A0A096NL04_PAPAN Loading...

Endonuclease III-like protein 1

Bifunctional DNA N-glycosylase with associated apurinic/apyrimidinic (AP) lyase function that catalyzes the first step in base excision repair (BER), the primary repair pathway for the repair of oxidative DNA damage. The DNA N-glycosylase activity releases the damaged DNA base from DNA by cleaving the N-glycosidic bond, leaving an AP site. The AP lyase activity cleaves the phosphodiester bond 3' to the AP site by a beta-elimination. Primarily recognizes and repairs oxidative base damage of pyrimidines.

AlphaFold DB , UniProt , Accession A0A096NL04, Species PAPAN (Papio anubis, Olive baboon), Gene NTHL1, Length 312 aa.

Structure Viewer
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(Predicted Aligned Error values between residue pairs)
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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 low36.7Very low244 Ų244149.8 Ų149.8100%1.20289%0.886SS**  01290-84.8-175.8159.400108.3
2C37.2Very low36.4Very low132 Ų132152.3 Ų152.389%0.89289%0.89SS**  trans61100.9168-66.10000120.9
3S35.2Very low35.9Very low113 Ų113149.5 Ų149.579%0.7988%0.884SS**  trans-72-163.8144-47.20000110.9
4P54.3Low35.8Very low121 Ų121146.3 Ų146.379%0.78688%0.883SS**  -114.1179.8-120.724.61000112.6
5Q38.4Very low35.5Very low202 Ų202152.3 Ų152.394%0.94488%0.883SS**  trans-132.2124.8162.3-87.5-171.4-27.200112.6
6E36.6Very low35.2Very low186 Ų186153.7 Ų153.787%0.86988%0.882SS**  trans-70159.6166.7-61.3175.5115.900112.3
7S36.8Very low35.1Very low130 Ų130155 Ų15591%0.90988%0.884SS**  trans173134.5145.835.30000107.2
8G29.8Very low35Very low76 Ų76153.1 Ų153.178%0.78488%0.876SS**  cis-176.4148.5-1.700000106.7
9M33.3Very low34.9Very low181 Ų181158.5 Ų158.589%0.89288%0.881SS**  trans-61149.1175.7-75.2144.756.700112.5
10N33Very low34.7Very low171 Ų171157.7 Ų157.791%0.91488%0.875SS**  trans-154.1119.5134-103.3-19.4000112.1
11A32.2Very low34.7Very low92 Ų92162.1 Ų162.176%0.7688%0.878SS**  trans-87.6137.2169.100000109.2
12L33.2Very low34.4Very low179 Ų179154.9 Ų154.994%0.93785%0.852SS**  trans-132.4118.9158.8-86.2171.6000110.4
13S29.7Very low34.2Very low116 Ų116157 Ų15781%0.81185%0.853SS**  trans-77.9139.2176.7-179.20000110.3
14A33.7Very low33.9Very low105 Ų105155 Ų15587%0.86885%0.851SS**  trans-127.6120.5166.500000110.2
15R32.2Very low33.5Very low236 Ų236156 Ų15689%0.89186%0.857SS**  trans-64.4150.8-165.8-73.4164.2170.6-177.8-3.5116.3
16M30.7Very low33.1Very low175 Ų175150 Ų15086%0.86285%0.849SS**  trans-53.9145.4154.7-69.5174.3171.100112.7
17L33.3Very low32.8Very low176 Ų176146.2 Ų146.292%0.92185%0.85SS**  trans-133.198.6154.6-87.1167.3000109.8
18T32.7Very low32.5Very low120 Ų120143.6 Ų143.674%0.73684%0.843SS**  trans-73.3137158.247.50000109.5
19R33.4Very low33.5Very low257 Ų257145.7 Ų145.797%0.9784%0.843SS**  trans-124.5104.6160.7-112.6179.9175.5175.8-0.8109.6
20N30.7Very low33.5Very low141 Ų141149.3 Ų149.375%0.75485%0.847SS**  trans-96.9139.3164.2-16514.5000107.5
21R35.1Very low33.2Very low251 Ų251144.4 Ų144.495%0.94784%0.836SS**  trans-147.3104.8159.4-111.4-172.5-178.7-166.3-0.3109.1
22S31.3Very low32.8Very low93 Ų93146.9 Ų146.965%0.6585%0.846SS**  trans-74.3154.8163.413.70000111
23L32.5Very low32.6Very low177 Ų177141.6 Ų141.693%0.92784%0.835SS**  trans-178.9112.7130.6-96165.2000111.8
24G29.7Very low32.6Very low71 Ų71145.4 Ų145.473%0.73284%0.84SS**  86.5154.5122.300000121.3
25P45.4Very low32.5Very low141 Ų141149.4 Ų149.492%0.91684%0.841SS**  trans-122.3170-138.338-22.3000115.7
26G29.8Very low32.6Very low75 Ų75144.2 Ų144.277%0.77384%0.838SS**  trans-177.2113.716700000116.5
27A31.1Very low33Very low108 Ų108140.1 Ų140.189%0.89383%0.832SS**  trans48.3126.1145.500000122.6
28G28.7Very low33.2Very low74 Ų74136.9 Ų136.976%0.76382%0.821SS**  trans-85.7-148.6163.500000113.1
29P51.9Low33.3Very low120 Ų120137.6 Ų137.678%0.77983%0.828SS**  cis-121169.1-45.338.1-24.5000111.7
30R33.4Very low33.2Very low258 Ų258137.1 Ų137.197%0.97483%0.826SS**  trans160.1136.2162.6-96.2175.5-90.4-155.10.4106.3
31G27Very low33.1Very low67 Ų67142.5 Ų142.569%0.69184%0.836SS**  cis157.51417.300000106.2
32C24.3Very low32.7Very low144 Ų144133.9 Ų133.997%0.97383%0.825SS**  trans58.9133.1159.2-57.40000121.2
33G28.4Very low32.5Very low69 Ų69138.6 Ų138.671%0.71184%0.837SS**  trans155.173.2157.100000116.7
34E29.9Very low32.2Very low196 Ų196134.9 Ų134.992%0.91683%0.831SS**  trans52.3118.6143.4-70.5168.2113.100122.5
35E31.9Very low32.1Very low188 Ų188136.6 Ų136.688%0.87984%0.839SS**  trans-72.5155.8159.7-70.9-169.611000112.8
36P34.3Very low31.2Very low127 Ų127134.8 Ų134.883%0.82584%0.836SS**  trans-105.8129.7147.822.8-6.8000112.2
37A37.2Very low31.1Very low89 Ų89140.8 Ų140.874%0.73684%0.844SS**PPolyproline II helixtrans-68.4161.4-176.500000115.4
38P38.2Very low30.8Very low109 Ų109140 Ų14071%0.70884%0.837SS**PPolyproline II helixtrans-89.3157.4-176.336.1-33.6000112.8
39P35Very low30.7Very low134 Ų134147.9 Ų147.987%0.8784%0.844SS**PPolyproline II helixtrans-82.2127.5176.431.9-29.9000111.3
40R30.9Very low29.5Very low248 Ų248152.3 Ų152.394%0.93685%0.851SS**PPolyproline II helixtrans-90.3144.4169.9-71.3-174.5173.9-167.7-0.8111
41R29Very low29.2Very low254 Ų254145.3 Ų145.396%0.95884%0.842SS**PPolyproline II helixtrans-87145.1166.3-83.5-177.5175.2-146.7-0.8110.6
42G25.9Very low29.2Very low70 Ų70151.1 Ų151.172%0.72285%0.85SS**  trans117.7119.3135.500000117.4
43E27.3Very low29.4Very low192 Ų192149.5 Ų149.590%0.89784%0.841SS**  trans144.7108.2133.7-81.4-176.1130.900110.2
44A26Very low29.5Very low98 Ų98152.1 Ų152.181%0.8185%0.845SS**  73.9101.784.600000113.1
45A28.3Very low29.5Very low108 Ų108149.3 Ų149.389%0.89384%0.841SS**  trans-140.1127.6157.200000108.6
46A26.1Very low29.3Very low103 Ų103150 Ų15085%0.85184%0.841SS**  trans-88.6142.8-17800000110.7
47E27.5Very low29.1Very low200 Ų200155.2 Ų155.294%0.93584%0.844SS**  trans-148.1147.2156.6-131.617317400111.5
48A26.3Very low28.8Very low91 Ų91162.6 Ų162.675%0.75285%0.853SS**  trans-90.1136.6-151.800000115.1
49R25.3Very low28.5Very low240 Ų240168.9 Ų168.991%0.90686%0.863SS**  trans29109.6136.5-61.3-178.4178.5-161.7-0.8118.6
50K26.3Very low28.4Very low214 Ų214172.2 Ų172.293%0.9386%0.864SS**  trans-121125.5136.6-78-177.5-179.9175.90109.5
51S27.7Very low28.3Very low111 Ų111164.9 Ų164.978%0.77686%0.856SS**  trans-78.2116.2-176.838.90000111.3
52H27.1Very low28.5Very low188 Ų188161.6 Ų161.687%0.8785%0.852SS**  trans-128.9111.7161.5-86.30.7000109.7
53S27.7Very low28.5Very low111 Ų111169.4 Ų169.478%0.77686%0.859SS**PPolyproline II helixtrans-60.8130.6177.1-590000111.2V55S53-V55 PolarHBondContact O-N 2.61Å
54P30.6Very low28.7Very low123 Ų123168 Ų16880%0.79986%0.857SS**PPolyproline II helixtrans-80.3116.9174.330.4-29.9000109.8K56P54-K56 PolarHBondContact O-N 3.22Å
55V30.3Very low28.6Very low137 Ų137169.2 Ų169.283%0.8386%0.858SS**PPolyproline II helixtrans-58.3117.5170.9174.70000109.3S53 R57S53-V55 PolarHBondContact O-N 2.61Å; V55-R57 PolarHBondContact O-N 3.1Å
56K29.1Very low28.9Very low204 Ų204170.3 Ų170.389%0.88785%0.854SS**  trans-62.496.2175.1-72.6178.1177.8175.80110.4P54 R58P54-K56 PolarHBondContact O-N 3.22Å; K56-R58 PolarHBondContact O-N 3.43Å; K56-R58 VanDerWaalsContact O-N 3.16Å
57R29.1Very low29Very low236 Ų236170.1 Ų170.189%0.89185%0.852SS**  trans-75.298.5162.6-88.1-177.2169.5-178.9-2.7109.1V55 R59V55-R57 PolarHBondContact O-N 3.1Å; R57-R59 PolarHBondContact O-N 2.96Å
58R30.4Very low29.6Very low244 Ų244170.7 Ų170.792%0.92185%0.847SS**  trans-51.4105.1165.6-97.5176.5160.1177.7-5.2108.9K56 K60K56-R58 PolarHBondContact O-N 3.43Å; K56-R58 VanDerWaalsContact O-N 3.16Å; R58-K60 PolarHBondContact O-N 2.9Å
59R33.7Very low30.2Very low240 Ų240175.6 Ų175.691%0.90685%0.854SS**  trans-71.9113164.8-78.3-176.1172.1-177-2.3107.4R57 A61R57-R59 PolarHBondContact O-N 2.96Å; R59-A61 PolarHBondContact O-N 3.08Å; R59-A61 VanDerWaalsContact O-N 3.07Å
60K31Very low30.6Very low205 Ų205166.6 Ų166.689%0.89184%0.837SS**  trans-61.5106.4172.9-142.4178.9-171.5-1770106.8R58 Q62R58-K60 PolarHBondContact O-N 2.9Å; K60-Q62 PolarHBondContact O-N 2.66Å
61A30.4Very low30.9Very low94 Ų94161.5 Ų161.578%0.77783%0.828SS**  trans-66104.2171.900000107.7R59 R63R59-A61 PolarHBondContact O-N 3.08Å; R59-A61 VanDerWaalsContact O-N 3.07Å; A61-R63 PolarHBondContact O-N 3.17Å; A61-R63 VanDerWaalsContact O-N 3.16Å
62Q32.1Very low31.1Very low185 Ų185163.2 Ų163.286%0.86483%0.828SS**  trans-72.1103.2166.5-108.5168.8-24.600107K60 L64K60-Q62 PolarHBondContact O-N 2.66Å; Q62-L64 PolarHBondContact O-N 2.93Å; Q62-L64 VanDerWaalsContact O-N 3.11Å
63R27.4Very low31.2Very low233 Ų233159.1 Ų159.188%0.87982%0.821SS**  trans-61.2107.8161.6-84.1178.4169.4176.2-4.7106.8A61 C65A61-R63 PolarHBondContact O-N 3.17Å; A61-R63 VanDerWaalsContact O-N 3.16Å; R63-C65 PolarHBondContact O-N 2.96Å
64L29.8Very low31.3Very low162 Ų162162 Ų16285%0.84882%0.822SS**  trans-66.2108.1159-86.3148.6000106.3Q62 V66Q62-L64 PolarHBondContact O-N 2.93Å; Q62-L64 VanDerWaalsContact O-N 3.11Å; L64-V66 PolarHBondContact O-N 3.32Å; L64-V66 VanDerWaalsContact O-N 3.12Å
65C25.3Very low31.7Very low124 Ų124165.6 Ų165.684%0.83883%0.825SS**  trans-69.1103.8168.4-670000107.5R63R63-C65 PolarHBondContact O-N 2.96Å
66V33.3Very low31.8Very low132 Ų132162.8 Ų162.880%0.882%0.823SS**  trans-84.8106.5163.6178.30000105.5L64 Y68L64-V66 PolarHBondContact O-N 3.32Å; L64-V66 VanDerWaalsContact O-N 3.12Å; V66-Y68 PolarHBondContact O-N 3.5Å
67A29.2Very low32.1Very low98 Ų98162.2 Ų162.281%0.8182%0.824SS**  trans-81110.6171.600000108.3
68Y38.7Very low32.5Very low212 Ų212161.2 Ų161.283%0.83183%0.826SS**  trans-120.6114.4159.3-172.3-89.1000105.9V66V66-Y68 PolarHBondContact O-N 3.5Å
69E39.2Very low33.1Very low194 Ų194153.8 Ų153.891%0.90782%0.817SS**  trans-133.4122.5167.6-72.4-172.4166.100108.6
70G33.6Very low33.5Very low52 Ų52150.8 Ų150.854%0.53681%0.813SS.*  trans-100.5144.2157.400000109.3
71S33.7Very low34.1Very low107 Ų107146.3 Ų146.375%0.74881%0.805SS**  trans40.4123.5149.458.30000117.9
72D31Very low34.8Very low147 Ų147149.7 Ų149.779%0.78681%0.809SS**  cis-170.6153.749.6-102.1-34.3000112.9
73S29.6Very low35.6Very low102 Ų102150.2 Ų150.271%0.71381%0.808SS**  trans69.2104.6145.3-54.70000121.8
74E30.8Very low36.8Very low170 Ų170144.7 Ų144.779%0.79480%0.801SS**  155.1126.999.4-74.8-148.4124.900113
75K38.8Very low38.4Very low200 Ų200142.7 Ų142.787%0.8780%0.797SS**  trans31.4107.8154.2-65.2175.7-177.3168.20119.3
76G31.1Very low41.2Very low77 Ų77141.3 Ų141.379%0.79479%0.785SS**  trans-162.2132.1159.100000110.7
77E36.2Very low44Very low192 Ų192139.5 Ų139.590%0.89776%0.764SS**  trans-16.1135.5179.6-66.7163.7140.800118.7A79E77-A79 VanDerWaalsContact C-N 3.28Å; E77-A79 PolarHBondContact O-N 2.79Å
78K38.5Very low47.2Very low216 Ų216140 Ų14094%0.93975%0.749SS**  trans-63.483.7171-71.1-179178.1179.60110.5E80K78-E80 PolarHBondContact O-N 3.43Å
79A41.8Very low49.9Very low88 Ų88130.2 Ų130.273%0.72771%0.712SS**  trans-76.2109.4155.300000107.1E77E77-A79 VanDerWaalsContact C-N 3.28Å; E77-A79 PolarHBondContact O-N 2.79Å
