.23740%0.404CS..  trans144.4109.6164.400000112.3D115 G116G113-D115 CarbonylContact O-C 3.54Å; G113-D115 PolarHBondContact O-N 3.48Å; G113-G116 PolarHBondContact O-N 2.74Å
114N69.8Low71Confident151 Ų15176.1 Ų76.181%0.80739%0.394SS*.THydrogen-bonded Turntrans-30.9-41.7173.9-169.920.2000114.7
115D78.8Confident73Confident37 Ų3767.6 Ų67.620%0.19836%0.357CS..THydrogen-bonded Turntrans-136.8-6169.7-66-71000112.8G113 I117 F118 M119 Y199 R203G113-D115 CarbonylContact O-C 3.54Å; G113-D115 PolarHBondContact O-N 3.48Å; D115-I117 PolarHBondContact O-N 2.83Å; D115-F118 PolarHBondContact O-N 3.27Å; D115-M119 WeakPolarHBondContact O-CG 3.33Å; D115-M119 PolarHBondContact O-N 2.87Å; D115-M119 VanDerWaalsContact O-N 3.1Å; D115-Y199 VanDerWaalsContact CB-OH 3.29Å; D115-Y199 WeakPolarHBondContact CB-OH 3.35Å; D115-Y199 VanDerWaalsContact CG-OH 3.27Å; D115-Y199 PolarHBondContact OD1-OH 3.27Å; D115-R203 IonicContact OD1-CZ 3.66Å; D115-R203 IonicContact OD1-NE 2.79Å; D115-R203 PolarHBondContact OD1-NE 3.46Å; D115-R203 IonicContact OD1-NH2 3.65Å; D115-R203 PolarHBondContact OD1-NH2 2.81Å; D115-R203 IonicContact OD2-CZ 3.55Å; D115-R203 IonicContact OD2-NE 2.82Å; D115-R203 PolarHBondContact OD2-NE 3.38Å; D115-R203 IonicContact OD2-NH2 3.47Å; D115-R203 PolarHBondContact OD2-NH2 2.88Å
116G83.2Confident74.6Confident37 Ų3768.5 Ų68.538%0.38136%0.359SS..Hα-helixtrans-66.2-43.4-166.400000111.3G113 F118 M119 L120G113-G116 PolarHBondContact O-N 2.74Å; G116-F118 PolarHBondContact O-N 3.5Å; G116-M119 PolarHBondContact O-N 3.48Å; G116-L120 WeakPolarHBondContact O-CA 3.33Å; G116-L120 WeakPolarHBondContact O-CB 3.2Å; G116-L120 PolarHBondContact O-N 3.01Å
117I85.9Confident75.9Confident18 Ų1868.8 Ų68.89%0.09236%0.36CS..Hα-helixtrans-65.3-39.3-177.4-169.259.9000112.7I112 D115 T121 T140 A144I112-I117 HydrophobicContact CG2-CB 3.97Å; I112-I117 HydrophobicContact CG2-CD1 4.31Å; I112-I117 HydrophobicContact CG2-CG1 4.15Å; I112-I117 HydrophobicContact CG2-CG2 4.44Å; D115-I117 PolarHBondContact O-N 2.83Å; I117-T121 HydrophobicContact CD1-CG2 4.29Å; I117-T121 WeakPolarHBondContact O-CB 3.43Å; I117-T121 VanDerWaalsContact O-CG2 3.32Å; I117-T121 WeakPolarHBondContact O-CG2 3.36Å; I117-T121 PolarHBondContact O-N 3.37Å; I117-T121 PolarHBondContact O-OG1 2.85Å; I117-T140 HydrophobicContact CD1-CG2 3.75Å; I117-T140 HydrophobicContact CG1-CG2 3.82Å; I117-A144 HydrophobicContact CG2-CB 3.71Å
118F86Confident77.3Confident4 Ų471.1 Ų71.12%0.01836%0.359CS..Hα-helixtrans-64.8-53175.2173.9-90.5000110.4D115 G116 L120 T121 F122 Y199D115-F118 PolarHBondContact O-N 3.27Å; G116-F118 PolarHBondContact O-N 3.5Å; F118-L120 VanDerWaalsContact C-N 3.33Å; F118-L120 PolarHBondContact O-N 2.89Å; F118-T121 PolarHBondContact O-N 3.44Å; F118-T121 PolarHBondContact O-OG1 3.37Å; F118-F122 WeakPolarHBondContact O-CB 3.42Å; F118-F122 PolarHBondContact O-N 2.81Å; F118-Y199 HydrophobicContact CB-CD2 3.79Å; F118-Y199 HydrophobicContact CB-CE2 3.55Å; F118-Y199 AromaticContact CD1-CD1 3.54Å; F118-Y199 HydrophobicContact CD1-CD1 3.54Å; F118-Y199 AromaticContact CD1-CD2 3.56Å; F118-Y199 HydrophobicContact CD1-CD2 3.56Å; F118-Y199 AromaticContact CD1-CE1 3.46Å; F118-Y199 HydrophobicContact CD1-CE1 3.46Å; F118-Y199 VanDerWaalsContact CD1-CE1 3.46Å; F118-Y199 AromaticContact CD1-CE2 3.52Å; F118-Y199 HydrophobicContact CD1-CE2 3.52Å; F118-Y199 AromaticContact CD1-CG 3.57Å; F118-Y199 HydrophobicContact CD1-CG 3.57Å; F118-Y199 AromaticContact CD1-CZ 3.45Å; F118-Y199 VanDerWaalsContact CD1-CZ 3.45Å; F118-Y199 HydrophobicContact CD2-CD1 4.36Å; F118-Y199 AromaticContact CD2-CD2 3.4Å; F118-Y199 HydrophobicContact CD2-CD2 3.4Å; F118-Y199 VanDerWaalsContact CD2-CD2 3.4Å; F118-Y199 HydrophobicContact CD2-CE2 4.07Å; F118-Y199 AromaticContact CD2-CG 3.58Å; F118-Y199 HydrophobicContact CD2-CG 3.58Å; F118-Y199 AromaticContact CE1-CD1 3.24Å; F118-Y199 HydrophobicContact CE1-CD1 3.24Å; F118-Y199 AromaticContact CE1-CD2 4Å; F118-Y199 HydrophobicContact CE1-CD2 4Å; F118-Y199 AromaticContact CE1-CE1 3.54Å; F118-Y199 HydrophobicContact CE1-CE1 3.54Å; F118-Y199 HydrophobicContact CE1-CE2 4.27Å; F118-Y199 AromaticContact CE1-CG 3.48Å; F118-Y199 HydrophobicContact CE1-CG 3.48Å; F118-Y199 VanDerWaalsContact CE1-CG 3.48Å; F118-Y199 HydrophobicContact CE2-CD1 4.12Å; F118-Y199 AromaticContact CE2-CD2 3.84Å; F118-Y199 HydrophobicContact CE2-CD2 3.84Å; F118-Y199 AromaticContact CE2-CG 3.48Å; F118-Y199 HydrophobicContact CE2-CG 3.48Å; F118-Y199 VanDerWaalsContact CE2-CG 3.48Å; F118-Y199 HydrophobicContact CG-CD1 4.11Å; F118-Y199 AromaticContact CG-CD2 3.26Å; F118-Y199 HydrophobicContact CG-CD2 3.26Å; F118-Y199 HydrophobicContact CG-CE1 4.21Å; F118-Y199 AromaticContact CG-CE2 3.41Å; F118-Y199 HydrophobicContact CG-CE2 3.41Å; F118-Y199 VanDerWaalsContact CG-CE2 3.41Å; F118-Y199 AromaticContact CG-CG 3.63Å; F118-Y199 HydrophobicContact CG-CG 3.63Å; F118-Y199 AromaticContact CG-CZ 3.88Å; F118-Y199 VanDerWaalsContact CZ-CB 3.47Å; F118-Y199 AromaticContact CZ-CD1 3.57Å; F118-Y199 HydrophobicContact CZ-CD1 3.57Å; F118-Y199 HydrophobicContact CZ-CD2 4.13Å; F118-Y199 HydrophobicContact CZ-CE1 4.31Å; F118-Y199 AromaticContact CZ-CG 3.44Å; F118-Y199 HydrophobicContact CZ-CG 3.44Å; F118-Y199 VanDerWaalsContact CZ-CG 3.44Å
119M88.4Confident78.4Confident63 Ų6370.3 Ų70.331%0.3135%0.354SS..Hα-helixtrans-63.3-40.2-179.5-68.9-64.5-170.900111.6D115 G116 F122 F123 Y199D115-M119 WeakPolarHBondContact O-CG 3.33Å; D115-M119 PolarHBondContact O-N 2.87Å; D115-M119 VanDerWaalsContact O-N 3.1Å; G116-M119 PolarHBondContact O-N 3.48Å; M119-F122 WeakPolarHBondContact O-CB 3.32Å; M119-F122 PolarHBondContact O-N 3.28Å; M119-F123 HydrophobicContact CB-CD2 4.33Å; M119-F123 HydrophobicContact CB-CE2 4.32Å; M119-F123 WeakPolarHBondContact O-CB 3.39Å; M119-F123 WeakPolarHBondContact O-CD2 3.49Å; M119-F123 PolarHBondContact O-N 3.45Å; M119-F123 HydrophobicContact SD-CE2 4.4Å; M119-Y199 HydrophobicContact CE-CE1 4.06Å
120L88.4Confident79.6Confident94 Ų9473.3 Ų73.349%0.49236%0.363SS..Hα-helixtrans-61.3-52.4179.2177.965.4000111.2G116 F118 F122 F123 M124G116-L120 WeakPolarHBondContact O-CA 3.33Å; G116-L120 WeakPolarHBondContact O-CB 3.2Å; G116-L120 PolarHBondContact O-N 3.01Å; F118-L120 VanDerWaalsContact C-N 3.33Å; F118-L120 PolarHBondContact O-N 2.89Å; L120-F122 VanDerWaalsContact C-N 3.31Å; L120-F122 PolarHBondContact O-N 3.4Å; L120-F123 PolarHBondContact O-N 3.31Å; L120-M124 HydrophobicContact CD1-CE 4.11Å; L120-M124 HydrophobicContact CD1-CG 4.12Å; L120-M124 HydrophobicContact CG-CG 4.46Å; L120-M124 VanDerWaalsContact O-CB 3.23Å; L120-M124 WeakPolarHBondContact O-CB 3.24Å; L120-M124 WeakPolarHBondContact O-CG 3.38Å; L120-M124 PolarHBondContact O-N 2.77Å
121T89Confident81Confident2 Ų271.3 Ų71.31%0.01235%0.352CS..Hα-helixtrans-65.5-35.3178.351.80000112.2I117 F118 A125 T140 G145I117-T121 HydrophobicContact CD1-CG2 4.29Å; I117-T121 WeakPolarHBondContact O-CB 3.43Å; I117-T121 VanDerWaalsContact O-CG2 3.32Å; I117-T121 WeakPolarHBondContact O-CG2 3.36Å; I117-T121 PolarHBondContact O-N 3.37Å; I117-T121 PolarHBondContact O-OG1 2.85Å; F118-T121 PolarHBondContact O-N 3.44Å; F118-T121 PolarHBondContact O-OG1 3.37Å; T121-A125 WeakPolarHBondContact O-CB 3.24Å; T121-A125 PolarHBondContact O-N 3.27Å; T121-T140 HydrophobicContact CG2-CG2 4.05Å; T121-T140 WeakPolarHBondContact CG2-OG1 3.28Å; T121-G145 PolarHBondContact OG1-O 3.18Å
122F89.2Confident82.3Confident24 Ų2462.9 Ų62.911%0.10532%0.321CS..Hα-helixtrans-61.7-52.6173.3170.9-99.7000112.2F118 M119 L120 A125 F126 S151 L155 F192F118-F122 WeakPolarHBondContact O-CB 3.42Å; F118-F122 PolarHBondContact O-N 2.81Å; M119-F122 WeakPolarHBondContact O-CB 3.32Å; M119-F122 PolarHBondContact O-N 3.28Å; L120-F122 VanDerWaalsContact C-N 3.31Å; L120-F122 PolarHBondContact O-N 3.4Å; F122-A125 PolarHBondContact O-N 2.83Å; F122-F126 VanDerWaalsContact O-CB 3.3Å; F122-F126 WeakPolarHBondContact O-CB 3.18Å; F122-F126 PolarHBondContact O-N 3.4Å; F122-S151 WeakPolarHBondContact CD2-OG 3.2Å; F122-L155 HydrophobicContact CE1-CD1 4.49Å; F122-L155 HydrophobicContact CE2-CD1 3.55Å; F122-L155 HydrophobicContact CE2-CG 4.21Å; F122-L155 HydrophobicContact CZ-CD1 3.33Å; F122-L155 HydrophobicContact CZ-CG 4.44Å; F122-F192 HydrophobicContact CD2-CE2 4.49Å; F122-F192 AromaticContact CE2-CD2 3.73Å; F122-F192 HydrophobicContact CE2-CD2 3.73Å; F122-F192 AromaticContact CE2-CE2 3.42Å; F122-F192 HydrophobicContact CE2-CE2 3.42Å; F122-F192 VanDerWaalsContact CE2-CE2 3.42Å; F122-F192 HydrophobicContact CZ-CD2 4.41Å; F122-F192 AromaticContact CZ-CE2 3.75Å; F122-F192 HydrophobicContact CZ-CE2 3.75Å