80E42.7Very low52.4Low177 Ų177128.6 Ų128.683%0.82770%0.704SS**  trans-56126.2164.9-75.2-143.1146.300107.9K78 L82K78-E80 PolarHBondContact O-N 3.43Å; E80-L82 PolarHBondContact O-N 3.36Å
81P43.9Very low55.3Low110 Ų110129.6 Ų129.671%0.71470%0.697SS**  trans-61.8117176.5-9.320.8000107K83P81-K83 VanDerWaalsContact C-N 3.29Å; P81-K83 PolarHBondContact O-N 2.99Å
82L43.9Very low58.3Low166 Ų166125.4 Ų125.487%0.86967%0.665SS**  trans-54.398.3168-77.7158.6000107.1E80 V84E80-L82 PolarHBondContact O-N 3.36Å; L82-V84 VanDerWaalsContact C-N 3.29Å; L82-V84 PolarHBondContact O-N 3.28Å
83K48.2Very low61.5Low195 Ų195124.2 Ų124.285%0.84866%0.655SS**  trans-66.292.9179-72.4-179.5-177.3174.80107.2P81 P85P81-K83 VanDerWaalsContact C-N 3.29Å; P81-K83 PolarHBondContact O-N 2.99Å; K83-P85 WeakPolarHBondContact O-CD 3.19Å
84V53.1Low64.8Low118 Ų118123.9 Ų123.972%0.71564%0.642SS**  trans-55.7125.5165.6-1740000105.9L82 V86L82-V84 VanDerWaalsContact C-N 3.29Å; L82-V84 PolarHBondContact O-N 3.28Å; V84-V86 PolarHBondContact O-N 2.85Å
85P63.8Low68Low120 Ų120115.9 Ų115.978%0.77960%0.604SS**  trans-60.3111.8179.3-18.429.2000108.2K83 W87K83-P85 WeakPolarHBondContact O-CD 3.19Å; P85-W87 PolarHBondContact O-N 2.64Å
86V83.6Confident70.8Confident95 Ų95106.5 Ų106.558%0.57656%0.564SS**  trans-68119.4170.4179.10000105.7V84 E88 E268 W269V84-V86 PolarHBondContact O-N 2.85Å; V86-E88 PolarHBondContact O-N 2.99Å; V86-E268 WeakPolarHBondContact CG1-O 3.43Å; V86-W269 HydrophobicContact CG1-CB 3.7Å
87W93.3Very high74.1Confident94 Ų94106.2 Ų106.236%0.35655%0.547SS..  trans-56.1132.4175.7171.589000109.3P85 P89 T252 K253 W269P85-W87 PolarHBondContact O-N 2.64Å; W87-P89 HydrophobicContact CH2-CB 4.15Å; W87-P89 HydrophobicContact CH2-CG 3.75Å; W87-P89 HydrophobicContact CZ3-CG 3.95Å; W87-T252 VanDerWaalsContact CH2-C 3.46Å; W87-K253 VanDerWaalsContact CB-CE 3.44Å; W87-K253 HydrophobicContact CD2-CD 4.14Å; W87-K253 HydrophobicContact CD2-CG 3.37Å; W87-K253 HydrophobicContact CE3-CD 4.13Å; W87-K253 HydrophobicContact CE3-CG 3.35Å; W87-K253 HydrophobicContact CG-CD 4.35Å; W87-K253 HydrophobicContact CG-CG 4Å; W87-K253 HydrophobicContact CH2-CB 4.41Å; W87-K253 HydrophobicContact CH2-CG 3.92Å; W87-K253 VanDerWaalsContact CH2-N 3.29Å; W87-K253 HydrophobicContact CZ2-CB 4.42Å; W87-K253 HydrophobicContact CZ2-CG 3.93Å; W87-K253 HydrophobicContact CZ3-CB 4.48Å; W87-K253 HydrophobicContact CZ3-CG 3.64Å; W87-W269 AromaticContact CE3-CD1 3.97Å; W87-W269 HydrophobicContact CE3-CG 4.35Å; W87-W269 AromaticContact CZ3-CD1 3.74Å; W87-W269 HydrophobicContact CZ3-CG 4.38Å; W87-W269 AromaticContact CZ3-NE1 3.81Å; W87-W269 WeakPolarHBondContact O-CB 3.31Å
88E94.9Very high77Confident107 Ų10798.2 Ų98.250%0.551%0.51SS..  trans-129151.617260.9179.5-172.100110.5V86 W92 W269V86-E88 PolarHBondContact O-N 2.99Å; E88-W92 PolarHBondContact OE2-NE1 3.44Å; E88-W269 HydrophobicContact CB-CE3 4.03Å
89P95.4Very high79.9Confident7 Ų787.9 Ų87.95%0.04547%0.465CS..  trans-67.4145.4177.9-12.625.2000111.7W87 D91 W92 W251 W269W87-P89 HydrophobicContact CH2-CB 4.15Å; W87-P89 HydrophobicContact CH2-CG 3.75Å; W87-P89 HydrophobicContact CZ3-CG 3.95Å; P89-D91 PolarHBondContact O-N 2.95Å; P89-W92 HydrophobicContact CB-CB 4.13Å; P89-W92 HydrophobicContact CG-CB 4.24Å; P89-W251 HydrophobicContact CG-CB 4.3Å; P89-W251 HydrophobicContact CG-CG 4.39Å; P89-W269 VanDerWaalsContact CD-CD2 3.48Å; P89-W269 VanDerWaalsContact CD-CE2 3.46Å; P89-W269 HydrophobicContact CG-CD2 4.2Å; P89-W269 HydrophobicContact CG-CE3 4.45Å; P89-W269 HydrophobicContact CG-CH2 3.72Å; P89-W269 HydrophobicContact CG-CZ2 3.39Å; P89-W269 HydrophobicContact CG-CZ3 4.24Å
90Q92.6Very high82.6Confident161 Ų16188.2 Ų88.275%0.75245%0.447SS*.THydrogen-bonded Turntrans-61.8141.6173.1-165.6179-6.400111W92Q90-W92 PolarHBondContact O-N 3.39Å
91D94.9Very high85.3Confident72 Ų7282.2 Ų82.239%0.38543%0.428SS..THydrogen-bonded Turntrans59.810.9176.6-50.6-45.4000115.8P89 Q93 Q94 Q95 L305P89-D91 PolarHBondContact O-N 2.95Å; D91-Q93 PolarHBondContact O-N 2.87Å; D91-Q93 VanDerWaalsContact O-N 3.16Å; D91-Q94 PolarHBondContact O-N 3.36Å; D91-Q94 VanDerWaalsContact O-N 3.15Å; D91-Q95 HydrophobicContact CB-CG 4.42Å; D91-Q95 WeakPolarHBondContact O-CB 3.47Å; D91-Q95 VanDerWaalsContact O-CG 3.26Å; D91-Q95 WeakPolarHBondContact O-CG 3.34Å; D91-Q95 PolarHBondContact O-N 3.35Å; D91-L305 HydrophobicContact CB-CD2 4.39Å
92W97.1Very high87.8Confident20 Ų2079 Ų798%0.07640%0.404CS..Hα-helixtrans-56.2-38.3-174.278.7-99.3000112.8E88 P89 Q90 Q95 L96 W269 L270 P271 L274E88-W92 PolarHBondContact OE2-NE1 3.44Å; P89-W92 HydrophobicContact CB-CB 4.13Å; P89-W92 HydrophobicContact CG-CB 4.24Å; Q90-W92 PolarHBondContact O-N 3.39Å; W92-Q95 PolarHBondContact O-N 3.02Å; W92-L96 HydrophobicContact CE3-CD2 4.42Å; W92-L96 HydrophobicContact CZ3-CD2 3.92Å; W92-L96 WeakPolarHBondContact O-CB 3.34Å; W92-L96 PolarHBondContact O-N 3.11Å; W92-W269 HydrophobicContact CB-CH2 4Å; W92-W269 HydrophobicContact CB-CZ3 4.18Å; W92-W269 AromaticContact CD1-CZ3 3.97Å; W92-W269 HydrophobicContact CD2-CH2 4.04Å; W92-W269 AromaticContact CD2-CZ3 3.49Å; W92-W269 HydrophobicContact CD2-CZ3 3.49Å; W92-W269 VanDerWaalsContact CD2-CZ3 3.49Å; W92-W269 AromaticContact CE2-CZ3 3.76Å; W92-W269 HydrophobicContact CE3-CH2 4.2Å; W92-W269 AromaticContact CE3-CZ3 3.87Å; W92-W269 HydrophobicContact CE3-CZ3 3.87Å; W92-W269 AromaticContact CG-CH2 3.97Å; W92-W269 HydrophobicContact CG-CH2 3.97Å; W92-W269 AromaticContact CG-CZ3 3.64Å; W92-W269 HydrophobicContact CG-CZ3 3.64Å; W92-W269 HydrophobicContact CZ2-CZ3 4.36Å; W92-W269 HydrophobicContact CZ3-CZ3 4.46Å; W92-L270 HydrophobicContact CE3-CD1 4.38Å; W92-L270 HydrophobicContact CZ3-CD1 4.11Å; W92-P271 HydrophobicContact CH2-CG 4.01Å; W92-P271 HydrophobicContact CZ2-CG 4.35Å; W92-L274 HydrophobicContact CH2-CD1 3.93Å; W92-L274 HydrophobicContact CZ3-CD1 3.74Å
93Q97.8Very high90.4Very high122 Ų12271.6 Ų71.657%0.5736%0.364SS*.Hα-helixtrans-64.2-50.9179.6-65.5-179.4-21.700110.9D91 Q95 L96 V97D91-Q93 PolarHBondContact O-N 2.87Å; D91-Q93 VanDerWaalsContact O-N 3.16Å; Q93-Q95 VanDerWaalsContact C-N 3.3Å; Q93-Q95 PolarHBondContact O-N 3.12Å; Q93-L96 PolarHBondContact O-N 3.16Å; Q93-V97 WeakPolarHBondContact O-CG2 3.23Å; Q93-V97 PolarHBondContact O-N 3.47Å
94Q98.4Very high92.8Very high94 Ų9466.5 Ų66.544%0.43935%0.353SS..Hα-helixtrans-64.8-38.5178-171.959.853.400111D91 L96 V97 N98 L305D91-Q94 PolarHBondContact O-N 3.36Å; D91-Q94 VanDerWaalsContact O-N 3.15Å; Q94-L96 VanDerWaalsContact C-N 3.33Å; Q94-L96 PolarHBondContact O-N 3.07Å; Q94-V97 PolarHBondContact O-N 3.39Å; Q94-N98 PolarHBondContact NE2-OD1 2.94Å; Q94-N98 WeakPolarHBondContact O-CB 3.38Å; Q94-N98 PolarHBondContact O-N 2.87Å; Q94-N98 PolarHBondContact O-ND2 2.9Å; Q94-L305 HydrophobicContact CB-CD1 3.98Å; Q94-L305 HydrophobicContact CG-CD1 3.54Å
95Q98.2Very high94.9Very high2 Ų268.9 Ų68.91%0.00935%0.354CS..Hα-helixtrans-60.3-42.9175.3-70.4169.31.300112.1D91 W92 Q93 N98 I99 W251 N302 L305D91-Q95 HydrophobicContact CB-CG 4.42Å; D91-Q95 WeakPolarHBondContact O-CB 3.47Å; D91-Q95 VanDerWaalsContact O-CG 3.26Å; D91-Q95 WeakPolarHBondContact O-CG 3.34Å; D91-Q95 PolarHBondContact O-N 3.35Å; W92-Q95 PolarHBondContact O-N 3.02Å; Q93-Q95 VanDerWaalsContact C-N 3.3Å; Q93-Q95 PolarHBondContact O-N 3.12Å; Q95-N98 PolarHBondContact O-N 3.48Å; Q95-I99 WeakPolarHBondContact O-CD1 3.35Å; Q95-I99 VanDerWaalsContact O-CG1 3.24Å; Q95-I99 WeakPolarHBondContact O-CG1 3.17Å; Q95-I99 PolarHBondContact O-N 3.12Å; Q95-W251 HydrophobicContact CB-CZ2 4.34Å; Q95-N302 VanDerWaalsContact CA-OD1 3.3Å; Q95-N302 WeakPolarHBondContact CA-OD1 2.99Å; Q95-N302 PolarHBondContact O-ND2 3.21Å; Q95-L305 HydrophobicContact CG-CB 4.08Å; Q95-L305 HydrophobicContact CG-CD1 4.35Å; Q95-L305 PolarHBondContact NE2-O 3.39Å; Q95-L305 VanDerWaalsContact NE2-O 3.08Å
96L98.4Very high96.4Very high3 Ų370 Ų702%0.01635%0.346CS..Hα-helixtrans-66.5-44176.2-178.862.9000111.8W92 Q93 Q94 N98 I99 R100 W251 L274 I278 L281W92-L96 HydrophobicContact CE3-CD2 4.42Å; W92-L96 HydrophobicContact CZ3-CD2 3.92Å; W92-L96 WeakPolarHBondContact O-CB 3.34Å; W92-L96 PolarHBondContact O-N 3.11Å; Q93-L96 PolarHBondContact O-N 3.16Å; Q94-L96 VanDerWaalsContact C-N 3.33Å; Q94-L96 PolarHBondContact O-N 3.07Å; L96-N98 VanDerWaalsContact C-N 3.32Å; L96-N98 PolarHBondContact O-N 3.29Å; L96-I99 PolarHBondContact O-N 3.12Å; L96-R100 WeakPolarHBondContact O-CG 3.47Å; L96-R100 PolarHBondContact O-N 3.23Å; L96-W251 HydrophobicContact CD1-CH2 4.24Å; L96-L274 HydrophobicContact CD2-CD1 3.87Å; L96-I278 HydrophobicContact CD1-CD1 4.35Å; L96-L281 HydrophobicContact CD1-CD2 3.49Å; L96-L281 VanDerWaalsContact CD1-CD2 3.49Å
97V98.6Very high97Very high72 Ų7269.3 Ų69.344%0.43634%0.34SS..Hα-helixtrans-56.2-47.1174.5167.70000110.9Q93 Q94 I99 R100 A101Q93-V97 WeakPolarHBondContact O-CG2 3.23Å; Q93-V97 PolarHBondContact O-N 3.47Å; Q94-V97 PolarHBondContact O-N 3.39Å; V97-I99 PolarHBondContact O-N 2.66Å; V97-R100 WeakPolarHBondContact O-CB 3.41Å; V97-R100 PolarHBondContact O-N 3.34Å; V97-A101 PolarHBondContact O-N 3.48Å
98N98.6Very high97.2Very high23 Ų2364.9 Ų64.912%0.12332%0.323CS..Hα-helixtrans-63-40.7178-74.6-9.1000112.3Q94 Q95 L96 A101 M102 L301 N302Q94-N98 PolarHBondContact NE2-OD1 2.94Å; Q94-N98 WeakPolarHBondContact O-CB 3.38Å; Q94-N98 PolarHBondContact O-N 2.87Å; Q94-N98 PolarHBondContact O-ND2 2.9Å; Q95-N98 PolarHBondContact O-N 3.48Å; L96-N98 VanDerWaalsContact C-N 3.32Å; L96-N98 PolarHBondContact O-N 3.29Å; N98-A101 PolarHBondContact O-N 2.83Å; N98-M102 WeakPolarHBondContact O-CE 3.46Å; N98-M102 WeakPolarHBondContact O-CG 3.43Å; N98-M102 PolarHBondContact O-N 3.19Å; N98-L301 HydrophobicContact CB-CB 3.81Å; N98-L301 PolarHBondContact ND2-O 3.4Å; N98-L301 VanDerWaalsContact ND2-O 3.16Å; N98-N302 WeakPolarHBondContact CB-OD1 3.49Å; N98-N302 PolarHBondContact ND2-OD1 2.96Å
99I98.6Very high97.3Very high0 Ų061.6 Ų61.60%031%0.311CS..Hα-helixtrans-63.8-46.2175.1-67.8163.3000110.3Q95 L96 V97 A101 M102 R103 L249 W251 L281 L282 F285 N302Q95-I99 WeakPolarHBondContact O-CD1 3.35Å; Q95-I99 VanDerWaalsContact O-CG1 3.24Å; Q95-I99 WeakPolarHBondContact O-CG1 3.17Å; Q95-I99 PolarHBondContact O-N 3.12Å; L96-I99 PolarHBondContact O-N 3.12Å; V97-I99 PolarHBondContact O-N 2.66Å; I99-A101 VanDerWaalsContact C-N 3.3Å; I99-A101 PolarHBondContact O-N 3.47Å; I99-M102 HydrophobicContact CG1-CE 4.3Å; I99-M102 PolarHBondContact O-N 3.11Å; I99-R103 HydrophobicContact CG2-CG 4.21Å; I99-R103 VanDerWaalsContact O-CB 3.26Å; I99-R103 WeakPolarHBondContact O-CB 3.29Å; I99-R103 WeakPolarHBondContact O-CG 3.42Å; I99-R103 PolarHBondContact O-N 3Å; I99-L249 HydrophobicContact CD1-CD1 3.91Å; I99-W251 HydrophobicContact CD1-CH2 4.32Å; I99-W251 HydrophobicContact CD1-CZ2 4.38Å; I99-L281 HydrophobicContact CG2-CD1 3.97Å; I99-L281 HydrophobicContact CG2-CD2 3.92Å; I99-L281 HydrophobicContact CG2-CG 3.68Å; I99-L282 HydrophobicContact CD1-CD2 3.88Å; I99-L282 HydrophobicContact CG2-CD2 4.27Å; I99-F285 HydrophobicContact CD1-CD1 4.31Å; I99-F285 HydrophobicContact CD1-CE1 4.27Å; I99-F285 HydrophobicContact CG1-CD1 4.2Å; I99-F285 HydrophobicContact CG1-CD2 4.49Å; I99-F285 HydrophobicContact CG1-CE1 4.11Å; I99-F285 HydrophobicContact CG1-CE2 4.42Å; I99-F285 HydrophobicContact CG1-CG 4.39Å; I99-F285 HydrophobicContact CG1-CZ 4.24Å; I99-F285 HydrophobicContact CG2-CB 3.98Å; I99-F285 HydrophobicContact CG2-CD1 4.36Å; I99-F285 HydrophobicContact CG2-CD2 4.27Å; I99-F285 HydrophobicContact CG2-CG 3.96Å; I99-N302 WeakPolarHBondContact CG1-ND2 3.39Å
100R98.6Very high97.3Very high95 Ų9562.3 Ų62.336%0.35832%0.316SS..Hα-helixtrans-58-42.7175.4-72.9173.2174.7159.2-5.5111.7L96 V97 R103 S104 L274 E277 L281L96-R100 WeakPolarHBondContact O-CG 3.47Å; L96-R100 PolarHBondContact O-N 3.23Å; V97-R100 WeakPolarHBondContact O-CB 3.41Å; V97-R100 PolarHBondContact O-N 3.34Å; R100-R103 CarbonylContact O-C 3.52Å; R100-R103 PolarHBondContact O-N 3.49Å; R100-R103 VanDerWaalsContact O-N 3.14Å; R100-S104 PolarHBondContact O-N 3.22Å; R100-L274 VanDerWaalsContact NH2-CD2 3.32Å; R100-E277 IonicContact CZ-OE1 3.51Å; R100-E277 IonicContact CZ-OE2 2.77Å; R100-E277 IonicContact NE-OE1 3.66Å; R100-E277 IonicContact NE-OE2 2.71Å; R100-E277 PolarHBondContact NE-OE2 2.99Å; R100-E277 IonicContact NH2-OE1 2.9Å; R100-E277 PolarHBondContact NH2-OE1 3.35Å; R100-E277 IonicContact NH2-OE2 2.76Å; R100-E277 PolarHBondContact NH2-OE2 2.99Å; R100-L281 HydrophobicContact CG-CD1 4.29Å; R100-L281 HydrophobicContact CG-CD2 3.92Å
101A98.6Very high97.5Very high51 Ų5156 Ų5642%0.42129%0.287SS..Hα-helixtrans-61.3-48.3176.700000112V97 N98 I99 R103 S104 L301V97-A101 PolarHBondContact O-N 3.48Å; N98-A101 PolarHBondContact O-N 2.83Å; I99-A101 VanDerWaalsContact C-N 3.3Å; I99-A101 PolarHBondContact O-N 3.47Å; A101-R103 PolarHBondContact O-N 3.38Å; A101-S104 WeakPolarHBondContact O-CB 3.41Å; A101-S104 PolarHBondContact O-N 2.95Å; A101-S104 PolarHBondContact O-OG 3.13Å; A101-L301 HydrophobicContact CB-CD1 4.01Å
102M98.3Very high97.6Very high42 Ų4258.1 Ų58.121%0.20729%0.294CS..Hα-helixtrans-62.9-24.6175.2-71.5-176-74.600113.1N98 I99 F285 T289 L301N98-M102 WeakPolarHBondContact O-CE 3.46Å; N98-M102 WeakPolarHBondContact O-CG 3.43Å; N98-M102 PolarHBondContact O-N 3.19Å; I99-M102 HydrophobicContact CG1-CE 4.3Å; I99-M102 PolarHBondContact O-N 3.11Å; M102-F285 HydrophobicContact CE-CD2 4.15Å; M102-F285 HydrophobicContact CE-CE2 3.34Å; M102-F285 HydrophobicContact CE-CZ 3.9Å; M102-F285 HydrophobicContact SD-CE2 3.89Å; M102-T289 HydrophobicContact SD-CG2 4.35Å; M102-L301 HydrophobicContact CE-CB 4.12Å; M102-L301 HydrophobicContact CG-CB 4.32Å; M102-L301 HydrophobicContact CG-CD1 3.8Å; M102-L301 HydrophobicContact CG-CG 3.78Å; M102-L301 HydrophobicContact SD-CB 4.12Å; M102-L301 HydrophobicContact SD-CG 4.06Å; M102-L301 PolarHBondContact SD-N 3.31Å; M102-L301 VanDerWaalsContact SD-N 3.43Å
103R97.9Very high97.5Very high10 Ų1059.7 Ų59.74%0.03830%0.304CS..THydrogen-bonded Turntrans-104.68.3-177.8-64.2-64.7-64.5125.415.6113.9I99 R100 A101 K105 K106 D107 A108 D111 L281 F285I99-R103 HydrophobicContact CG2-CG 4.21Å; I99-R103 VanDerWaalsContact O-CB 3.26Å; I99-R103 WeakPolarHBondContact O-CB 3.29Å; I99-R103 WeakPolarHBondContact O-CG 3.42Å; I99-R103 PolarHBondContact O-N 3Å; R100-R103 CarbonylContact O-C 3.52Å; R100-R103 PolarHBondContact O-N 3.49Å; R100-R103 VanDerWaalsContact O-N 3.14Å; A101-R103 PolarHBondContact O-N 3.38Å; R103-K105 PolarHBondContact O-N 2.98Å; R103-K106 PolarHBondContact O-N 3.47Å; R103-K106 VanDerWaalsContact O-N 3.08Å; R103-D107 IonicContact NH1-OD1 3.24Å; R103-D107 PolarHBondContact NH1-OD1 2.94Å; R103-A108 VanDerWaalsContact NH1-CB 3.33Å; R103-D111 IonicContact CZ-OD2 3.4Å; R103-D111 IonicContact NH1-OD2 2.63Å; R103-D111 PolarHBondContact NH1-OD2 3.37Å; R103-D111 IonicContact NH2-OD1 3.4Å; R103-D111 PolarHBondContact NH2-OD1 2.97Å; R103-D111 IonicContact NH2-OD2 3.96Å; R103-D111 PolarHBondContact NH2-OD2 3.13Å; R103-L281 HydrophobicContact CB-CD1 3.68Å; R103-L281 HydrophobicContact CG-CD1 3.98Å; R103-F285 HydrophobicContact CG-CB 4.18Å
104S97.7Very high97.3Very high88 Ų8854.2 Ų54.262%0.61528%0.28SS*.THydrogen-bonded Turntrans-57.7-33-176.953.70000113.4R100 A101 K106R100-S104 PolarHBondContact O-N 3.22Å; A101-S104 WeakPolarHBondContact O-CB 3.41Å; A101-S104 PolarHBondContact O-N 2.95Å; A101-S104 PolarHBondContact O-OG 3.13Å; S104-K106 VanDerWaalsContact C-N 3.33Å; S104-K106 PolarHBondContact O-N 3.09Å
105K97.2Very high97.1Very high169 Ų16950.9 Ų50.974%0.73527%0.266SS*.THydrogen-bonded Turntrans-74.1-17.7180-66.6-176.2179.3179.30114.7R103 D107R103-K105 PolarHBondContact O-N 2.98Å; K105-D107 VanDerWaalsContact C-N 3.29Å; K105-D107 HydrophobicContact CB-CB 4.29Å; K105-D107 PolarHBondContact O-N 3.01Å
106K95.8Very high96.9Very high142 Ų14256.4 Ų56.462%0.61729%0.292SS*.  trans46.550.4-175.5-62.2-171.4176.4-173.40113.2R103 S104 D111 H112R103-K106 PolarHBondContact O-N 3.47Å; R103-K106 VanDerWaalsContact O-N 3.08Å; S104-K106 VanDerWaalsContact C-N 3.33Å; S104-K106 PolarHBondContact O-N 3.09Å; K106-D111 VanDerWaalsContact C-CG 3.48Å; K106-D111 VanDerWaalsContact CA-OD2 3.24Å; K106-D111 WeakPolarHBondContact CA-OD2 3.2Å; K106-D111 HydrophobicContact CB-CB 4.07Å; K106-D111 VanDerWaalsContact O-CB 3.24Å; K106-D111 WeakPolarHBondContact O-CB 3.49Å; K106-H112 PolarHBondContact O-CE1 2.94Å; K106-H112 PolarHBondContact O-NE2 3.15Å
107D96.7Very high96.7Very high81 Ų8160.7 Ų60.743%0.43331%0.312SS..  trans-109.715.3-174.762.6-10.9000113.7R103 K105 D111 Q288R103-D107 IonicContact NH1-OD1 3.24Å; R103-D107 PolarHBondContact NH1-OD1 2.94Å; K105-D107 VanDerWaalsContact C-N 3.29Å; K105-D107 HydrophobicContact CB-CB 4.29Å; K105-D107 PolarHBondContact O-N 3.01Å; D107-D111 PolarHBondContact N-OD2 3.41Å; D107-D111 VanDerWaalsContact N-OD2 3.16Å; D107-Q288 PolarHBondContact O-NE2 2.61Å; D107-Q288 PolarHBondContact OD1-NE2 2.9Å
108A97.1Very high96.5Very high1 Ų157.5 Ų57.51%0.00829%0.292CS..SBendtrans-84.3155.3173.700000110.3R103 V110 D111 Q288R103-A108 VanDerWaalsContact NH1-CB 3.33Å; A108-V110 HydrophobicContact CB-CG1 4.21Å; A108-V110 PolarHBondContact O-N 3.14Å; A108-V110 VanDerWaalsContact O-N 3.12Å; A108-D111 WeakPolarHBondContact CA-OD2 3.3Å; A108-D111 WeakPolarHBondContact CB-OD2 3.43Å; A108-D111 PolarHBondContact N-OD2 2.7Å; A108-D111 WeakPolarHBondContact O-CB 3.49Å; A108-D111 PolarHBondContact O-N 3.14Å; A108-Q288 HydrophobicContact CB-CG 4.12Å
109P96.4Very high96.4Very high38 Ų3859.3 Ų59.325%0.24730%0.298CS..THydrogen-bonded Turntrans-47.7-42174.9-31.536.2000114.4D111 H112 L113 D144P109-D111 PolarHBondContact O-N 2.93Å; P109-H112 PolarHBondContact O-N 3.36Å; P109-L113 WeakPolarHBondContact O-CA 2.95Å; P109-L113 VanDerWaalsContact O-CB 3.25Å; P109-L113 WeakPolarHBondContact O-CB 3.33Å; P109-L113 PolarHBondContact O-N 3Å; P109-D144 HydrophobicContact CB-CB 4.25Å
110V96.2Very high96.3Very high23 Ų2362.2 Ų62.214%0.13931%0.313CS..Hα-helixtrans-60.9-28.2-18069.10000113.6A108 H112 G114 D144 V283A108-V110 HydrophobicContact CB-CG1 4.21Å; A108-V110 PolarHBondContact O-N 3.14Å; A108-V110 VanDerWaalsContact O-N 3.12Å; V110-H112 VanDerWaalsContact C-N 3.26Å; V110-H112 PolarHBondContact O-N 2.95Å; V110-G114 VanDerWaalsContact O-CA 3.24Å; V110-G114 WeakPolarHBondContact O-CA 3.45Å; V110-G114 PolarHBondContact O-N 3.45Å; V110-D144 PolarHBondContact N-OD2 2.77Å; V110-V283 HydrophobicContact CB-CG1 3.77Å; V110-V283 HydrophobicContact CG1-CB 4.34Å; V110-V283 HydrophobicContact CG1-CG1 3.97Å; V110-V283 HydrophobicContact CG2-CB 4.31Å; V110-V283 HydrophobicContact CG2-CG1 3.8Å
111D96.7Very high96.1Very high29 Ų2962.2 Ų62.216%0.15533%0.328CS..Hα-helixtrans-76.2-12.6-177-54.5-53.9000113.8R103 K106 D107 A108 P109 H117R103-D111 IonicContact CZ-OD2 3.4Å; R103-D111 IonicContact NH1-OD2 2.63Å; R103-D111 PolarHBondContact NH1-OD2 3.37Å; R103-D111 IonicContact NH2-OD1 3.4Å; R103-D111 PolarHBondContact NH2-OD1 2.97Å; R103-D111 IonicContact NH2-OD2 3.96Å; R103-D111 PolarHBondContact NH2-OD2 3.13Å; K106-D111 VanDerWaalsContact C-CG 3.48Å; K106-D111 VanDerWaalsContact CA-OD2 3.24Å; K106-D111 WeakPolarHBondContact CA-OD2 3.2Å; K106-D111 HydrophobicContact CB-CB 4.07Å; K106-D111 VanDerWaalsContact O-CB 3.24Å; K106-D111 WeakPolarHBondContact O-CB 3.49Å; D107-D111 PolarHBondContact N-OD2 3.41Å; D107-D111 VanDerWaalsContact N-OD2 3.16Å; A108-D111 WeakPolarHBondContact CA-OD2 3.3Å; A108-D111 WeakPolarHBondContact CB-OD2 3.43Å; A108-D111 PolarHBondContact N-OD2 2.7Å; A108-D111 WeakPolarHBondContact O-CB 3.49Å; A108-D111 PolarHBondContact O-N 3.14Å; P109-D111 PolarHBondContact O-N 2.93Å; D111-H117 PolarHBondContact O-CD2 3.48Å; D111-H117 PolarHBondContact O-NE2 3.44Å
112H96.1Very high95.9Very high116 Ų11664.6 Ų64.654%0.53734%0.342SS..Hα-helixtrans-127.8-23.3-177.8-55.3-38.7000112.3K106 P109 V110 H117K106-H112 PolarHBondContact O-CE1 2.94Å; K106-H112 PolarHBondContact O-NE2 3.15Å; P109-H112 PolarHBondContact O-N 3.36Å; V110-H112 VanDerWaalsContact C-N 3.26Å; V110-H112 PolarHBondContact O-N 2.95Å; H112-H117 VanDerWaalsContact O-CB 3.27Å; H112-H117 WeakPolarHBondContact O-CB 3.36Å
113L95.8Very high95.8Very high52 Ų5263.2 Ų63.227%0.27234%0.337SS..Hα-helixtrans-125.23-172.4-52.3171.2000111.8P109 C118 D144 Q145 A148P109-L113 WeakPolarHBondContact O-CA 2.95Å; P109-L113 VanDerWaalsContact O-CB 3.25Å; P109-L113 WeakPolarHBondContact O-CB 3.33Å; P109-L113 PolarHBondContact O-N 3Å; L113-C118 PolarHBondContact O-SG 3.02Å; L113-C118 VanDerWaalsContact O-SG 3.41Å; L113-D144 HydrophobicContact CB-CB 3.82Å; L113-Q145 HydrophobicContact CD1-CB 4.25Å; L113-Q145 HydrophobicContact CD1-CG 3.59Å; L113-A148 HydrophobicContact CB-CB 4.12Å; L113-A148 HydrophobicContact CD2-CB 3.85Å
114G93.3Very high95.8Very high7 Ų766.7 Ų66.77%0.07236%0.361CS..SBendtrans-64.8175.117300000112.7V110 E116 H117 C118V110-G114 VanDerWaalsContact O-CA 3.24Å; V110-G114 WeakPolarHBondContact O-CA 3.45Å; V110-G114 PolarHBondContact O-N 3.45Å; G114-E116 PolarHBondContact O-N 3.03Å; G114-E116 VanDerWaalsContact O-N 3.13Å; G114-H117 PolarHBondContact O-N 3.33Å; G114-C118 PolarHBondContact O-N 2.89Å; G114-C118 PolarHBondContact O-SG 3.31Å
115V94Very high95.8Very high24 Ų2465.7 Ų65.715%0.14535%0.352CS..G310 helixtrans-54.1-33.8-179.955.30000112.8H117 C118 V132 S135 L136 L224 V228V115-H117 PolarHBondContact O-N 3.45Å; V115-H117 VanDerWaalsContact O-N 3.14Å; V115-C118 PolarHBondContact O-N 3.21Å; V115-V132 HydrophobicContact CG2-CG1 3.77Å; V115-S135 WeakPolarHBondContact CG2-OG 3.4Å; V115-L136 HydrophobicContact CB-CD2 3.96Å; V115-L136 HydrophobicContact CB-CG 4.44Å; V115-L136 HydrophobicContact CG1-CD2 4.29Å; V115-L136 HydrophobicContact CG2-CD1 4.26Å; V115-L136 HydrophobicContact CG2-CD2 3.81Å; V115-L136 HydrophobicContact CG2-CG 3.79Å; V115-L224 HydrophobicContact CG1-CD1 4.43Å; V115-V228 HydrophobicContact CG1-CG2 4Å; V115-V228 HydrophobicContact CG2-CG1 4.33Å; V115-V228 HydrophobicContact CG2-CG2 4.47Å