123F90Very high83.7Confident108 Ų10859.4 Ų59.447%0.47430%0.302SS..Hα-helixtrans-67.5-39179.5-77.2-64.4000112M119 L120 F126 L127M119-F123 HydrophobicContact CB-CD2 4.33Å; M119-F123 HydrophobicContact CB-CE2 4.32Å; M119-F123 WeakPolarHBondContact O-CB 3.39Å; M119-F123 WeakPolarHBondContact O-CD2 3.49Å; M119-F123 PolarHBondContact O-N 3.45Å; M119-F123 HydrophobicContact SD-CE2 4.4Å; L120-F123 PolarHBondContact O-N 3.31Å; F123-F126 PolarHBondContact O-N 2.93Å; F123-L127 WeakPolarHBondContact O-CB 3.23Å; F123-L127 WeakPolarHBondContact O-CG 3.3Å; F123-L127 PolarHBondContact O-N 3.32Å
124M89.8Confident85Confident82 Ų8263.2 Ų63.240%0.40431%0.312SS..Hα-helixtrans-63.6-44.7175.8-74.8-73.617400111.4L120 F126 F128 S136L120-M124 HydrophobicContact CD1-CE 4.11Å; L120-M124 HydrophobicContact CD1-CG 4.12Å; L120-M124 HydrophobicContact CG-CG 4.46Å; L120-M124 VanDerWaalsContact O-CB 3.23Å; L120-M124 WeakPolarHBondContact O-CB 3.24Å; L120-M124 WeakPolarHBondContact O-CG 3.38Å; L120-M124 PolarHBondContact O-N 2.77Å; M124-F126 PolarHBondContact O-N 3.2Å; M124-F128 HydrophobicContact CE-CE2 4.28Å; M124-F128 WeakPolarHBondContact O-CB 3.35Å; M124-F128 WeakPolarHBondContact O-CD2 3.18Å; M124-F128 PolarHBondContact O-N 3.03Å; M124-F128 HydrophobicContact SD-CD2 3.7Å; M124-F128 HydrophobicContact SD-CE2 3.33Å; M124-F128 WeakPolarHBondContact SD-CE2 3.41Å; M124-F128 HydrophobicContact SD-CZ 4.26Å; M124-S136 WeakPolarHBondContact CB-OG 3.25Å
125A90.6Very high85.9Confident0 Ų060.2 Ų60.20%030%0.296CS..Hα-helixtrans-67.8-34176.300000113.3T121 F122 F133 S136 S156T121-A125 WeakPolarHBondContact O-CB 3.24Å; T121-A125 PolarHBondContact O-N 3.27Å; F122-A125 PolarHBondContact O-N 2.83Å; A125-F133 HydrophobicContact CB-CB 4.44Å; A125-F133 HydrophobicContact CB-CD2 4.44Å; A125-S136 PolarHBondContact N-OG 3.36Å; A125-S156 WeakPolarHBondContact O-CB 3.3Å; A125-S156 PolarHBondContact O-OG 3.36Å; A125-S156 VanDerWaalsContact O-OG 3.13Å
126F86.5Confident86.3Confident62 Ų6258.7 Ų58.727%0.27229%0.288SS..Hα-helixtrans-71.5-42178.6172.5-114.7000113.3F122 F123 M124 L155 K159F122-F126 VanDerWaalsContact O-CB 3.3Å; F122-F126 WeakPolarHBondContact O-CB 3.18Å; F122-F126 PolarHBondContact O-N 3.4Å; F123-F126 PolarHBondContact O-N 2.93Å; M124-F126 PolarHBondContact O-N 3.2Å; F126-L155 HydrophobicContact CD2-CB 3.62Å; F126-L155 HydrophobicContact CD2-CD1 4.48Å; F126-L155 HydrophobicContact CE2-CB 4.1Å; F126-K159 HydrophobicContact CE2-CB 4.35Å; F126-K159 HydrophobicContact CE2-CD 3.98Å; F126-K159 HydrophobicContact CZ-CD 4.27Å
127L85Confident86.5Confident99 Ų9960.9 Ų60.952%0.51829%0.287SS..Hα-helixtrans-83.5-42.5-172.9-66.8178000112.7F123 N129F123-L127 WeakPolarHBondContact O-CB 3.23Å; F123-L127 WeakPolarHBondContact O-CG 3.3Å; F123-L127 PolarHBondContact O-N 3.32Å; L127-N129 VanDerWaalsContact C-N 3.28Å; L127-N129 PolarHBondContact O-N 3.4Å
128F80.2Confident86.4Confident111 Ų11164.4 Ų64.449%0.48731%0.312SS..SBendtrans-86.919.8-167.1-74.2-88000114.6M124 I131 G132M124-F128 HydrophobicContact CE-CE2 4.28Å; M124-F128 WeakPolarHBondContact O-CB 3.35Å; M124-F128 WeakPolarHBondContact O-CD2 3.18Å; M124-F128 PolarHBondContact O-N 3.03Å; M124-F128 HydrophobicContact SD-CD2 3.7Å; M124-F128 HydrophobicContact SD-CE2 3.33Å; M124-F128 WeakPolarHBondContact SD-CE2 3.41Å; M124-F128 HydrophobicContact SD-CZ 4.26Å; F128-I131 WeakPolarHBondContact O-CG2 3.5Å; F128-G132 PolarHBondContact O-N 3.48Å
129N79.2Confident86.2Confident61 Ų6171 Ų7133%0.32635%0.347SS..Hα-helixtrans57-165.3-179.4-163.10.9000111.5L127 I131 G132 F133L127-N129 VanDerWaalsContact C-N 3.28Å; L127-N129 PolarHBondContact O-N 3.4Å; N129-I131 PolarHBondContact O-N 2.76Å; N129-I131 VanDerWaalsContact O-N 3.13Å; N129-G132 VanDerWaalsContact O-CA 3.3Å; N129-G132 WeakPolarHBondContact O-CA 3.37Å; N129-G132 PolarHBondContact O-N 2.85Å; N129-F133 PolarHBondContact O-N 2.96Å
130W81.1Confident85.9Confident127 Ų12768.7 Ų68.748%0.48134%0.336SS..Hα-helixtrans-49.1-38.4178.2-93.968.5000113.4G132 F133 F134 F153W130-G132 VanDerWaalsContact C-N 3.29Å; W130-G132 PolarHBondContact O-N 2.75Å; W130-F133 PolarHBondContact O-N 3.41Å; W130-F134 AromaticContact CE3-CE2 3.83Å; W130-F134 HydrophobicContact CE3-CE2 3.83Å; W130-F134 HydrophobicContact CZ3-CE2 4.17Å; W130-F134 WeakPolarHBondContact O-CD2 3.32Å; W130-F134 PolarHBondContact O-N 3.46Å; W130-F153 HydrophobicContact CZ2-CE2 4.35Å
131I84.8Confident85.4Confident107 Ų10770.7 Ų70.755%0.54935%0.353SS..Hα-helixtrans-66.5-33.5176.7-166.261.4000111.9F128 N129 F134 L135F128-I131 WeakPolarHBondContact O-CG2 3.5Å; N129-I131 PolarHBondContact O-N 2.76Å; N129-I131 VanDerWaalsContact O-N 3.13Å; I131-F134 PolarHBondContact O-N 3.45Å; I131-L135 HydrophobicContact CG1-CD1 4.16Å; I131-L135 HydrophobicContact CG1-CG 4.27Å; I131-L135 WeakPolarHBondContact O-CB 3Å; I131-L135 VanDerWaalsContact O-CG 3.24Å; I131-L135 WeakPolarHBondContact O-CG 3.46Å; I131-L135 PolarHBondContact O-N 3.44Å
132G86.5Confident84.8Confident2 Ų271 Ų712%0.02136%0.355CS..Hα-helixtrans-60.4-42172.300000114.2F128 N129 W130 S136F128-G132 PolarHBondContact O-N 3.48Å; N129-G132 VanDerWaalsContact O-CA 3.3Å; N129-G132 WeakPolarHBondContact O-CA 3.37Å; N129-G132 PolarHBondContact O-N 2.85Å; W130-G132 VanDerWaalsContact C-N 3.29Å; W130-G132 PolarHBondContact O-N 2.75Å; G132-S136 VanDerWaalsContact O-CB 3.24Å; G132-S136 WeakPolarHBondContact O-CB 3.45Å; G132-S136 PolarHBondContact O-N 3.19Å; G132-S136 PolarHBondContact O-OG 3.38Å
133F85.2Confident84.1Confident35 Ų3571.1 Ų71.115%0.15436%0.36CS..Hα-helixtrans-63.1-48.9174.9171.4-111.7000111.1A125 N129 W130 S136 F137 A149 F153A125-F133 HydrophobicContact CB-CB 4.44Å; A125-F133 HydrophobicContact CB-CD2 4.44Å; N129-F133 PolarHBondContact O-N 2.96Å; W130-F133 PolarHBondContact O-N 3.41Å; F133-S136 PolarHBondContact O-N 3.41Å; F133-F137 WeakPolarHBondContact O-CB 3.47Å; F133-F137 PolarHBondContact O-N 3.1Å; F133-A149 HydrophobicContact CD2-CB 4.37Å; F133-A149 HydrophobicContact CE2-CB 4.15Å; F133-F153 HydrophobicContact CB-CD2 4.19Å; F133-F153 AromaticContact CD1-CD2 3.86Å; F133-F153 HydrophobicContact CD1-CD2 3.86Å; F133-F153 HydrophobicContact CD1-CE2 4.26Å; F133-F153 HydrophobicContact CD2-CB 3.57Å; F133-F153 AromaticContact CD2-CD2 3.97Å; F133-F153 HydrophobicContact CD2-CD2 3.97Å; F133-F153 HydrophobicContact CD2-CG 4.05Å; F133-F153 HydrophobicContact CE1-CD2 4.2Å; F133-F153 HydrophobicContact CE2-CB 3.69Å; F133-F153 HydrophobicContact CE2-CD2 4.29Å; F133-F153 HydrophobicContact CE2-CG 4.08Å; F133-F153 HydrophobicContact CG-CB 4.19Å; F133-F153 AromaticContact CG-CD2 3.72Å; F133-F153 HydrophobicContact CG-CD2 3.72Å; F133-F153 HydrophobicContact CG-CG 4.27Å; F133-F153 HydrophobicContact CZ-CB 4.43Å; F133-F153 HydrophobicContact CZ-CD2 4.4Å; F133-F153 HydrophobicContact CZ-CG 4.35Å
134F88.4Confident83.6Confident104 Ų10466.6 Ų66.646%0.45634%0.343SS..Hα-helixtrans-61.4-46.8177.4-81.7-68.1000112.4W130 I131 S136 F137 C138W130-F134 AromaticContact CE3-CE2 3.83Å; W130-F134 HydrophobicContact CE3-CE2 3.83Å; W130-F134 HydrophobicContact CZ3-CE2 4.17Å; W130-F134 WeakPolarHBondContact O-CD2 3.32Å; W130-F134 PolarHBondContact O-N 3.46Å; I131-F134 PolarHBondContact O-N 3.45Å; F134-S136 PolarHBondContact O-N 2.78Å; F134-F137 PolarHBondContact O-N 3.03Å; F134-C138 VanDerWaalsContact O-CB 3.3Å; F134-C138 WeakPolarHBondContact O-CB 3.31Å; F134-C138 PolarHBondContact O-N 3.44Å; F134-C138 PolarHBondContact O-SG 2.8Å
135L87.6Confident83.4Confident88 Ų8862.7 Ų62.746%0.46132%0.324SS..Hα-helixtrans-61.7-43.7177.2-69.9177.5000111.3I131 F137 C138 L139I131-L135 HydrophobicContact CG1-CD1 4.16Å; I131-L135 HydrophobicContact CG1-CG 4.27Å; I131-L135 WeakPolarHBondContact O-CB 3Å; I131-L135 VanDerWaalsContact O-CG 3.24Å; I131-L135 WeakPolarHBondContact O-CG 3.46Å; I131-L135 PolarHBondContact O-N 3.44Å; L135-F137 VanDerWaalsContact C-N 3.31Å; L135-F137 PolarHBondContact O-N 2.82Å; L135-C138 PolarHBondContact O-N 3.2Å; L135-L139 WeakPolarHBondContact O-CB 3.04Å; L135-L139 WeakPolarHBondContact O-CG 3.47Å; L135-L139 PolarHBondContact O-N 3.39Å
136S88.3Confident83.2Confident5 Ų568.5 Ų68.54%0.03535%0.345CS..Hα-helixtrans-62.7-39.3178-56.20000112.2M124 A125 G132 F133 F134 T140M124-S136 WeakPolarHBondContact CB-OG 3.25Å; A125-S136 PolarHBondContact N-OG 3.36Å; G132-S136 VanDerWaalsContact O-CB 3.24Å; G132-S136 WeakPolarHBondContact O-CB 3.45Å; G132-S136 PolarHBondContact O-N 3.19Å; G132-S136 PolarHBondContact O-OG 3.38Å; F133-S136 PolarHBondContact O-N 3.41Å; F134-S136 PolarHBondContact O-N 2.78Å; S136-T140 VanDerWaalsContact O-CB 3.27Å; S136-T140 WeakPolarHBondContact O-CB 3.48Å; S136-T140 PolarHBondContact O-N 3.42Å; S136-T140 PolarHBondContact O-OG1 2.71Å
137F86Confident83.2Confident83 Ų8371 Ų7136%0.36435%0.354SS..Hα-helixtrans-71.9-40.4177.9-172.8-94.7000112.2F133 F134 L135 R146F133-F137 WeakPolarHBondContact O-CB 3.47Å; F133-F137 PolarHBondContact O-N 3.1Å; F134-F137 PolarHBondContact O-N 3.03Å; L135-F137 VanDerWaalsContact C-N 3.31Å; L135-F137 PolarHBondContact O-N 2.82Å; F137-R146 HydrophobicContact CE2-CG 4.49Å
138C84.1Confident83.5Confident92 Ų9266.3 Ų66.362%0.62233%0.329SS*.Hα-helixtrans-71-39177.7-69.70000112.5F134 L135 T140F134-C138 VanDerWaalsContact O-CB 3.3Å; F134-C138 WeakPolarHBondContact O-CB 3.31Å; F134-C138 PolarHBondContact O-N 3.44Å; F134-C138 PolarHBondContact O-SG 2.8Å; L135-C138 PolarHBondContact O-N 3.2Å; C138-T140 PolarHBondContact O-N 3.43Å
139L81.3Confident84Confident142 Ų14261 Ų6174%0.74331%0.306SS*.Hα-helixtrans-72.8-19.6179.3-69.1174.7000112.4L135L135-L139 WeakPolarHBondContact O-CB 3.04Å; L135-L139 WeakPolarHBondContact O-CG 3.47Å; L135-L139 PolarHBondContact O-N 3.39Å
140T83Confident84.5Confident14 Ų1461.6 Ų61.69%0.08631%0.308CS..  trans-113.2100-173.9-44.90000111.7I117 T121 S136 C138 S142I117-T140 HydrophobicContact CD1-CG2 3.75Å; I117-T140 HydrophobicContact CG1-CG2 3.82Å; T121-T140 HydrophobicContact CG2-CG2 4.05Å; T121-T140 WeakPolarHBondContact CG2-OG1 3.28Å; S136-T140 VanDerWaalsContact O-CB 3.27Å; S136-T140 WeakPolarHBondContact O-CB 3.48Å; S136-T140 PolarHBondContact O-N 3.42Å; S136-T140 PolarHBondContact O-OG1 2.71Å; C138-T140 PolarHBondContact O-N 3.43Å; T140-S142 VanDerWaalsContact C-N 3.26Å
141T78.4Confident84.9Confident136 Ų13655.5 Ų55.583%0.83429%0.285SS*.  trans-80.2-6.1171.854.30000113.3
142S76.9Confident85.3Confident9 Ų950.4 Ų50.46%0.06326%0.259CS..SBendtrans-86.8140.8-176.6174.10000113.1T140 A144 G145 R146T140-S142 VanDerWaalsContact C-N 3.26Å; S142-A144 VanDerWaalsContact C-N 3.26Å; S142-A144 PolarHBondContact O-N 3.35Å; S142-A144 PolarHBondContact OG-N 3.41Å; S142-G145 PolarHBondContact O-N 3.01Å; S142-G145 VanDerWaalsContact O-N 3.17Å; S142-R146 PolarHBondContact O-N 3.47Å
143A74.3Confident85.4Confident26 Ų2652.3 Ų52.322%0.21527%0.267CS..Hα-helixtrans-50.8-40.8174.900000113.8D105 G145 R146 Y147D105-A143 PolarHBondContact OD1-N 3.38Å; A143-G145 VanDerWaalsContact C-N 3.35Å; A143-G145 PolarHBondContact O-N 3.31Å; A143-R146 PolarHBondContact O-N 2.84Å; A143-Y147 VanDerWaalsContact O-CD2 3.27Å; A143-Y147 WeakPolarHBondContact O-CD2 3.29Å; A143-Y147 PolarHBondContact O-N 3.47Å
144A79.1Confident85.8Confident13 Ų1350.7 Ų50.711%0.10726%0.26CS..Hα-helixtrans-61.4-41.5-178.900000113Q109 I117 S142 R146 Y147 G148Q109-A144 HydrophobicContact CG-CB 4.16Å; I117-A144 HydrophobicContact CG2-CB 3.71Å; S142-A144 VanDerWaalsContact C-N 3.26Å; S142-A144 PolarHBondContact O-N 3.35Å; S142-A144 PolarHBondContact OG-N 3.41Å; A144-R146 VanDerWaalsContact C-N 3.34Å; A144-Y147 PolarHBondContact O-N 2.79Å; A144-G148 PolarHBondContact O-N 3.28Å; A144-G148 VanDerWaalsContact O-N 3.16Å
145G84.9Confident85.7Confident0 Ų047.4 Ų47.40%025%0.247CC..Hα-helixtrans-75.8-21.4179.400000113.5T121 S142 A143 G148 A149T121-G145 PolarHBondContact OG1-O 3.18Å; S142-G145 PolarHBondContact O-N 3.01Å; S142-G145 VanDerWaalsContact O-N 3.17Å; A143-G145 VanDerWaalsContact C-N 3.35Å; A143-G145 PolarHBondContact O-N 3.31Å; G145-G148 PolarHBondContact O-N 3.04Å; G145-A149 WeakPolarHBondContact O-CB 3.34Å; G145-A149 PolarHBondContact O-N 3.46Å
146R86Confident85.9Confident122 Ų12243.6 Ų43.646%0.4623%0.227SC..Hα-helixtrans-64.4-45.3171.6-59.6-178.495.3-165.26.4110.6F137 S142 A143 A144 G148 A149 I150F137-R146 HydrophobicContact CE2-CG 4.49Å; S142-R146 PolarHBondContact O-N 3.47Å; A143-R146 PolarHBondContact O-N 2.84Å; A144-R146 VanDerWaalsContact C-N 3.34Å; R146-G148 VanDerWaalsContact C-N 3.35Å; R146-G148 PolarHBondContact O-N 2.78Å; R146-A149 PolarHBondContact O-N 3.48Å; R146-I150 WeakPolarHBondContact O-CD1 3.37Å; R146-I150 WeakPolarHBondContact O-CG1 3.3Å; R146-I150 PolarHBondContact O-N 3.33Å
147Y87.5Confident85.9Confident116 Ų11644.8 Ų44.846%0.45523%0.233SC..Hα-helixtrans-65-38.2174.3-62.9-64000112.5A143 A144 S151 N198A143-Y147 VanDerWaalsContact O-CD2 3.27Å; A143-Y147 WeakPolarHBondContact O-CD2 3.29Å; A143-Y147 PolarHBondContact O-N 3.47Å; A144-Y147 PolarHBondContact O-N 2.79Å; Y147-S151 WeakPolarHBondContact O-CB 3.12Å; Y147-S151 PolarHBondContact O-N 2.99Å; Y147-S151 PolarHBondContact O-OG 3.5Å; Y147-N198 WeakPolarHBondContact CD1-ND2 3.31Å; Y147-N198 WeakPolarHBondContact CE1-ND2 3.45Å; Y147-N198 VanDerWaalsContact CZ-ND2 3.3Å
148G90.1Very high86.1Confident0 Ų042.1 Ų42.10%022%0.223CC..Hα-helixtrans-61.3-50.7173.300000112.7A144 G145 R146 I150 S151 G152A144-G148 PolarHBondContact O-N 3.28Å; A144-G148 VanDerWaalsContact O-N 3.16Å; G145-G148 PolarHBondContact O-N 3.04Å; R146-G148 VanDerWaalsContact C-N 3.35Å; R146-G148 PolarHBondContact O-N 2.78Å; G148-I150 PolarHBondContact O-N 2.72Å; G148-S151 PolarHBondContact O-N 3.43Å; G148-S151 PolarHBondContact O-OG 3.17Å; G148-G152 PolarHBondContact O-N 3.39Å
149A91.2Very high86.3Confident0 Ų042.4 Ų42.40%021%0.213CC..Hα-helixtrans-60.3-42.6177.800000112.3F133 G145 R146 G152 F153F133-A149 HydrophobicContact CD2-CB 4.37Å; F133-A149 HydrophobicContact CE2-CB 4.15Å; G145-A149 WeakPolarHBondContact O-CB 3.34Å; G145-A149 PolarHBondContact O-N 3.46Å; R146-A149 PolarHBondContact O-N 3.48Å; A149-G152 PolarHBondContact O-N 3.19Å; A149-F153 VanDerWaalsContact O-CB 3.28Å; A149-F153 WeakPolarHBondContact O-CB 3.21Å; A149-F153 PolarHBondContact O-N 2.86Å
150I89.4Confident86.7Confident72 Ų7240.5 Ų40.537%0.36920%0.196SC..Hα-helixtrans-64.7-42.1176.1-66.4162.8000110.8R146 G148 F153 G154R146-I150 WeakPolarHBondContact O-CD1 3.37Å; R146-I150 WeakPolarHBondContact O-CG1 3.3Å; R146-I150 PolarHBondContact O-N 3.33Å; G148-I150 PolarHBondContact O-N 2.72Å; I150-F153 WeakPolarHBondContact O-CB 3.27Å; I150-F153 PolarHBondContact O-N 3.47Å; I150-G154 PolarHBondContact O-N 3.36Å
151S90.8Very high86.9Confident0 Ų040.3 Ų40.30%020%0.195CC..Hα-helixtrans-66.2-3917773.50000112.3F122 Y147 G148 G154 L155F122-S151 WeakPolarHBondContact CD2-OG 3.2Å; Y147-S151 WeakPolarHBondContact O-CB 3.12Å; Y147-S151 PolarHBondContact O-N 2.99Å; Y147-S151 PolarHBondContact O-OG 3.5Å; G148-S151 PolarHBondContact O-N 3.43Å; G148-S151 PolarHBondContact O-OG 3.17Å; S151-G154 PolarHBondContact O-N 3.05Å; S151-L155 PolarHBondContact O-N 3.47Å
152G91.5Very high87.2Confident0 Ų037.6 Ų37.60%018%0.175CC..Hα-helixtrans-71.2-34.4176.900000112.8G148 A149 G154 L155 S156G148-G152 PolarHBondContact O-N 3.39Å; A149-G152 PolarHBondContact O-N 3.19Å; G152-G154 VanDerWaalsContact C-N 3.34Å; G152-G154 PolarHBondContact O-N 3.49Å; G152-L155 PolarHBondContact O-N 3.05Å; G152-S156 WeakPolarHBondContact O-CB 3.32Å; G152-S156 PolarHBondContact O-N 3.46Å