116E93.6Very high95.9Very high118 Ų11861.8 Ų61.855%0.55134%0.335SS*.G310 helixtrans-64.3-16.4179.6-66.2-176.6-164.900113.7G114 Y119 V228G114-E116 PolarHBondContact O-N 3.03Å; G114-E116 VanDerWaalsContact O-N 3.13Å; E116-Y119 WeakPolarHBondContact O-CE1 3.31Å; E116-Y119 PolarHBondContact O-OH 2.68Å; E116-V228 HydrophobicContact CG-CG1 4.24Å; E116-V228 HydrophobicContact CG-CG2 3.92Å
117H94.7Very high96Very high94 Ų9456.6 Ų56.644%0.43532%0.315SS..G310 helixtrans-113.7-3.2-179.1-57.6-66.1000113.2D111 H112 G114 V115 Y119D111-H117 PolarHBondContact O-CD2 3.48Å; D111-H117 PolarHBondContact O-NE2 3.44Å; H112-H117 VanDerWaalsContact O-CB 3.27Å; H112-H117 WeakPolarHBondContact O-CB 3.36Å; G114-H117 PolarHBondContact O-N 3.33Å; V115-H117 PolarHBondContact O-N 3.45Å; V115-H117 VanDerWaalsContact O-N 3.14Å; H117-Y119 PolarHBondContact O-N 2.93Å
118C94.8Very high96.1Very high4 Ų456.6 Ų56.63%0.02731%0.309CS..SBendtrans-92.615.9-173-750000114.6L113 G114 V115 M151 R155L113-C118 PolarHBondContact O-SG 3.02Å; L113-C118 VanDerWaalsContact O-SG 3.41Å; G114-C118 PolarHBondContact O-N 2.89Å; G114-C118 PolarHBondContact O-SG 3.31Å; V115-C118 PolarHBondContact O-N 3.21Å; C118-M151 HydrophobicContact CB-CB 4.43Å; C118-M151 HydrophobicContact CB-CG 4.17Å; C118-M151 VanDerWaalsContact O-CE 3.25Å; C118-M151 WeakPolarHBondContact O-CE 3.44Å; C118-R155 PolarHBondContact O-NH1 2.98Å
119Y96.5Very high96.1Very high61 Ų6158.3 Ų58.324%0.23932%0.315CS..SBendtrans-128.9159.1175.761.3-97.1000111.8E116 H117 R128 V132 R155 V228E116-Y119 WeakPolarHBondContact O-CE1 3.31Å; E116-Y119 PolarHBondContact O-OH 2.68Å; H117-Y119 PolarHBondContact O-N 2.93Å; Y119-R128 VanDerWaalsContact CD2-CD 3.46Å; Y119-R128 HydrophobicContact CD2-CG 3.33Å; Y119-R128 VanDerWaalsContact CE2-CD 3.45Å; Y119-R128 HydrophobicContact CE2-CG 3.85Å; Y119-R128 HydrophobicContact CG-CG 3.78Å; Y119-V132 HydrophobicContact CD1-CG2 3.41Å; Y119-V132 VanDerWaalsContact CD1-CG2 3.41Å; Y119-V132 HydrophobicContact CE1-CG2 4Å; Y119-V132 HydrophobicContact CG-CG2 3.96Å; Y119-R155 VanDerWaalsContact CA-NH1 3.27Å; Y119-R155 PolarHBondContact O-NH1 3.38Å; Y119-V228 HydrophobicContact CE1-CG1 3.92Å
120D96.1Very high96.2Very high61 Ų6156.6 Ų56.633%0.32630%0.304SS..  trans-80.9116.6172.7178.9-0.4000109.4S122 A123D120-S122 VanDerWaalsContact C-N 3.27Å; D120-S122 PolarHBondContact O-N 3.49Å; D120-S122 WeakPolarHBondContact OD1-CB 3.48Å; D120-S122 PolarHBondContact OD1-N 2.88Å; D120-S122 PolarHBondContact OD1-OG 2.94Å; D120-S122 PolarHBondContact OD2-OG 3.45Å; D120-A123 HydrophobicContact CB-CB 3.9Å; D120-A123 WeakPolarHBondContact O-CB 3.45Å; D120-A123 PolarHBondContact O-N 3.2Å; D120-A123 PolarHBondContact OD1-N 3.19Å
121S94.1Very high96.4Very high96 Ų9655.8 Ų55.867%0.67130%0.299SS*.THydrogen-bonded Turntrans-71.5-22.8-179.553.80000113
122S95.8Very high96.4Very high101 Ų10154.5 Ų54.571%0.70629%0.292SS*.THydrogen-bonded Turntrans-84-14.9177.374.50000113.1D120D120-S122 VanDerWaalsContact C-N 3.27Å; D120-S122 PolarHBondContact O-N 3.49Å; D120-S122 WeakPolarHBondContact OD1-CB 3.48Å; D120-S122 PolarHBondContact OD1-N 2.88Å; D120-S122 PolarHBondContact OD1-OG 2.94Å; D120-S122 PolarHBondContact OD2-OG 3.45Å
123A96.2Very high96.6Very high12 Ų1249 Ų4910%0.09927%0.266CS..SBendtrans-68.7151.9179.500000112.1D120 V127D120-A123 HydrophobicContact CB-CB 3.9Å; D120-A123 WeakPolarHBondContact O-CB 3.45Å; D120-A123 PolarHBondContact O-N 3.2Å; D120-A123 PolarHBondContact OD1-N 3.19Å; A123-V127 HydrophobicContact CB-CB 4.11Å; A123-V127 HydrophobicContact CB-CG1 3.88Å
124P97.6Very high96.7Very high84 Ų8446.5 Ų46.555%0.54525%0.253SS..  trans-53147174.1-26.634.5000112K126 V127 R128P124-K126 VanDerWaalsContact C-N 3.27Å; P124-K126 PolarHBondContact O-N 3.04Å; P124-K126 VanDerWaalsContact O-N 3.08Å; P124-V127 HydrophobicContact CB-CG2 4.31Å; P124-V127 HydrophobicContact CG-CG2 4.38Å; P124-V127 WeakPolarHBondContact O-CA 3.26Å; P124-V127 WeakPolarHBondContact O-CB 3.39Å; P124-V127 PolarHBondContact O-N 3.12Å; P124-R128 PolarHBondContact O-N 3.41Å
125P97.7Very high96.9Very high67 Ų6746.2 Ų46.244%0.43525%0.251SS..Hα-helixtrans-51.2-42.3-173.3-30.435.3000114.5V127 R128 R129P125-V127 PolarHBondContact O-N 3.06Å; P125-R128 WeakPolarHBondContact O-CB 3.35Å; P125-R128 PolarHBondContact O-N 3.28Å; P125-R129 WeakPolarHBondContact O-CG 3.25Å; P125-R129 PolarHBondContact O-N 3.01Å
126K97.8Very high97.2Very high87 Ų8745.2 Ų45.238%0.37824%0.244SC..Hα-helixtrans-59.9-44.4176.2177.2-179.4179.6-1660112.8P124 R129 Y130 G201 G202 D203P124-K126 VanDerWaalsContact C-N 3.27Å; P124-K126 PolarHBondContact O-N 3.04Å; P124-K126 VanDerWaalsContact O-N 3.08Å; K126-R129 PolarHBondContact O-N 3.35Å; K126-Y130 PolarHBondContact O-N 3.33Å; K126-Y130 VanDerWaalsContact O-N 3.11Å; K126-G201 WeakPolarHBondContact CE-O 3.24Å; K126-G201 PolarHBondContact NZ-O 2.97Å; K126-G202 WeakPolarHBondContact CE-O 3.47Å; K126-D203 HydrophobicContact CD-CB 4.29Å; K126-D203 HydrophobicContact CG-CB 3.87Å
127V98.4Very high97.4Very high33 Ų3340 Ų4020%0.222%0.22CC..Hα-helixtrans-65.7-45.6177.3176.50000109.9A123 P124 P125 R129 Y130 Q131 L159 T160A123-V127 HydrophobicContact CB-CB 4.11Å; A123-V127 HydrophobicContact CB-CG1 3.88Å; P124-V127 HydrophobicContact CB-CG2 4.31Å; P124-V127 HydrophobicContact CG-CG2 4.38Å; P124-V127 WeakPolarHBondContact O-CA 3.26Å; P124-V127 WeakPolarHBondContact O-CB 3.39Å; P124-V127 PolarHBondContact O-N 3.12Å; P125-V127 PolarHBondContact O-N 3.06Å; V127-R129 VanDerWaalsContact C-N 3.34Å; V127-R129 PolarHBondContact O-N 3.35Å; V127-Y130 WeakPolarHBondContact O-CB 3.33Å; V127-Y130 PolarHBondContact O-N 2.87Å; V127-Q131 HydrophobicContact CG1-CG 4.4Å; V127-Q131 VanDerWaalsContact O-CG 3.31Å; V127-Q131 WeakPolarHBondContact O-CG 3.42Å; V127-Q131 PolarHBondContact O-N 3.16Å; V127-L159 WeakPolarHBondContact CG1-O 3.34Å; V127-T160 HydrophobicContact CG1-CG2 4.18Å; V127-T160 HydrophobicContact CG2-CG2 4.13Å
128R98.3Very high97.6Very high80 Ų8035.5 Ų35.530%0.30220%0.199SC..Hα-helixtrans-56.1-46.9177-176.317364.9-136.75.1112.2Y119 P124 P125 Y130 Q131 V132Y119-R128 VanDerWaalsContact CD2-CD 3.46Å; Y119-R128 HydrophobicContact CD2-CG 3.33Å; Y119-R128 VanDerWaalsContact CE2-CD 3.45Å; Y119-R128 HydrophobicContact CE2-CG 3.85Å; Y119-R128 HydrophobicContact CG-CG 3.78Å; P124-R128 PolarHBondContact O-N 3.41Å; P125-R128 WeakPolarHBondContact O-CB 3.35Å; P125-R128 PolarHBondContact O-N 3.28Å; R128-Y130 PolarHBondContact O-N 3.02Å; R128-Q131 PolarHBondContact O-N 2.96Å; R128-V132 WeakPolarHBondContact O-CG2 3.41Å; R128-V132 PolarHBondContact O-N 3.23Å
129R98.6Very high97.6Very high37 Ų3736.6 Ų36.614%0.1421%0.207CC..Hα-helixtrans-61.3-42.2177.5-72.8-169.9-75.6-91.13.9112.8P125 K126 V127 Q131 V132 L133 D203 I204 A229 W230P125-R129 WeakPolarHBondContact O-CG 3.25Å; P125-R129 PolarHBondContact O-N 3.01Å; K126-R129 PolarHBondContact O-N 3.35Å; V127-R129 VanDerWaalsContact C-N 3.34Å; V127-R129 PolarHBondContact O-N 3.35Å; R129-Q131 VanDerWaalsContact C-N 3.35Å; R129-Q131 PolarHBondContact O-N 2.85Å; R129-V132 WeakPolarHBondContact O-CB 3.42Å; R129-V132 PolarHBondContact O-N 3.4Å; R129-L133 PolarHBondContact O-N 3.45Å; R129-D203 IonicContact CZ-OD1 3.8Å; R129-D203 IonicContact CZ-OD2 3.3Å; R129-D203 VanDerWaalsContact CZ-OD2 3.3Å; R129-D203 IonicContact NE-OD1 2.93Å; R129-D203 PolarHBondContact NE-OD1 2.97Å; R129-D203 IonicContact NE-OD2 3.17Å; R129-D203 PolarHBondContact NE-OD2 2.92Å; R129-D203 IonicContact NH2-OD1 3.8Å; R129-D203 IonicContact NH2-OD2 2.66Å; R129-D203 PolarHBondContact NH2-OD2 3.11Å; R129-I204 HydrophobicContact CB-CD1 3.84Å; R129-I204 HydrophobicContact CB-CG1 3.96Å; R129-I204 HydrophobicContact CG-CD1 4.45Å; R129-A229 HydrophobicContact CB-CB 4.12Å; R129-A229 HydrophobicContact CG-CB 3.79Å; R129-A229 WeakPolarHBondContact CG-O 3.47Å; R129-W230 VanDerWaalsContact CD-CH2 3.44Å
130Y98.8Very high97.5Very high2 Ų235.5 Ų35.51%0.00821%0.208CC..Hα-helixtrans-61.6-42.8174.6178.8-109.8000112.2K126 V127 R128 V132 L133 L134 L159 T160 V161 I164 S193 L196K126-Y130 PolarHBondContact O-N 3.33Å; K126-Y130 VanDerWaalsContact O-N 3.11Å; V127-Y130 WeakPolarHBondContact O-CB 3.33Å; V127-Y130 PolarHBondContact O-N 2.87Å; R128-Y130 PolarHBondContact O-N 3.02Å; Y130-V132 PolarHBondContact O-N 3.17Å; Y130-L133 PolarHBondContact O-N 2.98Å; Y130-L134 HydrophobicContact CD1-CD1 4.46Å; Y130-L134 HydrophobicContact CD1-CD2 4.37Å; Y130-L134 HydrophobicContact CD2-CD1 3.85Å; Y130-L134 HydrophobicContact CE1-CD1 3.99Å; Y130-L134 HydrophobicContact CE1-CD2 3.55Å; Y130-L134 HydrophobicContact CE1-CG 4.39Å; Y130-L134 HydrophobicContact CE2-CD1 3.3Å; Y130-L134 HydrophobicContact CE2-CD2 4.36Å; Y130-L134 HydrophobicContact CE2-CG 4.46Å; Y130-L134 HydrophobicContact CG-CD1 4.41Å; Y130-L134 PolarHBondContact O-N 3.48Å; Y130-L134 WeakPolarHBondContact OH-CD2 3.41Å; Y130-L159 HydrophobicContact CE1-CD1 4.03Å; Y130-L159 HydrophobicContact CE1-CG 4.34Å; Y130-T160 WeakPolarHBondContact CE1-O 3.13Å; Y130-V161 HydrophobicContact CD1-CG2 4.29Å; Y130-V161 HydrophobicContact CD2-CG2 3.47Å; Y130-V161 VanDerWaalsContact CD2-CG2 3.47Å; Y130-V161 HydrophobicContact CE1-CG2 4.32Å; Y130-V161 HydrophobicContact CE2-CB 4.49Å; Y130-V161 HydrophobicContact CE2-CG2 3.49Å; Y130-V161 VanDerWaalsContact CE2-CG2 3.49Å; Y130-V161 HydrophobicContact CG-CG2 3.87Å; Y130-I164 HydrophobicContact CE1-CG1 4.14Å; Y130-I164 WeakPolarHBondContact OH-CB 3.29Å; Y130-I164 VanDerWaalsContact OH-CG1 3.29Å; Y130-I164 WeakPolarHBondContact OH-CG1 3.33Å; Y130-I164 WeakPolarHBondContact OH-CG2 3.3Å; Y130-S193 PolarHBondContact OH-OG 3.46Å; Y130-L196 HydrophobicContact CD2-CD1 3.68Å; Y130-L196 HydrophobicContact CE2-CD1 3.9Å
131Q98.7Very high97.3Very high7 Ų740.1 Ų40.13%0.03323%0.228CC..Hα-helixtrans-63.6-39.9176.2-65-178.48.100112.2V127 R128 R129 L134 S135 M151 L159V127-Q131 HydrophobicContact CG1-CG 4.4Å; V127-Q131 VanDerWaalsContact O-CG 3.31Å; V127-Q131 WeakPolarHBondContact O-CG 3.42Å; V127-Q131 PolarHBondContact O-N 3.16Å; R128-Q131 PolarHBondContact O-N 2.96Å; R129-Q131 VanDerWaalsContact C-N 3.35Å; R129-Q131 PolarHBondContact O-N 2.85Å; Q131-L134 PolarHBondContact O-N 3.4Å; Q131-S135 WeakPolarHBondContact O-CB 3.45Å; Q131-S135 PolarHBondContact O-N 2.98Å; Q131-M151 HydrophobicContact CB-CE 4.14Å; Q131-M151 WeakPolarHBondContact O-CE 3.31Å; Q131-L159 HydrophobicContact CB-CD2 4.35Å; Q131-L159 HydrophobicContact CG-CB 4.22Å; Q131-L159 HydrophobicContact CG-CD2 3.81Å; Q131-L159 HydrophobicContact CG-CG 3.93Å; Q131-L159 PolarHBondContact NE2-O 3.38Å