153F90.3Very high87.5Confident42 Ų4241.6 Ų41.618%0.18419%0.194CC..Hα-helixtrans-58.8-44.2171.6177.4-113000111.7W130 F133 A149 I150 L155 S156 L157W130-F153 HydrophobicContact CZ2-CE2 4.35Å; F133-F153 HydrophobicContact CB-CD2 4.19Å; F133-F153 AromaticContact CD1-CD2 3.86Å; F133-F153 HydrophobicContact CD1-CD2 3.86Å; F133-F153 HydrophobicContact CD1-CE2 4.26Å; F133-F153 HydrophobicContact CD2-CB 3.57Å; F133-F153 AromaticContact CD2-CD2 3.97Å; F133-F153 HydrophobicContact CD2-CD2 3.97Å; F133-F153 HydrophobicContact CD2-CG 4.05Å; F133-F153 HydrophobicContact CE1-CD2 4.2Å; F133-F153 HydrophobicContact CE2-CB 3.69Å; F133-F153 HydrophobicContact CE2-CD2 4.29Å; F133-F153 HydrophobicContact CE2-CG 4.08Å; F133-F153 HydrophobicContact CG-CB 4.19Å; F133-F153 AromaticContact CG-CD2 3.72Å; F133-F153 HydrophobicContact CG-CD2 3.72Å; F133-F153 HydrophobicContact CG-CG 4.27Å; F133-F153 HydrophobicContact CZ-CB 4.43Å; F133-F153 HydrophobicContact CZ-CD2 4.4Å; F133-F153 HydrophobicContact CZ-CG 4.35Å; A149-F153 VanDerWaalsContact O-CB 3.28Å; A149-F153 WeakPolarHBondContact O-CB 3.21Å; A149-F153 PolarHBondContact O-N 2.86Å; I150-F153 WeakPolarHBondContact O-CB 3.27Å; I150-F153 PolarHBondContact O-N 3.47Å; F153-L155 VanDerWaalsContact C-N 3.33Å; F153-L155 PolarHBondContact O-N 3.16Å; F153-S156 WeakPolarHBondContact O-CB 3.45Å; F153-S156 PolarHBondContact O-N 2.62Å; F153-L157 HydrophobicContact CD1-CD1 3.81Å; F153-L157 HydrophobicContact CD1-CG 4.31Å; F153-L157 HydrophobicContact CD2-CG 4.34Å; F153-L157 HydrophobicContact CE1-CD1 3.32Å; F153-L157 HydrophobicContact CE1-CG 3.97Å; F153-L157 HydrophobicContact CE2-CD1 4.24Å; F153-L157 HydrophobicContact CE2-CD2 4.06Å; F153-L157 HydrophobicContact CE2-CG 3.98Å; F153-L157 HydrophobicContact CG-CD1 4.46Å; F153-L157 HydrophobicContact CG-CG 4.5Å; F153-L157 HydrophobicContact CZ-CD1 3.57Å; F153-L157 HydrophobicContact CZ-CD2 3.88Å; F153-L157 HydrophobicContact CZ-CG 3.79Å; F153-L157 WeakPolarHBondContact O-CB 2.97Å; F153-L157 WeakPolarHBondContact O-CG 3.27Å; F153-L157 PolarHBondContact O-N 3.48Å
154G92.4Very high87.9Confident0 Ų042.3 Ų42.30%020%0.196CC..Hα-helixtrans-56.7-44.1176.200000113I150 S151 G152 L157 I158 G188I150-G154 PolarHBondContact O-N 3.36Å; S151-G154 PolarHBondContact O-N 3.05Å; G152-G154 VanDerWaalsContact C-N 3.34Å; G152-G154 PolarHBondContact O-N 3.49Å; G154-L157 WeakPolarHBondContact O-CB 3.2Å; G154-L157 PolarHBondContact O-N 3.47Å; G154-I158 VanDerWaalsContact O-CG1 3.31Å; G154-I158 WeakPolarHBondContact O-CG1 3.35Å; G154-I158 PolarHBondContact O-N 2.82Å; G154-G188 CarbonylContact C-O 3.58Å; G154-G188 WeakPolarHBondContact CA-O 3.05Å
155L87.5Confident87.9Confident36 Ų3645.6 Ų45.619%0.18821%0.205CC..Hα-helixtrans-73.2-33.9176.2-66.8-169.1000113.5F122 F126 S151 G152 F153 L157 I158 K159 F192F122-L155 HydrophobicContact CE1-CD1 4.49Å; F122-L155 HydrophobicContact CE2-CD1 3.55Å; F122-L155 HydrophobicContact CE2-CG 4.21Å; F122-L155 HydrophobicContact CZ-CD1 3.33Å; F122-L155 HydrophobicContact CZ-CG 4.44Å; F126-L155 HydrophobicContact CD2-CB 3.62Å; F126-L155 HydrophobicContact CD2-CD1 4.48Å; F126-L155 HydrophobicContact CE2-CB 4.1Å; S151-L155 PolarHBondContact O-N 3.47Å; G152-L155 PolarHBondContact O-N 3.05Å; F153-L155 VanDerWaalsContact C-N 3.33Å; F153-L155 PolarHBondContact O-N 3.16Å; L155-L157 VanDerWaalsContact C-N 3.31Å; L155-I158 HydrophobicContact CD2-CD1 3.7Å; L155-I158 PolarHBondContact O-N 3.05Å; L155-K159 VanDerWaalsContact O-CB 3.32Å; L155-K159 WeakPolarHBondContact O-CB 3.47Å; L155-K159 PolarHBondContact O-N 2.7Å; L155-F192 HydrophobicContact CD1-CD2 3.85Å; L155-F192 HydrophobicContact CD1-CE2 3.84Å; L155-F192 HydrophobicContact CD1-CG 4.28Å; L155-F192 HydrophobicContact CD1-CZ 4.26Å; L155-F192 HydrophobicContact CD2-CB 3.85Å; L155-F192 HydrophobicContact CD2-CD1 3.73Å; L155-F192 HydrophobicContact CD2-CD2 3.96Å; L155-F192 HydrophobicContact CD2-CE1 4.29Å; L155-F192 HydrophobicContact CD2-CE2 4.5Å; L155-F192 HydrophobicContact CD2-CG 3.54Å; L155-F192 HydrophobicContact CG-CB 4.07Å; L155-F192 HydrophobicContact CG-CD1 4.31Å; L155-F192 HydrophobicContact CG-CD2 3.61Å; L155-F192 HydrophobicContact CG-CE2 4.13Å; L155-F192 HydrophobicContact CG-CG 3.71Å
156S91.3Very high87.6Confident7 Ų753.5 Ų53.55%0.04924%0.24CC..Hα-helixtrans-63.2-40.8173.5-1570000110.6A125 G152 F153 K159 W160A125-S156 WeakPolarHBondContact O-CB 3.3Å; A125-S156 PolarHBondContact O-OG 3.36Å; A125-S156 VanDerWaalsContact O-OG 3.13Å; G152-S156 WeakPolarHBondContact O-CB 3.32Å; G152-S156 PolarHBondContact O-N 3.46Å; F153-S156 WeakPolarHBondContact O-CB 3.45Å; F153-S156 PolarHBondContact O-N 2.62Å; S156-K159 PolarHBondContact O-N 3.37Å; S156-W160 VanDerWaalsContact O-CB 3.31Å; S156-W160 WeakPolarHBondContact O-CB 3.21Å; S156-W160 PolarHBondContact O-N 3.37Å
157L88.3Confident87.2Confident30 Ų3050.9 Ų50.916%0.15724%0.24CC..Hα-helixtrans-61-49170.3-74.1177.1000111.4F153 G154 L155 K159 W160 I161 L191F153-L157 HydrophobicContact CD1-CD1 3.81Å; F153-L157 HydrophobicContact CD1-CG 4.31Å; F153-L157 HydrophobicContact CD2-CG 4.34Å; F153-L157 HydrophobicContact CE1-CD1 3.32Å; F153-L157 HydrophobicContact CE1-CG 3.97Å; F153-L157 HydrophobicContact CE2-CD1 4.24Å; F153-L157 HydrophobicContact CE2-CD2 4.06Å; F153-L157 HydrophobicContact CE2-CG 3.98Å; F153-L157 HydrophobicContact CG-CD1 4.46Å; F153-L157 HydrophobicContact CG-CG 4.5Å; F153-L157 HydrophobicContact CZ-CD1 3.57Å; F153-L157 HydrophobicContact CZ-CD2 3.88Å; F153-L157 HydrophobicContact CZ-CG 3.79Å; F153-L157 WeakPolarHBondContact O-CB 2.97Å; F153-L157 WeakPolarHBondContact O-CG 3.27Å; F153-L157 PolarHBondContact O-N 3.48Å; G154-L157 WeakPolarHBondContact O-CB 3.2Å; G154-L157 PolarHBondContact O-N 3.47Å; L155-L157 VanDerWaalsContact C-N 3.31Å; L157-K159 VanDerWaalsContact C-N 3.35Å; L157-K159 PolarHBondContact O-N 2.75Å; L157-W160 CarbonylContact O-C 3.5Å; L157-W160 WeakPolarHBondContact O-CB 3.33Å; L157-W160 PolarHBondContact O-N 2.78Å; L157-W160 VanDerWaalsContact O-N 3.13Å; L157-I161 WeakPolarHBondContact O-CB 3.48Å; L157-I161 WeakPolarHBondContact O-CG1 3.28Å; L157-I161 PolarHBondContact O-N 2.86Å; L157-L191 HydrophobicContact CD1-CD1 4.31Å
158I90.2Very high86.2Confident28 Ų2847.2 Ų47.214%0.14423%0.23CC..Hα-helixtrans-58.9-47.2177.9-67.7158.1000110.9G154 L155 W160 I161 L162 F189G154-I158 VanDerWaalsContact O-CG1 3.31Å; G154-I158 WeakPolarHBondContact O-CG1 3.35Å; G154-I158 PolarHBondContact O-N 2.82Å; L155-I158 HydrophobicContact CD2-CD1 3.7Å; L155-I158 PolarHBondContact O-N 3.05Å; I158-W160 VanDerWaalsContact C-N 3.26Å; I158-W160 PolarHBondContact O-N 2.7Å; I158-I161 PolarHBondContact O-N 3.36Å; I158-L162 HydrophobicContact CG2-CD1 4.21Å; I158-L162 HydrophobicContact CG2-CG 4.48Å; I158-L162 WeakPolarHBondContact O-CG 3.42Å; I158-L162 PolarHBondContact O-N 3.13Å; I158-F189 HydrophobicContact CD1-CB 4.03Å
159K87.8Confident85Confident97 Ų9754.4 Ų54.442%0.42226%0.258SS..Hα-helixtrans-58.1-40.5176.4178.6179170-177.90111.4F126 L155 S156 L157 L162 I163F126-K159 HydrophobicContact CE2-CB 4.35Å; F126-K159 HydrophobicContact CE2-CD 3.98Å; F126-K159 HydrophobicContact CZ-CD 4.27Å; L155-K159 VanDerWaalsContact O-CB 3.32Å; L155-K159 WeakPolarHBondContact O-CB 3.47Å; L155-K159 PolarHBondContact O-N 2.7Å; S156-K159 PolarHBondContact O-N 3.37Å; L157-K159 VanDerWaalsContact C-N 3.35Å; L157-K159 PolarHBondContact O-N 2.75Å; K159-L162 PolarHBondContact O-N 3.3Å; K159-I163 PolarHBondContact O-N 3.2Å
160W89.5Confident83.5Confident102 Ų10262.5 Ų62.539%0.38629%0.294SS..Hα-helixtrans-69.8-42.6175.9-176.284.4000112.4S156 L157 I158 L162 I163 V164S156-W160 VanDerWaalsContact O-CB 3.31Å; S156-W160 WeakPolarHBondContact O-CB 3.21Å; S156-W160 PolarHBondContact O-N 3.37Å; L157-W160 CarbonylContact O-C 3.5Å; L157-W160 WeakPolarHBondContact O-CB 3.33Å; L157-W160 PolarHBondContact O-N 2.78Å; L157-W160 VanDerWaalsContact O-N 3.13Å; I158-W160 VanDerWaalsContact C-N 3.26Å; I158-W160 PolarHBondContact O-N 2.7Å; W160-L162 PolarHBondContact O-N 3.48Å; W160-I163 HydrophobicContact CG-CG2 4.48Å; W160-I163 WeakPolarHBondContact O-CG2 3.5Å; W160-I163 PolarHBondContact O-N 3.17Å; W160-V164 HydrophobicContact CD2-CG2 3.9Å; W160-V164 HydrophobicContact CE3-CG2 4.06Å; W160-V164 HydrophobicContact CH2-CG2 3.87Å; W160-V164 HydrophobicContact CZ2-CG2 3.69Å; W160-V164 HydrophobicContact CZ3-CG2 4.05Å; W160-V164 WeakPolarHBondContact O-CG2 3.41Å; W160-V164 PolarHBondContact O-N 3.37Å