132V98.6Very high97.4Very high1 Ų136.6 Ų36.61%0.00620%0.202CC..Hα-helixtrans-56.7-50.9171.71690000110.5V115 Y119 R128 R129 Y130 L134 S135 L136 V228 A229V115-V132 HydrophobicContact CG2-CG1 3.77Å; Y119-V132 HydrophobicContact CD1-CG2 3.41Å; Y119-V132 VanDerWaalsContact CD1-CG2 3.41Å; Y119-V132 HydrophobicContact CE1-CG2 4Å; Y119-V132 HydrophobicContact CG-CG2 3.96Å; R128-V132 WeakPolarHBondContact O-CG2 3.41Å; R128-V132 PolarHBondContact O-N 3.23Å; R129-V132 WeakPolarHBondContact O-CB 3.42Å; R129-V132 PolarHBondContact O-N 3.4Å; Y130-V132 PolarHBondContact O-N 3.17Å; V132-L134 PolarHBondContact O-N 3.13Å; V132-S135 PolarHBondContact O-N 3.23Å; V132-S135 PolarHBondContact O-OG 3.45Å; V132-L136 HydrophobicContact CG1-CD1 4.16Å; V132-L136 WeakPolarHBondContact O-CG 3.44Å; V132-L136 PolarHBondContact O-N 2.87Å; V132-L136 VanDerWaalsContact O-N 3.15Å; V132-V228 HydrophobicContact CG1-CB 4.09Å; V132-V228 HydrophobicContact CG1-CG1 4.07Å; V132-V228 HydrophobicContact CG2-CG1 3.93Å; V132-A229 HydrophobicContact CB-CB 4.17Å; V132-A229 HydrophobicContact CG1-CB 3.9Å
133L98.8Very high97.3Very high0 Ų039.3 Ų39.30%020%0.201CC..Hα-helixtrans-58.8-46.7179.2178.363.2000112.1R129 Y130 S135 L136 M137 T192 L196 I204 L211 L214 V217R129-L133 PolarHBondContact O-N 3.45Å; Y130-L133 PolarHBondContact O-N 2.98Å; L133-S135 VanDerWaalsContact C-N 3.35Å; L133-S135 PolarHBondContact O-N 3.2Å; L133-L136 WeakPolarHBondContact O-CB 3.31Å; L133-L136 PolarHBondContact O-N 3.47Å; L133-M137 HydrophobicContact CD1-CG 4.5Å; L133-M137 HydrophobicContact CG-SD 4.22Å; L133-M137 WeakPolarHBondContact O-CG 3.42Å; L133-M137 PolarHBondContact O-N 3.33Å; L133-T192 HydrophobicContact CD2-CG2 3.99Å; L133-L196 HydrophobicContact CD2-CD1 4.1Å; L133-I204 HydrophobicContact CB-CG2 3.95Å; L133-I204 HydrophobicContact CD2-CB 4.25Å; L133-I204 HydrophobicContact CD2-CG2 3.55Å; L133-I204 HydrophobicContact CG-CG2 4.39Å; L133-L211 HydrophobicContact CD1-CD2 4.39Å; L133-L214 HydrophobicContact CD2-CD1 3.9Å; L133-V217 HydrophobicContact CD1-CG2 4.01Å
134L98.5Very high97.3Very high0 Ų040.1 Ų40.10%020%0.204CC..Hα-helixtrans-63.6-40179.2-98.659.9000112.4Y130 Q131 V132 L136 M137 L138 M151 L159 I164 I189Y130-L134 HydrophobicContact CD1-CD1 4.46Å; Y130-L134 HydrophobicContact CD1-CD2 4.37Å; Y130-L134 HydrophobicContact CD2-CD1 3.85Å; Y130-L134 HydrophobicContact CE1-CD1 3.99Å; Y130-L134 HydrophobicContact CE1-CD2 3.55Å; Y130-L134 HydrophobicContact CE1-CG 4.39Å; Y130-L134 HydrophobicContact CE2-CD1 3.3Å; Y130-L134 HydrophobicContact CE2-CD2 4.36Å; Y130-L134 HydrophobicContact CE2-CG 4.46Å; Y130-L134 HydrophobicContact CG-CD1 4.41Å; Y130-L134 PolarHBondContact O-N 3.48Å; Y130-L134 WeakPolarHBondContact OH-CD2 3.41Å; Q131-L134 PolarHBondContact O-N 3.4Å; V132-L134 PolarHBondContact O-N 3.13Å; L134-L136 VanDerWaalsContact C-N 3.27Å; L134-L136 PolarHBondContact O-N 3.41Å; L134-M137 HydrophobicContact CD1-SD 4.36Å; L134-M137 PolarHBondContact O-N 3.35Å; L134-L138 WeakPolarHBondContact O-CB 3.49Å; L134-L138 VanDerWaalsContact O-CG 3.3Å; L134-L138 WeakPolarHBondContact O-CG 3.48Å; L134-L138 PolarHBondContact O-N 2.91Å; L134-M151 HydrophobicContact CB-CE 4.43Å; L134-M151 HydrophobicContact CB-SD 4.31Å; L134-L159 HydrophobicContact CD2-CD1 3.6Å; L134-L159 HydrophobicContact CD2-CD2 4.18Å; L134-L159 HydrophobicContact CD2-CG 4.24Å; L134-I164 HydrophobicContact CD2-CD1 4.38Å; L134-I164 HydrophobicContact CD2-CG1 4.21Å; L134-I189 HydrophobicContact CD2-CG2 4.25Å; L134-I189 HydrophobicContact CG-CG2 4.38Å
135S98.5Very high97.3Very high2 Ų240.8 Ų40.81%0.01420%0.2CC..Hα-helixtrans-59.9-39.7176.176.10000111.9V115 Q131 V132 L133 L138 S139V115-S135 WeakPolarHBondContact CG2-OG 3.4Å; Q131-S135 WeakPolarHBondContact O-CB 3.45Å; Q131-S135 PolarHBondContact O-N 2.98Å; V132-S135 PolarHBondContact O-N 3.23Å; V132-S135 PolarHBondContact O-OG 3.45Å; L133-S135 VanDerWaalsContact C-N 3.35Å; L133-S135 PolarHBondContact O-N 3.2Å; S135-L138 PolarHBondContact O-N 2.95Å; S135-S139 WeakPolarHBondContact O-CB 3.41Å; S135-S139 PolarHBondContact O-N 3.4Å
136L98.3Very high97.3Very high2 Ų239.7 Ų39.71%0.0119%0.192CC..Hα-helixtrans-67-43.4176.3-68.7167.8000112.1V115 V132 L133 L134 L138 S139 M221 L224 A225V115-L136 HydrophobicContact CB-CD2 3.96Å; V115-L136 HydrophobicContact CB-CG 4.44Å; V115-L136 HydrophobicContact CG1-CD2 4.29Å; V115-L136 HydrophobicContact CG2-CD1 4.26Å; V115-L136 HydrophobicContact CG2-CD2 3.81Å; V115-L136 HydrophobicContact CG2-CG 3.79Å; V132-L136 HydrophobicContact CG1-CD1 4.16Å; V132-L136 WeakPolarHBondContact O-CG 3.44Å; V132-L136 PolarHBondContact O-N 2.87Å; V132-L136 VanDerWaalsContact O-N 3.15Å; L133-L136 WeakPolarHBondContact O-CB 3.31Å; L133-L136 PolarHBondContact O-N 3.47Å; L134-L136 VanDerWaalsContact C-N 3.27Å; L134-L136 PolarHBondContact O-N 3.41Å; L136-L138 VanDerWaalsContact C-N 3.29Å; L136-L138 PolarHBondContact O-N 2.91Å; L136-S139 PolarHBondContact O-N 3.11Å; L136-S139 PolarHBondContact O-OG 3.34Å; L136-S139 VanDerWaalsContact O-OG 3.09Å; L136-M221 HydrophobicContact CB-CB 4.3Å; L136-M221 HydrophobicContact CB-CG 4.23Å; L136-M221 WeakPolarHBondContact CD1-O 3.24Å; L136-M221 VanDerWaalsContact O-CE 3.28Å; L136-M221 WeakPolarHBondContact O-CE 3.33Å; L136-L224 HydrophobicContact CD1-CB 4.04Å; L136-L224 HydrophobicContact CD2-CB 3.77Å; L136-L224 HydrophobicContact CD2-CD1 3.53Å; L136-L224 HydrophobicContact CD2-CG 4.32Å; L136-A225 HydrophobicContact CD1-CB 3.85Å
137M98.4Very high97.3Very high8 Ų835.7 Ų35.74%0.03918%0.175CC..Hα-helixtrans-60.2-42.3175.5-67.1176.176.400111L133 L134 S140 K185 I189 T192 P215 V217L133-M137 HydrophobicContact CD1-CG 4.5Å; L133-M137 HydrophobicContact CG-SD 4.22Å; L133-M137 WeakPolarHBondContact O-CG 3.42Å; L133-M137 PolarHBondContact O-N 3.33Å; L134-M137 HydrophobicContact CD1-SD 4.36Å; L134-M137 PolarHBondContact O-N 3.35Å; M137-S140 PolarHBondContact O-OG 3.15Å; M137-K185 WeakPolarHBondContact O-CE 3.42Å; M137-I189 HydrophobicContact CE-CG1 3.99Å; M137-I189 HydrophobicContact SD-CG1 4.35Å; M137-T192 WeakPolarHBondContact CE-OG1 3.44Å; M137-T192 HydrophobicContact SD-CG2 4.25Å; M137-P215 WeakPolarHBondContact CE-O 3.32Å; M137-V217 HydrophobicContact CG-CG2 4.13Å; M137-V217 HydrophobicContact SD-CG2 4.39Å
138L98.3Very high97.3Very high0 Ų035 Ų350%017%0.173CC..Hα-helixtrans-70.7-31.4177.7-67.2-179.1000113.2L134 S135 L136 S140 T142 T147 A150 M151 L154 I176 V179 K185 I189L134-L138 WeakPolarHBondContact O-CB 3.49Å; L134-L138 VanDerWaalsContact O-CG 3.3Å; L134-L138 WeakPolarHBondContact O-CG 3.48Å; L134-L138 PolarHBondContact O-N 2.91Å; S135-L138 PolarHBondContact O-N 2.95Å; L136-L138 VanDerWaalsContact C-N 3.29Å; L136-L138 PolarHBondContact O-N 2.91Å; L138-S140 VanDerWaalsContact C-N 3.28Å; L138-S140 PolarHBondContact O-N 3.45Å; L138-T142 WeakPolarHBondContact O-CB 3.4Å; L138-T142 PolarHBondContact O-OG1 3.31Å; L138-T147 HydrophobicContact CB-CG2 4.04Å; L138-A150 HydrophobicContact CD1-CB 4.14Å; L138-M151 HydrophobicContact CD1-CG 4.31Å; L138-M151 HydrophobicContact CD1-SD 3.73Å; L138-L154 HydrophobicContact CD1-CD1 3.91Å; L138-I176 HydrophobicContact CD1-CG2 4.25Å; L138-I176 HydrophobicContact CD2-CB 4.12Å; L138-I176 HydrophobicContact CD2-CD1 3.99Å; L138-I176 HydrophobicContact CD2-CG2 4.06Å; L138-V179 HydrophobicContact CB-CG1 4.45Å; L138-V179 HydrophobicContact CD2-CG1 4.11Å; L138-V179 HydrophobicContact CD2-CG2 4.47Å; L138-V179 WeakPolarHBondContact O-CG1 3.29Å; L138-K185 HydrophobicContact CD2-CD 4.23Å; L138-K185 PolarHBondContact O-NZ 2.8Å; L138-I189 HydrophobicContact CD2-CD1 3.71Å; L138-I189 HydrophobicContact CG-CD1 4.35Å
139S96.6Very high97.3Very high28 Ų2832.1 Ų32.120%0.19617%0.167CC..Hα-helixtrans-70.3-20-176.685.70000114.1S135 L136 Q141 T142 T147S135-S139 WeakPolarHBondContact O-CB 3.41Å; S135-S139 PolarHBondContact O-N 3.4Å; L136-S139 PolarHBondContact O-N 3.11Å; L136-S139 PolarHBondContact O-OG 3.34Å; L136-S139 VanDerWaalsContact O-OG 3.09Å; S139-Q141 PolarHBondContact O-N 3Å; S139-Q141 VanDerWaalsContact O-N 3.1Å; S139-T142 PolarHBondContact O-N 3.21Å; S139-T142 VanDerWaalsContact O-N 3.11Å; S139-T147 WeakPolarHBondContact CA-OG1 3.29Å
140S93.4Very high97.3Very high38 Ų3830.3 Ų30.327%0.26616%0.161SC..THydrogen-bonded Turntrans-55.7120.2178.555.50000111.6M137 L138 T142 K185M137-S140 PolarHBondContact O-OG 3.15Å; L138-S140 VanDerWaalsContact C-N 3.28Å; L138-S140 PolarHBondContact O-N 3.45Å; S140-T142 PolarHBondContact O-N 3.42Å; S140-T142 VanDerWaalsContact O-N 3.16Å; S140-T142 PolarHBondContact O-OG1 2.95Å; S140-K185 PolarHBondContact O-NZ 3.23Å; S140-K185 WeakPolarHBondContact OG-CE 3.33Å; S140-K185 PolarHBondContact OG-NZ 3.27Å
141Q92.6Very high97.3Very high157 Ų15730.3 Ų30.373%0.73416%0.16SC*.THydrogen-bonded Turntrans51.238.1-179.2-57.4178.577.300112.9S139 F181S139-Q141 PolarHBondContact O-N 3Å; S139-Q141 VanDerWaalsContact O-N 3.1Å; Q141-F181 HydrophobicContact CB-CD2 4.37Å; Q141-F181 HydrophobicContact CB-CE2 4.03Å; Q141-F181 HydrophobicContact CG-CE2 4.49Å
142T95.3Very high97.3Very high22 Ų2236.1 Ų36.114%0.13519%0.188CC..SBendtrans-140140.8179.4-60.80000108.9L138 S139 S140 V146 T147 V179 G180 K185L138-T142 WeakPolarHBondContact O-CB 3.4Å; L138-T142 PolarHBondContact O-OG1 3.31Å; S139-T142 PolarHBondContact O-N 3.21Å; S139-T142 VanDerWaalsContact O-N 3.11Å; S140-T142 PolarHBondContact O-N 3.42Å; S140-T142 VanDerWaalsContact O-N 3.16Å; S140-T142 PolarHBondContact O-OG1 2.95Å; T142-V146 HydrophobicContact CG2-CB 3.73Å; T142-V146 HydrophobicContact CG2-CG1 3.69Å; T142-T147 WeakPolarHBondContact CG2-OG1 3.41Å; T142-V179 HydrophobicContact CG2-CB 4.31Å; T142-V179 HydrophobicContact CG2-CG1 4.12Å; T142-V179 HydrophobicContact CG2-CG2 4.15Å; T142-G180 PolarHBondContact OG1-N 2.94Å; T142-K185 PolarHBondContact OG1-NZ 2.67Å; T142-K185 VanDerWaalsContact OG1-NZ 3.12Å
143K94.9Very high97.3Very high159 Ų15940.4 Ų40.469%0.69120%0.204SC*.  trans-69.5146.4178.4-64-178.5179.6179.20110.7Q145 V146 T147K143-Q145 VanDerWaalsContact C-N 3.29Å; K143-Q145 PolarHBondContact O-N 2.83Å; K143-V146 HydrophobicContact CB-CG2 4.38Å; K143-V146 WeakPolarHBondContact O-CB 3.07Å; K143-V146 PolarHBondContact O-N 2.67Å; K143-T147 PolarHBondContact O-N 3.16Å
144D96.1Very high97.3Very high28 Ų2840.7 Ų40.715%0.1521%0.205CC..Hα-helixtrans-54.5-41.4-177.1-57.7-25.5000112.7P109 V110 L113 V146 T147 A148 Q287P109-D144 HydrophobicContact CB-CB 4.25Å; V110-D144 PolarHBondContact N-OD2 2.77Å; L113-D144 HydrophobicContact CB-CB 3.82Å; D144-V146 VanDerWaalsContact C-N 3.31Å; D144-V146 PolarHBondContact O-N 3.45Å; D144-T147 PolarHBondContact O-N 2.95Å; D144-A148 VanDerWaalsContact O-CB 3.31Å; D144-A148 WeakPolarHBondContact O-CB 3.35Å; D144-A148 PolarHBondContact O-N 3.14Å; D144-Q287 PolarHBondContact OD2-NE2 3.21Å
145Q96.9Very high97.2Very high99 Ų9944.3 Ų44.346%0.46322%0.219SC..Hα-helixtrans-59.3-40.1176.6-62.678.47.300112.9L113 K143 G149L113-Q145 HydrophobicContact CD1-CB 4.25Å; L113-Q145 HydrophobicContact CD1-CG 3.59Å; K143-Q145 VanDerWaalsContact C-N 3.29Å; K143-Q145 PolarHBondContact O-N 2.83Å; Q145-G149 PolarHBondContact O-N 3.47Å
146V98.1Very high97.1Very high43 Ų4347.9 Ų47.926%0.26125%0.249SC..Hα-helixtrans-72.2-41.3-178.8178.10000109.9T142 K143 D144 A150 P178 V179T142-V146 HydrophobicContact CG2-CB 3.73Å; T142-V146 HydrophobicContact CG2-CG1 3.69Å; K143-V146 HydrophobicContact CB-CG2 4.38Å; K143-V146 WeakPolarHBondContact O-CB 3.07Å; K143-V146 PolarHBondContact O-N 2.67Å; D144-V146 VanDerWaalsContact C-N 3.31Å; D144-V146 PolarHBondContact O-N 3.45Å; V146-A150 PolarHBondContact O-N 2.78Å; V146-P178 HydrophobicContact CG1-CG 3.96Å; V146-V179 HydrophobicContact CG1-CG2 4.07Å