161I86.8Confident81.9Confident11 Ų1164.8 Ų64.86%0.05631%0.313CS..Hα-helixtrans-62.9-33.6175.8-67.2-66.4000111.1L157 I158 R165 W181 F184L157-I161 WeakPolarHBondContact O-CB 3.48Å; L157-I161 WeakPolarHBondContact O-CG1 3.28Å; L157-I161 PolarHBondContact O-N 2.86Å; I158-I161 PolarHBondContact O-N 3.36Å; I161-R165 VanDerWaalsContact O-CB 3.3Å; I161-R165 WeakPolarHBondContact O-CB 3.17Å; I161-R165 PolarHBondContact O-N 3.14Å; I161-W181 VanDerWaalsContact CG2-CD1 3.44Å; I161-W181 HydrophobicContact CG2-CG 4.33Å; I161-W181 PolarHBondContact O-NE1 2.95Å; I161-F184 HydrophobicContact CD1-CB 3.75Å; I161-F184 HydrophobicContact CD1-CD2 4.38Å; I161-F184 HydrophobicContact CD1-CG 4.04Å; I161-F184 HydrophobicContact CG1-CB 4.05Å
162L85Confident80.5Confident78 Ų7867.6 Ų67.641%0.40834%0.342SS..Hα-helixtrans-67.6-42.3170.4-70.6174.5000112.1I158 K159 W160 V164 R165 F166 W181I158-L162 HydrophobicContact CG2-CD1 4.21Å; I158-L162 HydrophobicContact CG2-CG 4.48Å; I158-L162 WeakPolarHBondContact O-CG 3.42Å; I158-L162 PolarHBondContact O-N 3.13Å; K159-L162 PolarHBondContact O-N 3.3Å; W160-L162 PolarHBondContact O-N 3.48Å; L162-V164 VanDerWaalsContact C-N 3.33Å; L162-V164 PolarHBondContact O-N 3.22Å; L162-R165 WeakPolarHBondContact O-CB 3.15Å; L162-R165 PolarHBondContact O-N 2.82Å; L162-F166 VanDerWaalsContact O-CD2 3.29Å; L162-F166 WeakPolarHBondContact O-CD2 3.44Å; L162-F166 PolarHBondContact O-N 3.33Å; L162-W181 HydrophobicContact CD2-CZ2 4.37Å
163I84.5Confident78.9Confident94 Ų9477.4 Ų77.448%0.48238%0.381SS..Hα-helixtrans-64.4-40.8176.1-152.776.8000111.3K159 W160 R165 F166 S167K159-I163 PolarHBondContact O-N 3.2Å; W160-I163 HydrophobicContact CG-CG2 4.48Å; W160-I163 WeakPolarHBondContact O-CG2 3.5Å; W160-I163 PolarHBondContact O-N 3.17Å; I163-R165 VanDerWaalsContact C-N 3.32Å; I163-R165 PolarHBondContact O-N 3Å; I163-F166 PolarHBondContact O-N 3.31Å; I163-S167 WeakPolarHBondContact O-CB 3.37Å; I163-S167 PolarHBondContact O-N 3.31Å
164V82.1Confident77.2Confident40 Ų4079 Ų7924%0.24239%0.388CS..Hα-helixtrans-60.5-45.2174171.90000109.2W160 L162 F166 S167 T168W160-V164 HydrophobicContact CD2-CG2 3.9Å; W160-V164 HydrophobicContact CE3-CG2 4.06Å; W160-V164 HydrophobicContact CH2-CG2 3.87Å; W160-V164 HydrophobicContact CZ2-CG2 3.69Å; W160-V164 HydrophobicContact CZ3-CG2 4.05Å; W160-V164 WeakPolarHBondContact O-CG2 3.41Å; W160-V164 PolarHBondContact O-N 3.37Å; L162-V164 VanDerWaalsContact C-N 3.33Å; L162-V164 PolarHBondContact O-N 3.22Å; V164-F166 PolarHBondContact O-N 3.49Å; V164-S167 CarbonylContact O-C 3.56Å; V164-S167 PolarHBondContact O-N 3.3Å; V164-S167 VanDerWaalsContact O-N 3.09Å; V164-T168 HydrophobicContact CG1-CG2 3.98Å; V164-T168 WeakPolarHBondContact O-CB 3.44Å; V164-T168 WeakPolarHBondContact O-CG2 3.16Å; V164-T168 PolarHBondContact O-N 3.32Å; V164-T168 PolarHBondContact O-OG1 3.25Å
165R78.4Confident75.8Confident82 Ų8285.4 Ų85.431%0.30942%0.422SS..Hα-helixtrans-60.4-41.6178.4-177.564.2-172.486.31.2113.8I161 L162 I163 Y169 W181I161-R165 VanDerWaalsContact O-CB 3.3Å; I161-R165 WeakPolarHBondContact O-CB 3.17Å; I161-R165 PolarHBondContact O-N 3.14Å; L162-R165 WeakPolarHBondContact O-CB 3.15Å; L162-R165 PolarHBondContact O-N 2.82Å; I163-R165 VanDerWaalsContact C-N 3.32Å; I163-R165 PolarHBondContact O-N 3Å; R165-Y169 VanDerWaalsContact CZ-CD2 3.45Å; R165-Y169 VanDerWaalsContact CZ-CE2 3.49Å; R165-Y169 VanDerWaalsContact NH1-CE2 3.33Å; R165-Y169 PolarHBondContact O-N 2.88Å; R165-Y169 VanDerWaalsContact O-N 3.16Å; R165-W181 HydrophobicContact CB-CZ2 4.23Å; R165-W181 HydrophobicContact CG-CZ2 3.91Å
166F78.5Confident75Confident166 Ų16687 Ų8773%0.72845%0.447SS*.Hα-helixtrans-68-37.7174.3-85.1-73.5000111.3L162 I163 V164L162-F166 VanDerWaalsContact O-CD2 3.29Å; L162-F166 WeakPolarHBondContact O-CD2 3.44Å; L162-F166 PolarHBondContact O-N 3.33Å; I163-F166 PolarHBondContact O-N 3.31Å; V164-F166 PolarHBondContact O-N 3.49Å
167S77.2Confident74.2Confident67 Ų6791.2 Ų91.247%0.46947%0.466SS..Hα-helixtrans-73.5-32.2178.1-167.30000113.3I163 V164I163-S167 WeakPolarHBondContact O-CB 3.37Å; I163-S167 PolarHBondContact O-N 3.31Å; V164-S167 CarbonylContact O-C 3.56Å; V164-S167 PolarHBondContact O-N 3.3Å; V164-S167 VanDerWaalsContact O-N 3.09Å
168T66.8Low73.7Confident39 Ų3996.2 Ų96.224%0.23948%0.484CS..THydrogen-bonded Turntrans-97.813-179.165.90000112.9V164 F170 F174V164-T168 HydrophobicContact CG1-CG2 3.98Å; V164-T168 WeakPolarHBondContact O-CB 3.44Å; V164-T168 WeakPolarHBondContact O-CG2 3.16Å; V164-T168 PolarHBondContact O-N 3.32Å; V164-T168 PolarHBondContact O-OG1 3.25Å; T168-F170 PolarHBondContact O-N 2.79Å; T168-F174 HydrophobicContact CG2-CD2 4.35Å; T168-F174 HydrophobicContact CG2-CE2 3.47Å; T168-F174 VanDerWaalsContact CG2-CE2 3.47Å; T168-F174 HydrophobicContact CG2-CZ 3.76Å
169Y64.6Low73.5Confident151 Ų151103.4 Ų103.459%0.59251%0.509SS*.  trans-63.94.1169.8-145.6-78.5000112.7R165 P171R165-Y169 VanDerWaalsContact CZ-CD2 3.45Å; R165-Y169 VanDerWaalsContact CZ-CE2 3.49Å; R165-Y169 VanDerWaalsContact NH1-CE2 3.33Å; R165-Y169 PolarHBondContact O-N 2.88Å; R165-Y169 VanDerWaalsContact O-N 3.16Å; Y169-P171 WeakPolarHBondContact O-CD 3.26Å
170F60Low73.3Confident171 Ų171102.8 Ų102.875%0.7551%0.51SS*.SBendtrans-57.3112161.1-88.1-80.2000108.6T168 G172T168-F170 PolarHBondContact O-N 2.79Å; F170-G172 PolarHBondContact O-N 3.36Å
171P57.3Low73.1Confident119 Ų119101.2 Ų101.277%0.77350%0.504SS*.THydrogen-bonded Turntrans-73.420.9-154.728.9-37.2000115.7Y169Y169-P171 WeakPolarHBondContact O-CD 3.26Å
172G60.5Low73.3Confident59 Ų59108.2 Ų108.261%0.60853%0.53SS*.THydrogen-bonded Turntrans-135.1-0.7-171.100000117.1F170F170-G172 PolarHBondContact O-N 3.36Å
173Y57.7Low73.5Confident207 Ų207107.8 Ų107.881%0.81253%0.53SS*.SBendtrans-108.5-11.9-172.7-118.8-90.5000115.7
174F55.7Low73.8Confident75 Ų75107.6 Ų107.633%0.32953%0.526SS..  trans-121.111-170.5-76.5-93.1000115.3T168 G176 Q177 Y178T168-F174 HydrophobicContact CG2-CD2 4.35Å; T168-F174 HydrophobicContact CG2-CE2 3.47Å; T168-F174 VanDerWaalsContact CG2-CE2 3.47Å; T168-F174 HydrophobicContact CG2-CZ 3.76Å; F174-G176 PolarHBondContact O-N 3.46Å; F174-Q177 HydrophobicContact CD1-CB 3.67Å; F174-Q177 HydrophobicContact CD1-CG 4.49Å; F174-Q177 HydrophobicContact CE1-CB 4.34Å; F174-Q177 PolarHBondContact O-N 3.31Å; F174-Y178 PolarHBondContact O-N 3.37Å
175D62.3Low74.2Confident134 Ų134107.9 Ų107.972%0.71753%0.526SS*.THydrogen-bonded Turntrans-59.9-19.1176-71.5-29.4000113.3Y178D175-Y178 WeakPolarHBondContact O-CD1 2.98Å; D175-Y178 WeakPolarHBondContact O-CE1 3.2Å
176G70.6Confident74.9Confident69 Ų69106.5 Ų106.571%0.71153%0.527SS*.THydrogen-bonded Turntrans-93.8-17.4171.500000114.9F174F174-G176 PolarHBondContact O-N 3.46Å
177Q74.2Confident75.5Confident96 Ų96102.4 Ų102.445%0.44951%0.512SS..THydrogen-bonded Turntrans-112.14.7-168.9-73.1-1731.600113.8F174 W179 L180 W181F174-Q177 HydrophobicContact CD1-CB 3.67Å; F174-Q177 HydrophobicContact CD1-CG 4.49Å; F174-Q177 HydrophobicContact CE1-CB 4.34Å; F174-Q177 PolarHBondContact O-N 3.31Å; Q177-W179 PolarHBondContact O-N 3.36Å; Q177-W179 VanDerWaalsContact O-N 3.16Å; Q177-L180 WeakPolarHBondContact O-CB 3.4Å; Q177-L180 PolarHBondContact O-N 3.1Å; Q177-W181 PolarHBondContact O-N 3.07Å
178Y78.9Confident76.2Confident135 Ų13599.2 Ų99.253%0.52949%0.49SS..Hα-helixtrans-52-35.9171.763.9-86000112.1F174 D175 W181 W182F174-Y178 PolarHBondContact O-N 3.37Å; D175-Y178 WeakPolarHBondContact O-CD1 2.98Å; D175-Y178 WeakPolarHBondContact O-CE1 3.2Å; Y178-W181 PolarHBondContact O-N 3.32Å; Y178-W182 WeakPolarHBondContact O-CB 3.4Å; Y178-W182 PolarHBondContact O-N 2.96Å