147T98.2Very high97.1Very high4 Ų454 Ų543%0.02528%0.277CS..Hα-helixtrans-63.9-48.1175.4-64.40000111.7L138 S139 T142 K143 D144 G149 A150 M151L138-T147 HydrophobicContact CB-CG2 4.04Å; S139-T147 WeakPolarHBondContact CA-OG1 3.29Å; T142-T147 WeakPolarHBondContact CG2-OG1 3.41Å; K143-T147 PolarHBondContact O-N 3.16Å; D144-T147 PolarHBondContact O-N 2.95Å; T147-G149 VanDerWaalsContact C-N 3.34Å; T147-G149 PolarHBondContact O-N 3.34Å; T147-A150 PolarHBondContact O-N 3.03Å; T147-M151 HydrophobicContact CG2-CG 4.46Å; T147-M151 WeakPolarHBondContact O-CG 3.39Å; T147-M151 PolarHBondContact O-N 2.59Å
148A97.9Very high96.9Very high19 Ų1955.6 Ų55.616%0.15730%0.296CS..Hα-helixtrans-60.3-43.4178.300000111.7L113 D144 A150 M151 Q152L113-A148 HydrophobicContact CB-CB 4.12Å; L113-A148 HydrophobicContact CD2-CB 3.85Å; D144-A148 VanDerWaalsContact O-CB 3.31Å; D144-A148 WeakPolarHBondContact O-CB 3.35Å; D144-A148 PolarHBondContact O-N 3.14Å; A148-A150 VanDerWaalsContact C-N 3.35Å; A148-A150 PolarHBondContact O-N 2.95Å; A148-M151 PolarHBondContact O-N 3.44Å; A148-Q152 WeakPolarHBondContact O-CB 3.41Å; A148-Q152 PolarHBondContact O-N 3.31Å
149G98.2Very high96.9Very high18 Ų1855.8 Ų55.819%0.18630%0.296CS..Hα-helixtrans-62.3-38.9175.100000113.2Q145 T147 R153Q145-G149 PolarHBondContact O-N 3.47Å; T147-G149 VanDerWaalsContact C-N 3.34Å; T147-G149 PolarHBondContact O-N 3.34Å; G149-R153 PolarHBondContact O-N 3.13Å; G149-R153 PolarHBondContact O-NH1 2.82Å
150A98.5Very high97Very high0 Ų056.5 Ų56.50%030%0.3CS..Hα-helixtrans-66-44.9173.700000112.1L138 V146 T147 A148 Q152 R153 L154 I176 V179L138-A150 HydrophobicContact CD1-CB 4.14Å; V146-A150 PolarHBondContact O-N 2.78Å; T147-A150 PolarHBondContact O-N 3.03Å; A148-A150 VanDerWaalsContact C-N 3.35Å; A148-A150 PolarHBondContact O-N 2.95Å; A150-Q152 VanDerWaalsContact C-N 3.32Å; A150-Q152 PolarHBondContact O-N 3.33Å; A150-R153 PolarHBondContact O-N 3.21Å; A150-L154 WeakPolarHBondContact O-CG 3.42Å; A150-L154 PolarHBondContact O-N 2.78Å; A150-I176 HydrophobicContact CB-CB 4.48Å; A150-V179 HydrophobicContact CB-CG2 3.69Å
151M98.6Very high97.2Very high1 Ų155 Ų551%0.00529%0.289CS..Hα-helixtrans-61.5-39.7176.2-72.4-58.4-62.200111.9C118 Q131 L134 L138 T147 A148 L154 R155 L159C118-M151 HydrophobicContact CB-CB 4.43Å; C118-M151 HydrophobicContact CB-CG 4.17Å; C118-M151 VanDerWaalsContact O-CE 3.25Å; C118-M151 WeakPolarHBondContact O-CE 3.44Å; Q131-M151 HydrophobicContact CB-CE 4.14Å; Q131-M151 WeakPolarHBondContact O-CE 3.31Å; L134-M151 HydrophobicContact CB-CE 4.43Å; L134-M151 HydrophobicContact CB-SD 4.31Å; L138-M151 HydrophobicContact CD1-CG 4.31Å; L138-M151 HydrophobicContact CD1-SD 3.73Å; T147-M151 HydrophobicContact CG2-CG 4.46Å; T147-M151 WeakPolarHBondContact O-CG 3.39Å; T147-M151 PolarHBondContact O-N 2.59Å; A148-M151 PolarHBondContact O-N 3.44Å; M151-L154 PolarHBondContact O-N 2.74Å; M151-L154 HydrophobicContact SD-CD1 4.21Å; M151-R155 WeakPolarHBondContact O-CB 3.22Å; M151-R155 VanDerWaalsContact O-CG 3.29Å; M151-R155 WeakPolarHBondContact O-CG 3.49Å; M151-R155 PolarHBondContact O-N 2.84Å; M151-L159 HydrophobicContact CE-CD2 3.46Å; M151-L159 VanDerWaalsContact CE-CD2 3.46Å; M151-L159 HydrophobicContact SD-CD2 4.27Å
152Q98.2Very high97.5Very high130 Ų13051.3 Ų51.361%0.60728%0.275SS*.Hα-helixtrans-59.3-48.9174.8-175.6-174-3.100111.7A148 A150 L154 R155 A156A148-Q152 WeakPolarHBondContact O-CB 3.41Å; A148-Q152 PolarHBondContact O-N 3.31Å; A150-Q152 VanDerWaalsContact C-N 3.32Å; A150-Q152 PolarHBondContact O-N 3.33Å; Q152-L154 PolarHBondContact O-N 3.06Å; Q152-R155 PolarHBondContact O-N 3.49Å; Q152-A156 WeakPolarHBondContact O-CB 3.38Å; Q152-A156 PolarHBondContact O-N 3.24Å
153R98.4Very high97.6Very high91 Ų9151.3 Ų51.334%0.34328%0.275SS..Hα-helixtrans-63-41178.5-70.2-173.1-57.2-93.30.3112.4G149 A150 A156 L175 Y177G149-R153 PolarHBondContact O-N 3.13Å; G149-R153 PolarHBondContact O-NH1 2.82Å; A150-R153 PolarHBondContact O-N 3.21Å; R153-A156 PolarHBondContact O-N 3.13Å; R153-L175 HydrophobicContact CB-CD2 4.24Å; R153-L175 PolarHBondContact NE-O 3.4Å; R153-L175 PolarHBondContact NH2-O 3.37Å; R153-Y177 PolarHBondContact NH2-O 3.45Å
154L98.4Very high97.8Very high5 Ų543.9 Ų43.93%0.02624%0.243CC..Hα-helixtrans-63.5-46.1175.5-72174.1000111.7L138 A150 M151 Q152 A156 Q157 L159 I164 L172 L175 I176L138-L154 HydrophobicContact CD1-CD1 3.91Å; A150-L154 WeakPolarHBondContact O-CG 3.42Å; A150-L154 PolarHBondContact O-N 2.78Å; M151-L154 PolarHBondContact O-N 2.74Å; M151-L154 HydrophobicContact SD-CD1 4.21Å; Q152-L154 PolarHBondContact O-N 3.06Å; L154-A156 VanDerWaalsContact C-N 3.29Å; L154-A156 PolarHBondContact O-N 3.32Å; L154-Q157 PolarHBondContact O-N 3.41Å; L154-L159 HydrophobicContact CB-CB 4.46Å; L154-L159 HydrophobicContact CB-CD1 4.08Å; L154-L159 HydrophobicContact CB-CD2 3.85Å; L154-L159 HydrophobicContact CB-CG 4.36Å; L154-L159 HydrophobicContact CD1-CD1 4.48Å; L154-L159 HydrophobicContact CD1-CD2 4.31Å; L154-I164 HydrophobicContact CD2-CD1 4.21Å; L154-L172 HydrophobicContact CD2-CD1 3.64Å; L154-L175 HydrophobicContact CD2-CB 3.82Å; L154-L175 HydrophobicContact CD2-CD1 4.01Å; L154-I176 HydrophobicContact CD1-CG2 3.82Å; L154-I176 HydrophobicContact CD2-CG2 4.07Å; L154-I176 HydrophobicContact CG-CG2 4.14Å
155R97.5Very high97.9Very high76 Ų7645.2 Ų45.229%0.28725%0.25SC..Hα-helixtrans-63-36.1178.7-72.6-171.6-48.6-159.57.8112.3C118 Y119 M151 Q152 Q157 G158 L159C118-R155 PolarHBondContact O-NH1 2.98Å; Y119-R155 VanDerWaalsContact CA-NH1 3.27Å; Y119-R155 PolarHBondContact O-NH1 3.38Å; M151-R155 WeakPolarHBondContact O-CB 3.22Å; M151-R155 VanDerWaalsContact O-CG 3.29Å; M151-R155 WeakPolarHBondContact O-CG 3.49Å; M151-R155 PolarHBondContact O-N 2.84Å; Q152-R155 PolarHBondContact O-N 3.49Å; R155-Q157 PolarHBondContact O-N 2.96Å; R155-Q157 VanDerWaalsContact O-N 3.11Å; R155-G158 PolarHBondContact O-N 2.99Å; R155-L159 HydrophobicContact CG-CB 4.15Å; R155-L159 HydrophobicContact CG-CD2 4.21Å
156A97.3Very high98Very high78 Ų7848.3 Ų48.365%0.64526%0.264SS*.THydrogen-bonded Turntrans-61.4-17.2174.200000113.4Q152 R153 L154Q152-A156 WeakPolarHBondContact O-CB 3.38Å; Q152-A156 PolarHBondContact O-N 3.24Å; R153-A156 PolarHBondContact O-N 3.13Å; L154-A156 VanDerWaalsContact C-N 3.29Å; L154-A156 PolarHBondContact O-N 3.32Å
157Q96.4Very high98Very high131 Ų13147.7 Ų47.761%0.61226%0.261SS*.THydrogen-bonded Turntrans-101.112.8174.1-57.3-59.8-57.900112.9L154 R155 L175L154-Q157 PolarHBondContact O-N 3.41Å; R155-Q157 PolarHBondContact O-N 2.96Å; R155-Q157 VanDerWaalsContact O-N 3.11Å; Q157-L175 HydrophobicContact CG-CD1 4.21Å; Q157-L175 HydrophobicContact CG-CD2 4.13Å
158G95.4Very high98Very high41 Ų4151.6 Ų51.642%0.42328%0.282SS..  trans74.266.3-179.300000112.9R155 T160 S163R155-G158 PolarHBondContact O-N 2.99Å; G158-T160 PolarHBondContact O-N 3.22Å; G158-S163 VanDerWaalsContact O-CB 3.26Å; G158-S163 WeakPolarHBondContact O-CB 3.37Å; G158-S163 PolarHBondContact O-OG 3.07Å
159L98.1Very high98Very high3 Ų355.1 Ų55.12%0.01630%0.298CS..  trans-66.3101.3-172.9-175.654.7000113.4V127 Y130 Q131 L134 M151 L154 R155 I164V127-L159 WeakPolarHBondContact CG1-O 3.34Å; Y130-L159 HydrophobicContact CE1-CD1 4.03Å; Y130-L159 HydrophobicContact CE1-CG 4.34Å; Q131-L159 HydrophobicContact CB-CD2 4.35Å; Q131-L159 HydrophobicContact CG-CB 4.22Å; Q131-L159 HydrophobicContact CG-CD2 3.81Å; Q131-L159 HydrophobicContact CG-CG 3.93Å; Q131-L159 PolarHBondContact NE2-O 3.38Å; L134-L159 HydrophobicContact CD2-CD1 3.6Å; L134-L159 HydrophobicContact CD2-CD2 4.18Å; L134-L159 HydrophobicContact CD2-CG 4.24Å; M151-L159 HydrophobicContact CE-CD2 3.46Å; M151-L159 VanDerWaalsContact CE-CD2 3.46Å; M151-L159 HydrophobicContact SD-CD2 4.27Å; L154-L159 HydrophobicContact CB-CB 4.46Å; L154-L159 HydrophobicContact CB-CD1 4.08Å; L154-L159 HydrophobicContact CB-CD2 3.85Å; L154-L159 HydrophobicContact CB-CG 4.36Å; L154-L159 HydrophobicContact CD1-CD1 4.48Å; L154-L159 HydrophobicContact CD1-CD2 4.31Å; R155-L159 HydrophobicContact CG-CB 4.15Å; R155-L159 HydrophobicContact CG-CD2 4.21Å; L159-I164 HydrophobicContact CD1-CD1 3.72Å; L159-I164 HydrophobicContact CD1-CG1 3.61Å
160T98.5Very high98Very high44 Ų4457 Ų5727%0.2731%0.312SS..SBendtrans-139.1167.7177.464.10000109.8V127 Y130 G158 D162 S163 I164V127-T160 HydrophobicContact CG1-CG2 4.18Å; V127-T160 HydrophobicContact CG2-CG2 4.13Å; Y130-T160 WeakPolarHBondContact CE1-O 3.13Å; G158-T160 PolarHBondContact O-N 3.22Å; T160-D162 VanDerWaalsContact C-N 3.32Å; T160-D162 PolarHBondContact O-N 3.48Å; T160-S163 PolarHBondContact N-OG 3.41Å; T160-S163 PolarHBondContact O-OG 2.7Å; T160-S163 WeakPolarHBondContact OG1-CB 3.31Å; T160-S163 PolarHBondContact OG1-N 2.99Å; T160-S163 VanDerWaalsContact OG1-N 3.09Å; T160-S163 PolarHBondContact OG1-OG 3.39Å; T160-S163 VanDerWaalsContact OG1-OG 3.13Å; T160-I164 WeakPolarHBondContact O-CG1 3.22Å; T160-I164 PolarHBondContact O-N 3.14Å; T160-I164 VanDerWaalsContact O-N 3.13Å
161V98.5Very high98Very high7 Ų759.7 Ų59.74%0.04233%0.328CS..Hα-helixtrans-57.1-47.8173.5170.30000110.5Y130 I164 L165 S193 L196 Q197 G202Y130-V161 HydrophobicContact CD1-CG2 4.29Å; Y130-V161 HydrophobicContact CD2-CG2 3.47Å; Y130-V161 VanDerWaalsContact CD2-CG2 3.47Å; Y130-V161 HydrophobicContact CE1-CG2 4.32Å; Y130-V161 HydrophobicContact CE2-CB 4.49Å; Y130-V161 HydrophobicContact CE2-CG2 3.49Å; Y130-V161 VanDerWaalsContact CE2-CG2 3.49Å; Y130-V161 HydrophobicContact CG-CG2 3.87Å; V161-I164 PolarHBondContact O-N 3.19Å; V161-L165 HydrophobicContact CG1-CD1 3.96Å; V161-L165 HydrophobicContact CG1-CG 4.45Å; V161-L165 WeakPolarHBondContact O-CG 3.49Å; V161-L165 PolarHBondContact O-N 3.27Å; V161-S193 WeakPolarHBondContact CG1-O 3.3Å; V161-L196 HydrophobicContact CG2-CB 4.3Å; V161-L196 HydrophobicContact CG2-CD1 4.23Å; V161-Q197 HydrophobicContact CG1-CB 3.98Å; V161-G202 WeakPolarHBondContact CG2-O 3.49Å
162D98.2Very high98Very high79 Ų7959.6 Ų59.642%0.42233%0.328SS..Hα-helixtrans-64.5-44.1-177.6-65.5-41.7000112.2T160 I164 L165 Q166 Q197T160-D162 VanDerWaalsContact C-N 3.32Å; T160-D162 PolarHBondContact O-N 3.48Å; D162-I164 VanDerWaalsContact C-N 3.32Å; D162-I164 PolarHBondContact O-N 2.97Å; D162-L165 PolarHBondContact O-N 3.43Å; D162-L165 VanDerWaalsContact O-N 3.15Å; D162-Q166 VanDerWaalsContact O-CG 3.3Å; D162-Q166 WeakPolarHBondContact O-CG 3.46Å; D162-Q166 PolarHBondContact O-N 2.86Å; D162-Q197 PolarHBondContact OD1-OE1 3.38Å
163S98.2Very high98Very high22 Ų2253.5 Ų53.515%0.15430%0.299CS..Hα-helixtrans-64.8-37.7179.267.10000112.1G158 T160 Q166 T167G158-S163 VanDerWaalsContact O-CB 3.26Å; G158-S163 WeakPolarHBondContact O-CB 3.37Å; G158-S163 PolarHBondContact O-OG 3.07Å; T160-S163 PolarHBondContact N-OG 3.41Å; T160-S163 PolarHBondContact O-OG 2.7Å; T160-S163 WeakPolarHBondContact OG1-CB 3.31Å; T160-S163 PolarHBondContact OG1-N 2.99Å; T160-S163 VanDerWaalsContact OG1-N 3.09Å; T160-S163 PolarHBondContact OG1-OG 3.39Å; T160-S163 VanDerWaalsContact OG1-OG 3.13Å; S163-Q166 PolarHBondContact O-N 2.99Å; S163-T167 WeakPolarHBondContact O-CB 3.44Å; S163-T167 PolarHBondContact O-N 3.34Å; S163-T167 PolarHBondContact O-OG1 3.04Å