179W85.7Confident77.4Confident180 Ų180102 Ų10268%0.68250%0.499SS*.Hα-helixtrans-63.1-46.6176.7-155.7-73.3000111.1Q177 W181 W182 V183Q177-W179 PolarHBondContact O-N 3.36Å; Q177-W179 VanDerWaalsContact O-N 3.16Å; W179-W181 VanDerWaalsContact C-N 3.32Å; W179-W181 PolarHBondContact O-N 3.45Å; W179-W182 PolarHBondContact O-N 3.35Å; W179-V183 WeakPolarHBondContact O-CB 3.29Å; W179-V183 VanDerWaalsContact O-CG2 3.25Å; W179-V183 WeakPolarHBondContact O-CG2 3.18Å; W179-V183 PolarHBondContact O-N 3.18Å
180L83.2Confident78.7Confident84 Ų8499.5 Ų99.544%0.4450%0.495SS..Hα-helixtrans-63.1-40.2177.6-167.974.7000111.1Q177 V183 F184Q177-L180 WeakPolarHBondContact O-CB 3.4Å; Q177-L180 PolarHBondContact O-N 3.1Å; L180-V183 PolarHBondContact O-N 3.48Å; L180-F184 HydrophobicContact CD1-CD2 4.33Å; L180-F184 HydrophobicContact CD1-CE2 3.84Å; L180-F184 HydrophobicContact CD2-CD2 4.33Å; L180-F184 HydrophobicContact CD2-CE2 3.76Å; L180-F184 HydrophobicContact CG-CD2 3.75Å; L180-F184 HydrophobicContact CG-CE2 3.5Å; L180-F184 VanDerWaalsContact CG-CE2 3.5Å; L180-F184 WeakPolarHBondContact O-CD2 3.21Å; L180-F184 PolarHBondContact O-N 3.39Å
181W85.9Confident80.1Confident68 Ų6893.6 Ų93.626%0.25847%0.471SS..Hα-helixtrans-62.6-44.6175.2-175.782.2000112.1I161 L162 R165 Q177 Y178 W179 V183 F184 L185I161-W181 VanDerWaalsContact CG2-CD1 3.44Å; I161-W181 HydrophobicContact CG2-CG 4.33Å; I161-W181 PolarHBondContact O-NE1 2.95Å; L162-W181 HydrophobicContact CD2-CZ2 4.37Å; R165-W181 HydrophobicContact CB-CZ2 4.23Å; R165-W181 HydrophobicContact CG-CZ2 3.91Å; Q177-W181 PolarHBondContact O-N 3.07Å; Y178-W181 PolarHBondContact O-N 3.32Å; W179-W181 VanDerWaalsContact C-N 3.32Å; W179-W181 PolarHBondContact O-N 3.45Å; W181-V183 VanDerWaalsContact C-N 3.35Å; W181-F184 PolarHBondContact O-N 2.86Å; W181-L185 HydrophobicContact CE3-CD1 4.44Å; W181-L185 HydrophobicContact CH2-CD1 3.53Å; W181-L185 HydrophobicContact CZ2-CD1 3.97Å; W181-L185 HydrophobicContact CZ3-CD1 3.79Å; W181-L185 WeakPolarHBondContact O-CB 3.43Å; W181-L185 PolarHBondContact O-N 2.69Å
182W89.7Confident81.7Confident158 Ų15889.7 Ų89.760%0.59844%0.442SS*.Hα-helixtrans-60.7-44.1173.3-108.698.6000111.8Y178 W179 L185 V186Y178-W182 WeakPolarHBondContact O-CB 3.4Å; Y178-W182 PolarHBondContact O-N 2.96Å; W179-W182 PolarHBondContact O-N 3.35Å; W182-L185 PolarHBondContact O-N 3.11Å; W182-V186 HydrophobicContact CE3-CG2 3.52Å; W182-V186 HydrophobicContact CZ3-CG2 3.69Å; W182-V186 WeakPolarHBondContact O-CB 3.34Å; W182-V186 VanDerWaalsContact O-CG2 3.29Å; W182-V186 WeakPolarHBondContact O-CG2 3.05Å; W182-V186 PolarHBondContact O-N 2.75Å
183V90.8Very high83.1Confident69 Ų6989.2 Ų89.242%0.41843%0.425SS..Hα-helixtrans-61.9-45.1176.4170.40000110.5W179 L180 W181 V186 L187W179-V183 WeakPolarHBondContact O-CB 3.29Å; W179-V183 VanDerWaalsContact O-CG2 3.25Å; W179-V183 WeakPolarHBondContact O-CG2 3.18Å; W179-V183 PolarHBondContact O-N 3.18Å; L180-V183 PolarHBondContact O-N 3.48Å; W181-V183 VanDerWaalsContact C-N 3.35Å; V183-V186 PolarHBondContact O-N 3.17Å; V183-L187 WeakPolarHBondContact O-CA 3.22Å; V183-L187 WeakPolarHBondContact O-CB 3.48Å; V183-L187 PolarHBondContact O-N 2.79Å
184F89Confident84.6Confident90 Ų9088.2 Ų88.240%0.39542%0.42SS..Hα-helixtrans-67-37.5177.8-83-60.4000113.1I161 L180 W181 L187 G188I161-F184 HydrophobicContact CD1-CB 3.75Å; I161-F184 HydrophobicContact CD1-CD2 4.38Å; I161-F184 HydrophobicContact CD1-CG 4.04Å; I161-F184 HydrophobicContact CG1-CB 4.05Å; L180-F184 HydrophobicContact CD1-CD2 4.33Å; L180-F184 HydrophobicContact CD1-CE2 3.84Å; L180-F184 HydrophobicContact CD2-CD2 4.33Å; L180-F184 HydrophobicContact CD2-CE2 3.76Å; L180-F184 HydrophobicContact CG-CD2 3.75Å; L180-F184 HydrophobicContact CG-CE2 3.5Å; L180-F184 VanDerWaalsContact CG-CE2 3.5Å; L180-F184 WeakPolarHBondContact O-CD2 3.21Å; L180-F184 PolarHBondContact O-N 3.39Å; W181-F184 PolarHBondContact O-N 2.86Å; F184-L187 HydrophobicContact CD1-CD2 4.48Å; F184-G188 PolarHBondContact O-N 3.35Å
185L90.3Very high86.1Confident46 Ų4684.9 Ų84.924%0.24141%0.406CS..Hα-helixtrans-64.3-53175.1-169.2170.9000110W181 W182 L187 G188 F189W181-L185 HydrophobicContact CE3-CD1 4.44Å; W181-L185 HydrophobicContact CH2-CD1 3.53Å; W181-L185 HydrophobicContact CZ2-CD1 3.97Å; W181-L185 HydrophobicContact CZ3-CD1 3.79Å; W181-L185 WeakPolarHBondContact O-CB 3.43Å; W181-L185 PolarHBondContact O-N 2.69Å; W182-L185 PolarHBondContact O-N 3.11Å; L185-L187 VanDerWaalsContact C-N 3.32Å; L185-L187 PolarHBondContact O-N 3.19Å; L185-G188 PolarHBondContact O-N 3.2Å; L185-F189 VanDerWaalsContact O-CB 3.28Å; L185-F189 WeakPolarHBondContact O-CB 3.15Å; L185-F189 PolarHBondContact O-N 2.97Å
186V93.2Very high87.3Confident54 Ų5482.8 Ų82.833%0.32739%0.391SS..Hα-helixtrans-61.7-41.8178.2171.60000110.4W182 V183 F189 L190W182-V186 HydrophobicContact CE3-CG2 3.52Å; W182-V186 HydrophobicContact CZ3-CG2 3.69Å; W182-V186 WeakPolarHBondContact O-CB 3.34Å; W182-V186 VanDerWaalsContact O-CG2 3.29Å; W182-V186 WeakPolarHBondContact O-CG2 3.05Å; W182-V186 PolarHBondContact O-N 2.75Å; V183-V186 PolarHBondContact O-N 3.17Å; V186-F189 CarbonylContact O-C 3.6Å; V186-F189 PolarHBondContact O-N 2.91Å; V186-L190 HydrophobicContact CG1-CD1 3.65Å; V186-L190 HydrophobicContact CG1-CG 3.94Å; V186-L190 VanDerWaalsContact O-CB 3.26Å; V186-L190 WeakPolarHBondContact O-CB 3.06Å; V186-L190 WeakPolarHBondContact O-CG 3.49Å; V186-L190 PolarHBondContact O-N 3.14Å
187L91.6Very high88Confident80 Ų8084.4 Ų84.442%0.41938%0.383SS..Hα-helixtrans-63-48.6177.7179.864.4000111.7V183 F184 L185 F189 L190 L191V183-L187 WeakPolarHBondContact O-CA 3.22Å; V183-L187 WeakPolarHBondContact O-CB 3.48Å; V183-L187 PolarHBondContact O-N 2.79Å; F184-L187 HydrophobicContact CD1-CD2 4.48Å; L185-L187 VanDerWaalsContact C-N 3.32Å; L185-L187 PolarHBondContact O-N 3.19Å; L187-F189 VanDerWaalsContact C-N 3.27Å; L187-F189 PolarHBondContact O-N 3.4Å; L187-L190 PolarHBondContact O-N 2.87Å; L187-L191 HydrophobicContact CD1-CD1 4.42Å; L187-L191 HydrophobicContact CD1-CG 4.42Å; L187-L191 HydrophobicContact CG-CD1 4.21Å; L187-L191 WeakPolarHBondContact O-CB 3.44Å; L187-L191 VanDerWaalsContact O-CG 3.27Å; L187-L191 WeakPolarHBondContact O-CG 3Å; L187-L191 PolarHBondContact O-N 3.42Å
188G92.5Very high88.5Confident0 Ų082.3 Ų82.30%037%0.374CS..Hα-helixtrans-61-39.2175.900000111.9G154 F184 L185 F192G154-G188 CarbonylContact C-O 3.58Å; G154-G188 WeakPolarHBondContact CA-O 3.05Å; F184-G188 PolarHBondContact O-N 3.35Å; L185-G188 PolarHBondContact O-N 3.2Å; G188-F192 PolarHBondContact O-N 3.43Å
189F91.6Very high88.6Confident98 Ų9877.2 Ų77.243%0.4335%0.354SS..Hα-helixtrans-67.5-43175.3-176.1-105000112.4I158 L185 V186 L187 F192 L193I158-F189 HydrophobicContact CD1-CB 4.03Å; L185-F189 VanDerWaalsContact O-CB 3.28Å; L185-F189 WeakPolarHBondContact O-CB 3.15Å; L185-F189 PolarHBondContact O-N 2.97Å; V186-F189 CarbonylContact O-C 3.6Å; V186-F189 PolarHBondContact O-N 2.91Å; L187-F189 VanDerWaalsContact C-N 3.27Å; L187-F189 PolarHBondContact O-N 3.4Å; F189-F192 WeakPolarHBondContact O-CB 3.3Å; F189-F192 PolarHBondContact O-N 3.33Å; F189-L193 HydrophobicContact CD1-CD1 3.91Å; F189-L193 HydrophobicContact CD1-CD2 4.17Å; F189-L193 HydrophobicContact CD2-CD1 3.85Å; F189-L193 HydrophobicContact CE1-CD1 3.51Å; F189-L193 HydrophobicContact CE1-CD2 3.49Å; F189-L193 VanDerWaalsContact CE1-CD2 3.49Å; F189-L193 HydrophobicContact CE1-CG 4.13Å; F189-L193 HydrophobicContact CE2-CD1 3.44Å; F189-L193 VanDerWaalsContact CE2-CD1 3.44Å; F189-L193 HydrophobicContact CG-CD1 4.09Å; F189-L193 HydrophobicContact CZ-CD1 3.26Å; F189-L193 HydrophobicContact CZ-CD2 3.88Å; F189-L193 HydrophobicContact CZ-CG 4.21Å; F189-L193 WeakPolarHBondContact O-CB 3.33Å; F189-L193 WeakPolarHBondContact O-CD1 3.27Å; F189-L193 PolarHBondContact O-N 3.5Å