164I98.6Very high98Very high3 Ų356.8 Ų56.82%0.01532%0.316CS..Hα-helixtrans-66.3-39.2173.9-72.2-69.6000111.3Y130 L134 L154 L159 T160 V161 D162 Q166 T167 L172 I189 K190 S193Y130-I164 HydrophobicContact CE1-CG1 4.14Å; Y130-I164 WeakPolarHBondContact OH-CB 3.29Å; Y130-I164 VanDerWaalsContact OH-CG1 3.29Å; Y130-I164 WeakPolarHBondContact OH-CG1 3.33Å; Y130-I164 WeakPolarHBondContact OH-CG2 3.3Å; L134-I164 HydrophobicContact CD2-CD1 4.38Å; L134-I164 HydrophobicContact CD2-CG1 4.21Å; L154-I164 HydrophobicContact CD2-CD1 4.21Å; L159-I164 HydrophobicContact CD1-CD1 3.72Å; L159-I164 HydrophobicContact CD1-CG1 3.61Å; T160-I164 WeakPolarHBondContact O-CG1 3.22Å; T160-I164 PolarHBondContact O-N 3.14Å; T160-I164 VanDerWaalsContact O-N 3.13Å; V161-I164 PolarHBondContact O-N 3.19Å; D162-I164 VanDerWaalsContact C-N 3.32Å; D162-I164 PolarHBondContact O-N 2.97Å; I164-Q166 VanDerWaalsContact C-N 3.32Å; I164-Q166 PolarHBondContact O-N 3.33Å; I164-T167 PolarHBondContact O-N 2.86Å; I164-L172 HydrophobicContact CD1-CD1 3.64Å; I164-L172 HydrophobicContact CD1-CD2 4.39Å; I164-L172 HydrophobicContact CG2-CD2 4.38Å; I164-I189 HydrophobicContact CD1-CG2 4.5Å; I164-I189 HydrophobicContact CG2-CG2 3.64Å; I164-K190 HydrophobicContact CG2-CD 4.42Å; I164-K190 WeakPolarHBondContact O-CE 3.38Å; I164-K190 PolarHBondContact O-NZ 2.76Å; I164-S193 WeakPolarHBondContact CG2-OG 3.48Å
165L98.4Very high98Very high55 Ų5558 Ų5829%0.28832%0.322SS..Hα-helixtrans-65.7-35.2176.4-72.3177.5000112.4V161 D162 K190 T194 Q197V161-L165 HydrophobicContact CG1-CD1 3.96Å; V161-L165 HydrophobicContact CG1-CG 4.45Å; V161-L165 WeakPolarHBondContact O-CG 3.49Å; V161-L165 PolarHBondContact O-N 3.27Å; D162-L165 PolarHBondContact O-N 3.43Å; D162-L165 VanDerWaalsContact O-N 3.15Å; L165-K190 PolarHBondContact O-NZ 2.88Å; L165-T194 WeakPolarHBondContact CD2-OG1 3.49Å; L165-Q197 HydrophobicContact CD1-CB 3.9Å; L165-Q197 HydrophobicContact CD1-CG 4.13Å
166Q98.3Very high98.1Very high164 Ų16454.3 Ų54.377%0.76631%0.309SS*.Hα-helixtrans-78.6-25.5177.7-68.2170.99.700114D162 S163 I164D162-Q166 VanDerWaalsContact O-CG 3.3Å; D162-Q166 WeakPolarHBondContact O-CG 3.46Å; D162-Q166 PolarHBondContact O-N 2.86Å; S163-Q166 PolarHBondContact O-N 2.99Å; I164-Q166 VanDerWaalsContact C-N 3.32Å; I164-Q166 PolarHBondContact O-N 3.33Å
167T98.4Very high98.1Very high31 Ų3157.4 Ų57.419%0.1931%0.305CS..SBendtrans-75.6125.7-179.2-59.30000111.3S163 I164 T171 L172 K190S163-T167 WeakPolarHBondContact O-CB 3.44Å; S163-T167 PolarHBondContact O-N 3.34Å; S163-T167 PolarHBondContact O-OG1 3.04Å; I164-T167 PolarHBondContact O-N 2.86Å; T167-T171 HydrophobicContact CG2-CG2 3.76Å; T167-L172 HydrophobicContact CG2-CB 3.99Å; T167-K190 WeakPolarHBondContact O-CE 3.43Å; T167-K190 PolarHBondContact O-NZ 2.71Å
168D98.2Very high98.1Very high86 Ų8654.6 Ų54.646%0.4630%0.297SS..  trans-66157.9177.272.890000113.1A170 T171 L172D168-A170 VanDerWaalsContact C-N 3.27Å; D168-A170 PolarHBondContact O-N 2.86Å; D168-A170 WeakPolarHBondContact OD1-CA 3.46Å; D168-A170 WeakPolarHBondContact OD1-CB 3.48Å; D168-A170 PolarHBondContact OD1-N 3.24Å; D168-T171 PolarHBondContact O-N 3.28Å; D168-T171 PolarHBondContact OD1-N 3.13Å; D168-T171 PolarHBondContact OD1-OG1 3.26Å; D168-T171 WeakPolarHBondContact OD2-CB 3.2Å; D168-T171 PolarHBondContact OD2-OG1 3.41Å; D168-L172 WeakPolarHBondContact O-CB 3.18Å; D168-L172 PolarHBondContact O-N 3.36Å
169D98.3Very high98.3Very high92 Ų9252.7 Ų52.749%0.49228%0.278SS..Hα-helixtrans-60.3-33.2-175.2-75.59.6000113.4G173 V186 K190D169-G173 PolarHBondContact O-N 3.07Å; D169-V186 HydrophobicContact CB-CG1 3.81Å; D169-K190 VanDerWaalsContact OD1-CE 3.29Å; D169-K190 WeakPolarHBondContact OD1-CE 2.98Å
170A98.3Very high98.1Very high58 Ų5853.7 Ų53.748%0.47929%0.288SS..Hα-helixtrans-73.1-42.5-179.500000110.8D168 G173 K174D168-A170 VanDerWaalsContact C-N 3.27Å; D168-A170 PolarHBondContact O-N 2.86Å; D168-A170 WeakPolarHBondContact OD1-CA 3.46Å; D168-A170 WeakPolarHBondContact OD1-CB 3.48Å; D168-A170 PolarHBondContact OD1-N 3.24Å; A170-G173 PolarHBondContact O-N 3.19Å; A170-K174 WeakPolarHBondContact O-CG 3.3Å; A170-K174 PolarHBondContact O-N 3.47Å
171T98.4Very high98.1Very high56 Ų5657.6 Ų57.634%0.34430%0.302SS..Hα-helixtrans-64-47.9173.6-61.30000111.4T167 D168 G173 K174 L175T167-T171 HydrophobicContact CG2-CG2 3.76Å; D168-T171 PolarHBondContact O-N 3.28Å; D168-T171 PolarHBondContact OD1-N 3.13Å; D168-T171 PolarHBondContact OD1-OG1 3.26Å; D168-T171 WeakPolarHBondContact OD2-CB 3.2Å; D168-T171 PolarHBondContact OD2-OG1 3.41Å; T171-G173 VanDerWaalsContact C-N 3.28Å; T171-G173 PolarHBondContact O-N 2.84Å; T171-K174 WeakPolarHBondContact O-CB 3.28Å; T171-K174 PolarHBondContact O-N 3.25Å; T171-K174 VanDerWaalsContact O-N 3.14Å; T171-L175 HydrophobicContact CG2-CD1 4.31Å; T171-L175 WeakPolarHBondContact O-CG 3.09Å; T171-L175 PolarHBondContact O-N 3.09Å
172L98.6Very high98Very high0 Ų060 Ų600%031%0.31CS..Hα-helixtrans-59.4-42.1177-178.754.8000111.2L154 I164 T167 D168 K174 L175 I176 V186 I189 K190L154-L172 HydrophobicContact CD2-CD1 3.64Å; I164-L172 HydrophobicContact CD1-CD1 3.64Å; I164-L172 HydrophobicContact CD1-CD2 4.39Å; I164-L172 HydrophobicContact CG2-CD2 4.38Å; T167-L172 HydrophobicContact CG2-CB 3.99Å; D168-L172 WeakPolarHBondContact O-CB 3.18Å; D168-L172 PolarHBondContact O-N 3.36Å; L172-K174 PolarHBondContact O-N 2.89Å; L172-L175 PolarHBondContact O-N 3.38Å; L172-I176 HydrophobicContact CD1-CG2 4.22Å; L172-I176 WeakPolarHBondContact O-CG1 3.43Å; L172-I176 PolarHBondContact O-N 2.93Å; L172-V186 HydrophobicContact CD2-CG1 4.21Å; L172-V186 HydrophobicContact CG-CG2 4.22Å; L172-I189 HydrophobicContact CD2-CG2 4.12Å; L172-K190 HydrophobicContact CD2-CG 4.31Å
173G98.5Very high98Very high1 Ų164.9 Ų64.91%0.0132%0.323CS..Hα-helixtrans-56.7-46.317400000113.6D169 A170 T171 L175 I176 Y177 W182D169-G173 PolarHBondContact O-N 3.07Å; A170-G173 PolarHBondContact O-N 3.19Å; T171-G173 VanDerWaalsContact C-N 3.28Å; T171-G173 PolarHBondContact O-N 2.84Å; G173-L175 VanDerWaalsContact C-N 3.33Å; G173-L175 PolarHBondContact O-N 2.9Å; G173-I176 PolarHBondContact O-N 2.63Å; G173-Y177 WeakPolarHBondContact O-CB 3.46Å; G173-Y177 PolarHBondContact O-N 3.35Å; G173-W182 VanDerWaalsContact CA-CE3 3.47Å
174K98.5Very high98Very high161 Ų16166.6 Ų66.670%0.734%0.335SS*.Hα-helixtrans-61.4-41.1175.1-71.2170-175.5174.40111.7A170 T171 L172 I176A170-K174 WeakPolarHBondContact O-CG 3.3Å; A170-K174 PolarHBondContact O-N 3.47Å; T171-K174 WeakPolarHBondContact O-CB 3.28Å; T171-K174 PolarHBondContact O-N 3.25Å; T171-K174 VanDerWaalsContact O-N 3.14Å; L172-K174 PolarHBondContact O-N 2.89Å; K174-I176 VanDerWaalsContact C-N 3.32Å; K174-I176 PolarHBondContact O-N 2.99Å
175L98.5Very high97.9Very high29 Ų2967 Ų6715%0.15234%0.336CS..Hα-helixtrans-64.5-35.8179.5-70170.7000112.3R153 L154 Q157 T171 L172 G173R153-L175 HydrophobicContact CB-CD2 4.24Å; R153-L175 PolarHBondContact NE-O 3.4Å; R153-L175 PolarHBondContact NH2-O 3.37Å; L154-L175 HydrophobicContact CD2-CB 3.82Å; L154-L175 HydrophobicContact CD2-CD1 4.01Å; Q157-L175 HydrophobicContact CG-CD1 4.21Å; Q157-L175 HydrophobicContact CG-CD2 4.13Å; T171-L175 HydrophobicContact CG2-CD1 4.31Å; T171-L175 WeakPolarHBondContact O-CG 3.09Å; T171-L175 PolarHBondContact O-N 3.09Å; L172-L175 PolarHBondContact O-N 3.38Å; G173-L175 VanDerWaalsContact C-N 3.33Å; G173-L175 PolarHBondContact O-N 2.9Å
176I98.4Very high98Very high0 Ų064.6 Ų64.60%032%0.324CS..Hα-helixtrans-95.6-10.4-178.271170.5000114.2L138 A150 L154 L172 G173 K174 V179 W182 K185 V186 I189L138-I176 HydrophobicContact CD1-CG2 4.25Å; L138-I176 HydrophobicContact CD2-CB 4.12Å; L138-I176 HydrophobicContact CD2-CD1 3.99Å; L138-I176 HydrophobicContact CD2-CG2 4.06Å; A150-I176 HydrophobicContact CB-CB 4.48Å; L154-I176 HydrophobicContact CD1-CG2 3.82Å; L154-I176 HydrophobicContact CD2-CG2 4.07Å; L154-I176 HydrophobicContact CG-CG2 4.14Å; L172-I176 HydrophobicContact CD1-CG2 4.22Å; L172-I176 WeakPolarHBondContact O-CG1 3.43Å; L172-I176 PolarHBondContact O-N 2.93Å; G173-I176 PolarHBondContact O-N 2.63Å; K174-I176 VanDerWaalsContact C-N 3.32Å; K174-I176 PolarHBondContact O-N 2.99Å; I176-V179 WeakPolarHBondContact O-CB 3.38Å; I176-V179 WeakPolarHBondContact O-CG2 3.42Å; I176-V179 PolarHBondContact O-N 3.14Å; I176-W182 HydrophobicContact CD1-CB 3.9Å; I176-W182 HydrophobicContact CG1-CB 3.93Å; I176-K185 HydrophobicContact CD1-CB 4.17Å; I176-V186 HydrophobicContact CD1-CG2 3.8Å; I176-V186 HydrophobicContact CG1-CG2 4.43Å; I176-I189 HydrophobicContact CD1-CD1 4.49Å
177Y97.4Very high98Very high143 Ų14362.6 Ų62.656%0.56131%0.313SS*.THydrogen-bonded Turntrans-61.8137.6173.3-177.8-93.8000111.2R153 G173 W182R153-Y177 PolarHBondContact NH2-O 3.45Å; G173-Y177 WeakPolarHBondContact O-CB 3.46Å; G173-Y177 PolarHBondContact O-N 3.35Å; Y177-W182 AromaticContact CD2-CD1 3.86Å; Y177-W182 AromaticContact CD2-NE1 3.65Å
178P97.6Very high98Very high71 Ų7165.8 Ų65.846%0.46132%0.322SS..THydrogen-bonded Turncis-99.936.29.239.9-36.6000114.5V146 G180V146-P178 HydrophobicContact CG1-CG 3.96Å; P178-G180 PolarHBondContact O-N 3.25Å
179V98Very high98Very high2 Ų261.7 Ų61.71%0.01230%0.3CS..SBendtrans-50.8137.5175.1168.60000110.6L138 T142 V146 A150 I176 F181 W182 K185L138-V179 HydrophobicContact CB-CG1 4.45Å; L138-V179 HydrophobicContact CD2-CG1 4.11Å; L138-V179 HydrophobicContact CD2-CG2 4.47Å; L138-V179 WeakPolarHBondContact O-CG1 3.29Å; T142-V179 HydrophobicContact CG2-CB 4.31Å; T142-V179 HydrophobicContact CG2-CG1 4.12Å; T142-V179 HydrophobicContact CG2-CG2 4.15Å; V146-V179 HydrophobicContact CG1-CG2 4.07Å; A150-V179 HydrophobicContact CB-CG2 3.69Å; I176-V179 WeakPolarHBondContact O-CB 3.38Å; I176-V179 WeakPolarHBondContact O-CG2 3.42Å; I176-V179 PolarHBondContact O-N 3.14Å; V179-F181 PolarHBondContact O-N 3.33Å; V179-W182 WeakPolarHBondContact O-CB 3.29Å; V179-W182 PolarHBondContact O-N 2.92Å; V179-K185 HydrophobicContact CG1-CD 3.52Å
180G95.4Very high98Very high23 Ų2358.9 Ų58.924%0.23728%0.283CS..THydrogen-bonded Turntrans-60.1136.7179.800000110.9T142 P178 W182 K185T142-G180 PolarHBondContact OG1-N 2.94Å; P178-G180 PolarHBondContact O-N 3.25Å; G180-W182 PolarHBondContact O-N 3.41Å; G180-K185 WeakPolarHBondContact O-CD 3.23Å; G180-K185 WeakPolarHBondContact O-CE 3.03Å; G180-K185 PolarHBondContact O-NZ 3.33Å
181F96.7Very high98Very high126 Ų12659.8 Ų59.855%0.55328%0.278SS*.THydrogen-bonded Turntrans55.632-177.6-50.1-83.3000114.3Q141 V179 R183 S184 K185Q141-F181 HydrophobicContact CB-CD2 4.37Å; Q141-F181 HydrophobicContact CB-CE2 4.03Å; Q141-F181 HydrophobicContact CG-CE2 4.49Å; V179-F181 PolarHBondContact O-N 3.33Å; F181-R183 PolarHBondContact O-N 3.34Å; F181-R183 VanDerWaalsContact O-N 3.11Å; F181-S184 PolarHBondContact O-N 3.12Å; F181-S184 VanDerWaalsContact O-N 3.08Å; F181-K185 PolarHBondContact O-N 3.36Å; F181-K185 VanDerWaalsContact O-N 3.1Å