190L91.6Very high88.2Confident97 Ų9769.7 Ų69.751%0.50833%0.33SS..Hα-helixtrans-66.9-36.7177.2-74.3177.5000111.6V186 L187 L193 R194V186-L190 HydrophobicContact CG1-CD1 3.65Å; V186-L190 HydrophobicContact CG1-CG 3.94Å; V186-L190 VanDerWaalsContact O-CB 3.26Å; V186-L190 WeakPolarHBondContact O-CB 3.06Å; V186-L190 WeakPolarHBondContact O-CG 3.49Å; V186-L190 PolarHBondContact O-N 3.14Å; L187-L190 PolarHBondContact O-N 2.87Å; L190-L193 PolarHBondContact O-N 3.01Å; L190-R194 WeakPolarHBondContact O-CB 3.15Å; L190-R194 PolarHBondContact O-N 3.25Å
191L89.7Confident87.9Confident48 Ų4871.7 Ų71.725%0.25134%0.336SS..Hα-helixtrans-64.6-44.1173-74170.8000111.2L157 L187 R194 G195L157-L191 HydrophobicContact CD1-CD1 4.31Å; L187-L191 HydrophobicContact CD1-CD1 4.42Å; L187-L191 HydrophobicContact CD1-CG 4.42Å; L187-L191 HydrophobicContact CG-CD1 4.21Å; L187-L191 WeakPolarHBondContact O-CB 3.44Å; L187-L191 VanDerWaalsContact O-CG 3.27Å; L187-L191 WeakPolarHBondContact O-CG 3Å; L187-L191 PolarHBondContact O-N 3.42Å; L191-R194 PolarHBondContact O-N 2.96Å; L191-G195 PolarHBondContact O-N 3.32Å
192F91.3Very high87.2Confident36 Ų3672.6 Ų72.616%0.15835%0.349CS..Hα-helixtrans-59.9-51.8172.7167.2-114.5000111.3F122 L155 G188 F189 R194 G195 F196F122-F192 HydrophobicContact CD2-CE2 4.49Å; F122-F192 AromaticContact CE2-CD2 3.73Å; F122-F192 HydrophobicContact CE2-CD2 3.73Å; F122-F192 AromaticContact CE2-CE2 3.42Å; F122-F192 HydrophobicContact CE2-CE2 3.42Å; F122-F192 VanDerWaalsContact CE2-CE2 3.42Å; F122-F192 HydrophobicContact CZ-CD2 4.41Å; F122-F192 AromaticContact CZ-CE2 3.75Å; F122-F192 HydrophobicContact CZ-CE2 3.75Å; L155-F192 HydrophobicContact CD1-CD2 3.85Å; L155-F192 HydrophobicContact CD1-CE2 3.84Å; L155-F192 HydrophobicContact CD1-CG 4.28Å; L155-F192 HydrophobicContact CD1-CZ 4.26Å; L155-F192 HydrophobicContact CD2-CB 3.85Å; L155-F192 HydrophobicContact CD2-CD1 3.73Å; L155-F192 HydrophobicContact CD2-CD2 3.96Å; L155-F192 HydrophobicContact CD2-CE1 4.29Å; L155-F192 HydrophobicContact CD2-CE2 4.5Å; L155-F192 HydrophobicContact CD2-CG 3.54Å; L155-F192 HydrophobicContact CG-CB 4.07Å; L155-F192 HydrophobicContact CG-CD1 4.31Å; L155-F192 HydrophobicContact CG-CD2 3.61Å; L155-F192 HydrophobicContact CG-CE2 4.13Å; L155-F192 HydrophobicContact CG-CG 3.71Å; G188-F192 PolarHBondContact O-N 3.43Å; F189-F192 WeakPolarHBondContact O-CB 3.3Å; F189-F192 PolarHBondContact O-N 3.33Å; F192-R194 VanDerWaalsContact C-N 3.35Å; F192-R194 PolarHBondContact O-N 3.02Å; F192-G195 PolarHBondContact O-N 3.44Å; F192-F196 HydrophobicContact CD2-CB 4.43Å; F192-F196 HydrophobicContact CE2-CB 4.07Å; F192-F196 HydrophobicContact CE2-CD2 4.16Å; F192-F196 HydrophobicContact CE2-CG 4.32Å; F192-F196 HydrophobicContact CZ-CB 4.25Å; F192-F196 HydrophobicContact CZ-CD2 4.18Å; F192-F196 HydrophobicContact CZ-CG 4.19Å; F192-F196 WeakPolarHBondContact O-CB 3.42Å; F192-F196 PolarHBondContact O-N 3.18Å
193L89.9Confident86.3Confident50 Ų5071.5 Ų71.526%0.26234%0.344SS..Hα-helixtrans-60-43.1178.7-100.265000111.6F189 L190 F196 I197F189-L193 HydrophobicContact CD1-CD1 3.91Å; F189-L193 HydrophobicContact CD1-CD2 4.17Å; F189-L193 HydrophobicContact CD2-CD1 3.85Å; F189-L193 HydrophobicContact CE1-CD1 3.51Å; F189-L193 HydrophobicContact CE1-CD2 3.49Å; F189-L193 VanDerWaalsContact CE1-CD2 3.49Å; F189-L193 HydrophobicContact CE1-CG 4.13Å; F189-L193 HydrophobicContact CE2-CD1 3.44Å; F189-L193 VanDerWaalsContact CE2-CD1 3.44Å; F189-L193 HydrophobicContact CG-CD1 4.09Å; F189-L193 HydrophobicContact CZ-CD1 3.26Å; F189-L193 HydrophobicContact CZ-CD2 3.88Å; F189-L193 HydrophobicContact CZ-CG 4.21Å; F189-L193 WeakPolarHBondContact O-CB 3.33Å; F189-L193 WeakPolarHBondContact O-CD1 3.27Å; F189-L193 PolarHBondContact O-N 3.5Å; L190-L193 PolarHBondContact O-N 3.01Å; L193-F196 PolarHBondContact O-N 2.75Å; L193-I197 HydrophobicContact CB-CD1 4.21Å; L193-I197 WeakPolarHBondContact O-CA 3.17Å; L193-I197 WeakPolarHBondContact O-CB 3.42Å; L193-I197 WeakPolarHBondContact O-CD1 3.33Å; L193-I197 WeakPolarHBondContact O-CG1 3.28Å; L193-I197 PolarHBondContact O-N 3.2Å
194R88.3Confident84.9Confident186 Ų18675.8 Ų75.870%0.70236%0.357SS*.Hα-helixtrans-62.6-47.6179.7-177.1178.6173.9115.5-3.3111L190 L191 F192 N198L190-R194 WeakPolarHBondContact O-CB 3.15Å; L190-R194 PolarHBondContact O-N 3.25Å; L191-R194 PolarHBondContact O-N 2.96Å; F192-R194 VanDerWaalsContact C-N 3.35Å; F192-R194 PolarHBondContact O-N 3.02Å; R194-N198 WeakPolarHBondContact O-CB 3.43Å; R194-N198 PolarHBondContact O-N 2.75Å
195G88.2Confident83.3Confident4 Ų476 Ų764%0.04136%0.361CS..Hα-helixtrans-66.2-40.2176.900000112.5L191 F192 N198 Y199L191-G195 PolarHBondContact O-N 3.32Å; F192-G195 PolarHBondContact O-N 3.44Å; G195-N198 PolarHBondContact O-N 3.02Å; G195-Y199 PolarHBondContact O-N 3.28Å
196F86.8Confident81.5Confident90 Ų9077.3 Ų77.340%0.39537%0.372SS..Hα-helixtrans-69.9-41.4178.3-173.2-97.2000112.9F192 L193 N198 Y199 A200F192-F196 HydrophobicContact CD2-CB 4.43Å; F192-F196 HydrophobicContact CE2-CB 4.07Å; F192-F196 HydrophobicContact CE2-CD2 4.16Å; F192-F196 HydrophobicContact CE2-CG 4.32Å; F192-F196 HydrophobicContact CZ-CB 4.25Å; F192-F196 HydrophobicContact CZ-CD2 4.18Å; F192-F196 HydrophobicContact CZ-CG 4.19Å; F192-F196 WeakPolarHBondContact O-CB 3.42Å; F192-F196 PolarHBondContact O-N 3.18Å; L193-F196 PolarHBondContact O-N 2.75Å; F196-N198 VanDerWaalsContact C-N 3.32Å; F196-Y199 PolarHBondContact O-N 3.48Å; F196-A200 HydrophobicContact CE1-CB 4.45Å; F196-A200 WeakPolarHBondContact O-CB 3.1Å; F196-A200 PolarHBondContact O-N 3.36Å
197I86.5Confident79.5Confident104 Ų10481.6 Ų81.653%0.53339%0.388SS..Hα-helixtrans-64-41.7175.5-71.2163.4000109.5L193 A200 K201L193-I197 HydrophobicContact CB-CD1 4.21Å; L193-I197 WeakPolarHBondContact O-CA 3.17Å; L193-I197 WeakPolarHBondContact O-CB 3.42Å; L193-I197 WeakPolarHBondContact O-CD1 3.33Å; L193-I197 WeakPolarHBondContact O-CG1 3.28Å; L193-I197 PolarHBondContact O-N 3.2Å; I197-A200 PolarHBondContact O-N 3.41Å; I197-K201 WeakPolarHBondContact O-CB 3.37Å; I197-K201 PolarHBondContact O-N 3.26Å
198N84.3Confident77.5Confident51 Ų5182.2 Ų82.227%0.27340%0.396SS..Hα-helixtrans-61.9-45.8177-166.541.1000111.3Y147 R194 G195 F196 K201 V202Y147-N198 WeakPolarHBondContact CD1-ND2 3.31Å; Y147-N198 WeakPolarHBondContact CE1-ND2 3.45Å; Y147-N198 VanDerWaalsContact CZ-ND2 3.3Å; R194-N198 WeakPolarHBondContact O-CB 3.43Å; R194-N198 PolarHBondContact O-N 2.75Å; G195-N198 PolarHBondContact O-N 3.02Å; F196-N198 VanDerWaalsContact C-N 3.32Å; N198-K201 WeakPolarHBondContact O-CB 3.31Å; N198-K201 PolarHBondContact O-N 3.14Å; N198-V202 WeakPolarHBondContact O-CG2 3.36Å; N198-V202 PolarHBondContact O-N 3.42Å
199Y80.2Confident75.4Confident28 Ų2889.2 Ų89.211%0.1143%0.426CS..Hα-helixtrans-63.6-45.8174.4172-106.2000113D115 F118 M119 G195 F196 K201 V202 R203D115-Y199 VanDerWaalsContact CB-OH 3.29Å; D115-Y199 WeakPolarHBondContact CB-OH 3.35Å; D115-Y199 VanDerWaalsContact CG-OH 3.27Å; D115-Y199 PolarHBondContact OD1-OH 3.27Å; F118-Y199 HydrophobicContact CB-CD2 3.79Å; F118-Y199 HydrophobicContact CB-CE2 3.55Å; F118-Y199 AromaticContact CD1-CD1 3.54Å; F118-Y199 HydrophobicContact CD1-CD1 3.54Å; F118-Y199 AromaticContact CD1-CD2 3.56Å; F118-Y199 HydrophobicContact CD1-CD2 3.56Å; F118-Y199 AromaticContact CD1-CE1 3.46Å; F118-Y199 HydrophobicContact CD1-CE1 3.46Å; F118-Y199 VanDerWaalsContact CD1-CE1 3.46Å; F118-Y199 AromaticContact CD1-CE2 3.52Å; F118-Y199 HydrophobicContact CD1-CE2 3.52Å; F118-Y199 AromaticContact CD1-CG 3.57Å; F118-Y199 HydrophobicContact CD1-CG 3.57Å; F118-Y199 AromaticContact CD1-CZ 3.45Å; F118-Y199 VanDerWaalsContact CD1-CZ 3.45Å; F118-Y199 HydrophobicContact CD2-CD1 4.36Å; F118-Y199 AromaticContact CD2-CD2 3.4Å; F118-Y199 HydrophobicContact CD2-CD2 3.4Å; F118-Y199 VanDerWaalsContact CD2-CD2 3.4Å; F118-Y199 HydrophobicContact CD2-CE2 4.07Å; F118-Y199 AromaticContact CD2-CG 3.58Å; F118-Y199 HydrophobicContact CD2-CG 3.58Å; F118-Y199 AromaticContact CE1-CD1 3.24Å; F118-Y199 HydrophobicContact CE1-CD1 3.24Å; F118-Y199 AromaticContact CE1-CD2 4Å; F118-Y199 HydrophobicContact CE1-CD2 4Å; F118-Y199 AromaticContact CE1-CE1 3.54Å; F118-Y199 HydrophobicContact CE1-CE1 3.54Å; F118-Y199 HydrophobicContact CE1-CE2 4.27Å; F118-Y199 AromaticContact CE1-CG 3.48Å; F118-Y199 HydrophobicContact CE1-CG 3.48Å; F118-Y199 VanDerWaalsContact CE1-CG 3.48Å; F118-Y199 HydrophobicContact CE2-CD1 4.12Å; F118-Y199 AromaticContact CE2-CD2 3.84Å; F118-Y199 HydrophobicContact CE2-CD2 3.84Å; F118-Y199 AromaticContact CE2-CG 3.48Å; F118-Y199 HydrophobicContact CE2-CG 3.48Å; F118-Y199 VanDerWaalsContact CE2-CG 3.48Å; F118-Y199 HydrophobicContact CG-CD1 4.11Å; F118-Y199 AromaticContact CG-CD2 3.26Å; F118-Y199 HydrophobicContact CG-CD2 3.26Å; F118-Y199 HydrophobicContact CG-CE1 4.21Å; F118-Y199 AromaticContact CG-CE2 3.41Å; F118-Y199 HydrophobicContact CG-CE2 3.41Å; F118-Y199 VanDerWaalsContact CG-CE2 3.41Å; F118-Y199 AromaticContact CG-CG 3.63Å; F118-Y199 HydrophobicContact CG-CG 3.63Å; F118-Y199 AromaticContact CG-CZ 3.88Å; F118-Y199 VanDerWaalsContact CZ-CB 3.47Å; F118-Y199 AromaticContact CZ-CD1 3.57Å; F118-Y199 HydrophobicContact CZ-CD1 3.57Å; F118-Y199 HydrophobicContact CZ-CD2 4.13Å; F118-Y199 HydrophobicContact CZ-CE1 4.31Å; F118-Y199 AromaticContact CZ-CG 3.44Å; F118-Y199 HydrophobicContact CZ-CG 3.44Å; F118-Y199 VanDerWaalsContact CZ-CG 3.44Å; M119-Y199 HydrophobicContact CE-CE1 4.06Å; G195-Y199 PolarHBondContact O-N 3.28Å; F196-Y199 PolarHBondContact O-N 3.48Å; Y199-K201 PolarHBondContact O-N 3.39Å; Y199-V202 PolarHBondContact O-N 2.83Å; Y199-R203 PolarHBondContact O-N 2.88Å; Y199-R203 PolarHBondContact OH-NE 2.95Å
200A76.8Confident73.4Confident22 Ų2288 Ų8818%0.18243%0.43CS..Hα-helixtrans-62.6-32.2177.100000111.9F196 I197 R203 K204F196-A200 HydrophobicContact CE1-CB 4.45Å; F196-A200 WeakPolarHBondContact O-CB 3.1Å; F196-A200 PolarHBondContact O-N 3.36Å; I197-A200 PolarHBondContact O-N 3.41Å; A200-R203 CarbonylContact O-C 3.53Å; A200-R203 PolarHBondContact O-N 3.36Å; A200-K204 WeakPolarHBondContact O-CB 3.47Å; A200-K204 VanDerWaalsContact O-CG 3.3Å; A200-K204 WeakPolarHBondContact O-CG 3.43Å; A200-K204 PolarHBondContact O-N 3Å
201K78.6Confident71.3Confident127 Ų12789.8 Ų89.855%0.55244%0.44SS*.Hα-helixtrans-65.1-47.3175.1-176.5-179.8177.9-173.60110.6I197 N198 Y199 R203 K204 M205I197-K201 WeakPolarHBondContact O-CB 3.37Å; I197-K201 PolarHBondContact O-N 3.26Å; N198-K201 WeakPolarHBondContact O-CB 3.31Å; N198-K201 PolarHBondContact O-N 3.14Å; Y199-K201 PolarHBondContact O-N 3.39Å; K201-R203 PolarHBondContact O-N 2.84Å; K201-K204 PolarHBondContact O-N 2.74Å; K201-K204 VanDerWaalsContact O-N 3.14Å; K201-M205 HydrophobicContact CG-CE 4.06Å; K201-M205 PolarHBondContact O-N 2.9Å
202V70.5Confident69.1Low87 Ų8792.9 Ų92.953%0.52746%0.456SS..Hα-helixtrans-57.7-39.7173.5177.30000110.7N198 Y199 M205N198-V202 WeakPolarHBondContact O-CG2 3.36Å; N198-V202 PolarHBondContact O-N 3.42Å; Y199-V202 PolarHBondContact O-N 2.83Å; V202-M205 PolarHBondContact O-N 3.13Å
203R69.7Low67Low134 Ų13495.6 Ų95.651%0.50648%0.478SS..Hα-helixtrans-77.6-15.6178.6-137.6-176.5-165.6-136.54.9115.5D115 Y199 A200 K201 P206D115-R203 IonicContact OD1-CZ 3.66Å; D115-R203 IonicContact OD1-NE 2.79Å; D115-R203 PolarHBondContact OD1-NE 3.46Å; D115-R203 IonicContact OD1-NH2 3.65Å; D115-R203 PolarHBondContact OD1-NH2 2.81Å; D115-R203 IonicContact OD2-CZ 3.55Å; D115-R203 IonicContact OD2-NE 2.82Å; D115-R203 PolarHBondContact OD2-NE 3.38Å; D115-R203 IonicContact OD2-NH2 3.47Å; D115-R203 PolarHBondContact OD2-NH2 2.88Å; Y199-R203 PolarHBondContact O-N 2.88Å; Y199-R203 PolarHBondContact OH-NE 2.95Å; A200-R203 CarbonylContact O-C 3.53Å; A200-R203 PolarHBondContact O-N 3.36Å; K201-R203 PolarHBondContact O-N 2.84Å; R203-P206 WeakPolarHBondContact O-CD 2.8Å
204K62.9Low65.1Low160 Ų160103.2 Ų103.270%0.69650%0.503SS*.Hα-helixtrans-88.5-16.3174.2-79.1-179.1-178.9-177.60112.8A200 K201A200-K204 WeakPolarHBondContact O-CB 3.47Å; A200-K204 VanDerWaalsContact O-CG 3.3Å; A200-K204 WeakPolarHBondContact O-CG 3.43Å; A200-K204 PolarHBondContact O-N 3Å; K201-K204 PolarHBondContact O-N 2.74Å; K201-K204 VanDerWaalsContact O-N 3.14Å
205M55.8Low63.3Low95 Ų9599.5 Ų99.547%0.46850%0.501SS..SBendtrans-69.2-23.1174-69.1179.3-176.400116.5K201 V202 E207 T208 F209K201-M205 HydrophobicContact CG-CE 4.06Å; K201-M205 PolarHBondContact O-N 2.9Å; V202-M205 PolarHBondContact O-N 3.13Å; M205-E207 VanDerWaalsContact C-N 3.31Å; M205-E207 PolarHBondContact O-N 3.28Å; M205-T208 PolarHBondContact O-N 3.26Å; M205-F209 WeakPolarHBondContact O-CD2 3.39Å
206P50.8Low61.8Low73 Ų73109.1 Ų109.147%0.47454%0.536SS..Hα-helixtrans-63.5-33.2177.6-19.632.3000113.4R203 T208 S210R203-P206 WeakPolarHBondContact O-CD 2.8Å; P206-T208 VanDerWaalsContact C-N 3.34Å; P206-T208 PolarHBondContact O-N 2.98Å; P206-S210 PolarHBondContact O-N 3.08Å
207E51.1Low60.3Low143 Ų143110.3 Ų110.367%0.66855%0.55SS**Hα-helixtrans-81-12.9-176.9-63.9-62164.700113.8M205 S210M205-E207 VanDerWaalsContact C-N 3.31Å; M205-E207 PolarHBondContact O-N 3.28Å; E207-S210 WeakPolarHBondContact CA-OG 3.44Å; E207-S210 PolarHBondContact O-OG 3.16Å; E207-S210 VanDerWaalsContact O-OG 3.1Å; E207-S210 PolarHBondContact OE2-OG 3.03Å
208T50.1Low58.7Low93 Ų93112.2 Ų112.257%0.57156%0.561SS**Hα-helixtrans-86-31.4173.6-50.50000111M205 P206 N211M205-T208 PolarHBondContact O-N 3.26Å; P206-T208 VanDerWaalsContact C-N 3.34Å; P206-T208 PolarHBondContact O-N 2.98Å; T208-N211 PolarHBondContact O-N 3.19Å
209F49.3Very low57.1Low148 Ų148118.5 Ų118.565%0.64959%0.586SS**Hα-helixtrans-85.2-14.6175.4-69.7-71.2000114.2M205 L212M205-F209 WeakPolarHBondContact O-CD2 3.39Å; F209-L212 HydrophobicContact CD1-CD1 4.26Å
210S49.8Very low56.2Low72 Ų72124.3 Ų124.350%0.50362%0.618SS.*THydrogen-bonded Turntrans-71.8-18.8165.860.10000112.7P206 E207P206-S210 PolarHBondContact O-N 3.08Å; E207-S210 WeakPolarHBondContact CA-OG 3.44Å; E207-S210 PolarHBondContact O-OG 3.16Å; E207-S210 VanDerWaalsContact O-OG 3.1Å; E207-S210 PolarHBondContact OE2-OG 3.03Å
211N46.4Very low54.7Low135 Ų135136.8 Ų136.872%0.72266%0.662SS**THydrogen-bonded Turntrans-97.42.8173.8-109.7-86.3000115.1T208 P213T208-N211 PolarHBondContact O-N 3.19Å; N211-P213 VanDerWaalsContact O-CD 3.28Å; N211-P213 WeakPolarHBondContact O-CD 3.36Å
212L44.8Very low53.5Low113 Ų113137.3 Ų137.359%0.59267%0.667SS**SBendtrans-86.3105.5154.7-83.791.7000106.4F209 R214F209-L212 HydrophobicContact CD1-CD1 4.26Å; L212-R214 PolarHBondContact O-N 3.13Å
213P46.8Very low52.7Low93 Ų93139.9 Ų139.960%0.60468%0.675SS**  trans-58.8112.3-178.426.3-32.4000106.8N211 T215N211-P213 VanDerWaalsContact O-CD 3.28Å; N211-P213 WeakPolarHBondContact O-CD 3.36Å; P213-T215 HydrophobicContact CB-CG2 3.94Å; P213-T215 PolarHBondContact O-N 3.11Å; P213-T215 PolarHBondContact O-OG1 3.47Å
214R50.1Low51.7Low209 Ų209140.2 Ų140.279%0.78968%0.684SS**  trans-70.953.9161.5-172.6162.4-75.3167.3-2.5108.1L212 R216L212-R214 PolarHBondContact O-N 3.13Å; R214-R216 PolarHBondContact O-N 2.8Å
215T49.6Very low51.1Low108 Ų108139.1 Ų139.166%0.66368%0.683SS**THydrogen-bonded Turntrans-70.937.5157.443.70000110.2P213P213-T215 HydrophobicContact CB-CG2 3.94Å; P213-T215 PolarHBondContact O-N 3.11Å; P213-T215 PolarHBondContact O-OG1 3.47Å
216R56.4Low50.8Low207 Ų207141.8 Ų141.878%0.78170%0.697SS**THydrogen-bonded Turntrans-110.64.4170.5-71.4-75.1-134.7-170.43.2112R214R214-R216 PolarHBondContact O-N 2.8Å
217V54.9Low50.8Low115 Ų115146.4 Ų146.470%0.69771%0.712SS**SBendtrans-102.54.2168.7-65.50000113.5F219V217-F219 VanDerWaalsContact C-N 3.3Å
218L53.9Low50.7Low143 Ų143146.6 Ų146.675%0.74972%0.715SS**  trans-96.229.1166.5-109172.5000112.4I220L218-I220 VanDerWaalsContact C-N 3.27Å
219F51.6Low50.8Low183 Ų183150.8 Ų150.880%0.80373%0.726SS**  trans-9728165.2-125.9-83.9000111.5V217V217-F219 VanDerWaalsContact C-N 3.3Å
220I60.4Low50.9Low151 Ų151151 Ų15177%0.77473%0.732SS**  trans-129.266.4168.4-56.9176.2000107.5L218L218-I220 VanDerWaalsContact C-N 3.27Å
221Y46.2Very low51Low283 Ų283158.2 Ų158.2100%1.1175%0.753SS**  trans-163.20139.9-135.5-86.9000108.2

Retrieved 221 of 221 residues in 37.4 ms (Link to these results)