182W97.6Very high98Very high57 Ų5757.1 Ų57.122%0.21626%0.261CS..Hα-helixtrans-52.7-37.5-174.168.6-94.4000114G173 I176 Y177 V179 G180 S184 K185 V186G173-W182 VanDerWaalsContact CA-CE3 3.47Å; I176-W182 HydrophobicContact CD1-CB 3.9Å; I176-W182 HydrophobicContact CG1-CB 3.93Å; Y177-W182 AromaticContact CD2-CD1 3.86Å; Y177-W182 AromaticContact CD2-NE1 3.65Å; V179-W182 WeakPolarHBondContact O-CB 3.29Å; V179-W182 PolarHBondContact O-N 2.92Å; G180-W182 PolarHBondContact O-N 3.41Å; W182-S184 PolarHBondContact O-N 3.06Å; W182-K185 CarbonylContact O-C 3.34Å; W182-K185 PolarHBondContact O-N 3.14Å; W182-K185 VanDerWaalsContact O-N 3.09Å; W182-V186 HydrophobicContact CE3-CG2 3.98Å; W182-V186 HydrophobicContact CZ3-CG2 4.33Å; W182-V186 WeakPolarHBondContact O-CG2 3.5Å; W182-V186 PolarHBondContact O-N 2.97Å
183R97.5Very high98Very high183 Ų18357.1 Ų57.169%0.69126%0.261SS*.Hα-helixtrans-58.5-46178.9-68.3-175.4175.487-1.7112.3F181 K185F181-R183 PolarHBondContact O-N 3.34Å; F181-R183 VanDerWaalsContact O-N 3.11Å; R183-K185 VanDerWaalsContact C-N 3.34Å
184S97.6Very high98Very high57 Ų5759.6 Ų59.640%0.39928%0.277SS..Hα-helixtrans-67.9-37175.5-55.70000111.4F181 W182 K187 Y188F181-S184 PolarHBondContact O-N 3.12Å; F181-S184 VanDerWaalsContact O-N 3.08Å; W182-S184 PolarHBondContact O-N 3.06Å; S184-K187 WeakPolarHBondContact O-CB 3.48Å; S184-K187 PolarHBondContact O-N 2.84Å; S184-Y188 WeakPolarHBondContact O-CD2 3.5Å; S184-Y188 PolarHBondContact O-N 3.26Å
185K98.3Very high98.1Very high11 Ų1153.9 Ų53.95%0.04825%0.253CS..Hα-helixtrans-65.9-37.4177.9-71.4173.6173.31720112.9M137 L138 S140 T142 I176 V179 G180 F181 W182 R183 K187 Y188 I189M137-K185 WeakPolarHBondContact O-CE 3.42Å; L138-K185 HydrophobicContact CD2-CD 4.23Å; L138-K185 PolarHBondContact O-NZ 2.8Å; S140-K185 PolarHBondContact O-NZ 3.23Å; S140-K185 WeakPolarHBondContact OG-CE 3.33Å; S140-K185 PolarHBondContact OG-NZ 3.27Å; T142-K185 PolarHBondContact OG1-NZ 2.67Å; T142-K185 VanDerWaalsContact OG1-NZ 3.12Å; I176-K185 HydrophobicContact CD1-CB 4.17Å; V179-K185 HydrophobicContact CG1-CD 3.52Å; G180-K185 WeakPolarHBondContact O-CD 3.23Å; G180-K185 WeakPolarHBondContact O-CE 3.03Å; G180-K185 PolarHBondContact O-NZ 3.33Å; F181-K185 PolarHBondContact O-N 3.36Å; F181-K185 VanDerWaalsContact O-N 3.1Å; W182-K185 CarbonylContact O-C 3.34Å; W182-K185 PolarHBondContact O-N 3.14Å; W182-K185 VanDerWaalsContact O-N 3.09Å; R183-K185 VanDerWaalsContact C-N 3.34Å; K185-K187 VanDerWaalsContact C-N 3.32Å; K185-K187 PolarHBondContact O-N 2.77Å; K185-Y188 PolarHBondContact O-N 3.22Å; K185-I189 HydrophobicContact CB-CD1 4.47Å; K185-I189 VanDerWaalsContact O-CB 3.3Å; K185-I189 WeakPolarHBondContact O-CB 3.39Å; K185-I189 WeakPolarHBondContact O-CD1 3.47Å; K185-I189 WeakPolarHBondContact O-CG1 3.4Å; K185-I189 PolarHBondContact O-N 2.9Å
186V98.6Very high98.1Very high6 Ų652.5 Ų52.54%0.03625%0.246CC..Hα-helixtrans-53.3-52171.5168.10000110D169 L172 I176 W182 Y188 I189 K190D169-V186 HydrophobicContact CB-CG1 3.81Å; L172-V186 HydrophobicContact CD2-CG1 4.21Å; L172-V186 HydrophobicContact CG-CG2 4.22Å; I176-V186 HydrophobicContact CD1-CG2 3.8Å; I176-V186 HydrophobicContact CG1-CG2 4.43Å; W182-V186 HydrophobicContact CE3-CG2 3.98Å; W182-V186 HydrophobicContact CZ3-CG2 4.33Å; W182-V186 WeakPolarHBondContact O-CG2 3.5Å; W182-V186 PolarHBondContact O-N 2.97Å; V186-Y188 PolarHBondContact O-N 3.44Å; V186-I189 PolarHBondContact O-N 3.45Å; V186-K190 WeakPolarHBondContact O-CB 3.25Å; V186-K190 WeakPolarHBondContact O-CG 3.43Å; V186-K190 PolarHBondContact O-N 3.26Å
187K98.4Very high98.1Very high122 Ų12256 Ų5653%0.5326%0.263SS..Hα-helixtrans-57.9-48.9178.3-179.5178.9176.9178.80112S184 K185 K190 Q191S184-K187 WeakPolarHBondContact O-CB 3.48Å; S184-K187 PolarHBondContact O-N 2.84Å; K185-K187 VanDerWaalsContact C-N 3.32Å; K185-K187 PolarHBondContact O-N 2.77Å; K187-K190 PolarHBondContact O-N 2.98Å; K187-Q191 VanDerWaalsContact CE-NE2 3.31Å; K187-Q191 HydrophobicContact CG-CG 4.45Å; K187-Q191 WeakPolarHBondContact O-CB 3.17Å; K187-Q191 VanDerWaalsContact O-CG 3.23Å; K187-Q191 WeakPolarHBondContact O-CG 3.28Å; K187-Q191 PolarHBondContact O-N 3.04Å
188Y98.3Very high98.1Very high97 Ų9756.2 Ų56.238%0.3827%0.269SS..Hα-helixtrans-65.9-39.9-179.4-64-32.3000113.1S184 K185 V186 Q191 T192 P215S184-Y188 WeakPolarHBondContact O-CD2 3.5Å; S184-Y188 PolarHBondContact O-N 3.26Å; K185-Y188 PolarHBondContact O-N 3.22Å; V186-Y188 PolarHBondContact O-N 3.44Å; Y188-Q191 PolarHBondContact O-N 3.43Å; Y188-T192 WeakPolarHBondContact O-CB 3.27Å; Y188-T192 PolarHBondContact O-N 3.29Å; Y188-T192 PolarHBondContact O-OG1 3.35Å; Y188-P215 HydrophobicContact CD1-CB 3.91Å; Y188-P215 HydrophobicContact CG-CB 4.47Å
189I98.6Very high98.1Very high0 Ų061.9 Ų61.90%028%0.281CS..Hα-helixtrans-62.9-46.6177-72.8166.1000110.2L134 M137 L138 I164 L172 I176 K185 V186 T192 S193L134-I189 HydrophobicContact CD2-CG2 4.25Å; L134-I189 HydrophobicContact CG-CG2 4.38Å; M137-I189 HydrophobicContact CE-CG1 3.99Å; M137-I189 HydrophobicContact SD-CG1 4.35Å; L138-I189 HydrophobicContact CD2-CD1 3.71Å; L138-I189 HydrophobicContact CG-CD1 4.35Å; I164-I189 HydrophobicContact CD1-CG2 4.5Å; I164-I189 HydrophobicContact CG2-CG2 3.64Å; L172-I189 HydrophobicContact CD2-CG2 4.12Å; I176-I189 HydrophobicContact CD1-CD1 4.49Å; K185-I189 HydrophobicContact CB-CD1 4.47Å; K185-I189 VanDerWaalsContact O-CB 3.3Å; K185-I189 WeakPolarHBondContact O-CB 3.39Å; K185-I189 WeakPolarHBondContact O-CD1 3.47Å; K185-I189 WeakPolarHBondContact O-CG1 3.4Å; K185-I189 PolarHBondContact O-N 2.9Å; V186-I189 PolarHBondContact O-N 3.45Å; I189-T192 PolarHBondContact O-N 2.91Å; I189-S193 WeakPolarHBondContact O-CB 3.37Å; I189-S193 PolarHBondContact O-N 3.47Å; I189-S193 PolarHBondContact O-OG 3Å
190K98.6Very high98.1Very high33 Ų3364.7 Ų64.714%0.14329%0.292CS..Hα-helixtrans-58.9-53.1175.6-78.2-67.2-153.2171.60111.9I164 L165 T167 D169 L172 V186 K187 T192 S193 T194I164-K190 HydrophobicContact CG2-CD 4.42Å; I164-K190 WeakPolarHBondContact O-CE 3.38Å; I164-K190 PolarHBondContact O-NZ 2.76Å; L165-K190 PolarHBondContact O-NZ 2.88Å; T167-K190 WeakPolarHBondContact O-CE 3.43Å; T167-K190 PolarHBondContact O-NZ 2.71Å; D169-K190 VanDerWaalsContact OD1-CE 3.29Å; D169-K190 WeakPolarHBondContact OD1-CE 2.98Å; L172-K190 HydrophobicContact CD2-CG 4.31Å; V186-K190 WeakPolarHBondContact O-CB 3.25Å; V186-K190 WeakPolarHBondContact O-CG 3.43Å; V186-K190 PolarHBondContact O-N 3.26Å; K187-K190 PolarHBondContact O-N 2.98Å; K190-T192 VanDerWaalsContact C-N 3.34Å; K190-T192 PolarHBondContact O-N 3.24Å; K190-S193 PolarHBondContact O-N 2.66Å; K190-T194 PolarHBondContact O-N 3.33Å; K190-T194 PolarHBondContact O-OG1 3.46Å; K190-T194 VanDerWaalsContact O-OG1 3.12Å
191Q98.8Very high98.2Very high77 Ų7766.1 Ų66.136%0.3631%0.306SS..Hα-helixtrans-60-43.8179.8-71.1177.1-25.900112.2K187 Y188 T194 I195 P215K187-Q191 VanDerWaalsContact CE-NE2 3.31Å; K187-Q191 HydrophobicContact CG-CG 4.45Å; K187-Q191 WeakPolarHBondContact O-CB 3.17Å; K187-Q191 VanDerWaalsContact O-CG 3.23Å; K187-Q191 WeakPolarHBondContact O-CG 3.28Å; K187-Q191 PolarHBondContact O-N 3.04Å; Y188-Q191 PolarHBondContact O-N 3.43Å; Q191-T194 PolarHBondContact O-N 3.27Å; Q191-I195 WeakPolarHBondContact O-CG1 3.47Å; Q191-I195 PolarHBondContact O-N 3.08Å; Q191-P215 HydrophobicContact CB-CB 4.39Å; Q191-P215 HydrophobicContact CB-CG 3.98Å
192T98.7Very high98.3Very high0 Ų060.3 Ų60.30%028%0.281CS..Hα-helixtrans-59.4-50.8175.5-64.30000110L133 M137 Y188 I189 K190 T194 I195 L196 L214 P215L133-T192 HydrophobicContact CD2-CG2 3.99Å; M137-T192 WeakPolarHBondContact CE-OG1 3.44Å; M137-T192 HydrophobicContact SD-CG2 4.25Å; Y188-T192 WeakPolarHBondContact O-CB 3.27Å; Y188-T192 PolarHBondContact O-N 3.29Å; Y188-T192 PolarHBondContact O-OG1 3.35Å; I189-T192 PolarHBondContact O-N 2.91Å; K190-T192 VanDerWaalsContact C-N 3.34Å; K190-T192 PolarHBondContact O-N 3.24Å; T192-T194 VanDerWaalsContact C-N 3.29Å; T192-T194 PolarHBondContact O-N 3.12Å; T192-I195 WeakPolarHBondContact O-CA 3.47Å; T192-I195 WeakPolarHBondContact O-CB 3.28Å; T192-I195 PolarHBondContact O-N 3.25Å; T192-L196 HydrophobicContact CG2-CD1 4.26Å; T192-L196 HydrophobicContact CG2-CG 4.2Å; T192-L196 VanDerWaalsContact O-CG 3.31Å; T192-L196 WeakPolarHBondContact O-CG 3.47Å; T192-L196 PolarHBondContact O-N 2.9Å; T192-L214 HydrophobicContact CG2-CB 4.35Å; T192-L214 HydrophobicContact CG2-CD1 4.06Å; T192-L214 HydrophobicContact CG2-CD2 4.32Å; T192-L214 HydrophobicContact CG2-CG 4.48Å; T192-P215 PolarHBondContact OG1-O 3.39Å
193S98.7Very high98.3Very high0 Ų058.9 Ų58.90%028%0.278CS..Hα-helixtrans-59.9-38.9-179.4-53.40000112.2Y130 V161 I164 I189 K190 L196 Q197Y130-S193 PolarHBondContact OH-OG 3.46Å; V161-S193 WeakPolarHBondContact CG1-O 3.3Å; I164-S193 WeakPolarHBondContact CG2-OG 3.48Å; I189-S193 WeakPolarHBondContact O-CB 3.37Å; I189-S193 PolarHBondContact O-N 3.47Å; I189-S193 PolarHBondContact O-OG 3Å; K190-S193 PolarHBondContact O-N 2.66Å; S193-L196 PolarHBondContact O-N 3.22Å; S193-Q197 WeakPolarHBondContact O-CB 3.19Å; S193-Q197 PolarHBondContact O-N 3.01Å
194T98.8Very high98.4Very high54 Ų5450.4 Ų50.433%0.33125%0.246SC..Hα-helixtrans-60.8-46.3173-59.10000111.4L165 K190 Q191 T192 Q197 Q198L165-T194 WeakPolarHBondContact CD2-OG1 3.49Å; K190-T194 PolarHBondContact O-N 3.33Å; K190-T194 PolarHBondContact O-OG1 3.46Å; K190-T194 VanDerWaalsContact O-OG1 3.12Å; Q191-T194 PolarHBondContact O-N 3.27Å; T192-T194 VanDerWaalsContact C-N 3.29Å; T192-T194 PolarHBondContact O-N 3.12Å; T194-Q197 PolarHBondContact O-N 2.86Å; T194-Q198 HydrophobicContact CG2-CG 4.44Å; T194-Q198 WeakPolarHBondContact O-CB 3.11Å; T194-Q198 VanDerWaalsContact O-CG 3.29Å; T194-Q198 WeakPolarHBondContact O-CG 3.43Å; T194-Q198 PolarHBondContact O-N 3.04Å
195I98.8Very high98.4Very high40 Ų4047.8 Ų47.821%0.20523%0.228CC..Hα-helixtrans-62-44.2177.9-69163.5000110.7Q191 T192 Q198 R199 Y200 L214 P215Q191-I195 WeakPolarHBondContact O-CG1 3.47Å; Q191-I195 PolarHBondContact O-N 3.08Å; T192-I195 WeakPolarHBondContact O-CA 3.47Å; T192-I195 WeakPolarHBondContact O-CB 3.28Å; T192-I195 PolarHBondContact O-N 3.25Å; I195-Q198 PolarHBondContact O-N 3.43Å; I195-R199 WeakPolarHBondContact O-CB 3.36Å; I195-R199 PolarHBondContact O-N 3.45Å; I195-Y200 HydrophobicContact CG2-CD2 4.29Å; I195-Y200 HydrophobicContact CG2-CE2 3.91Å; I195-L214 HydrophobicContact CB-CD2 4.39Å; I195-L214 HydrophobicContact CG2-CD2 3.8Å; I195-P215 HydrophobicContact CD1-CG 3.95Å
196L98.8Very high98.3Very high0 Ų050.1 Ų50.10%025%0.249CC..Hα-helixtrans-60.4-47178.2-61.3-169.2000111.2Y130 L133 V161 T192 S193 Q198 Y200 G201 G202 D203 I204 L214Y130-L196 HydrophobicContact CD2-CD1 3.68Å; Y130-L196 HydrophobicContact CE2-CD1 3.9Å; L133-L196 HydrophobicContact CD2-CD1 4.1Å; V161-L196 HydrophobicContact CG2-CB 4.3Å; V161-L196 HydrophobicContact CG2-CD1 4.23Å; T192-L196 HydrophobicContact CG2-CD1 4.26Å; T192-L196 HydrophobicContact CG2-CG 4.2Å; T192-L196 VanDerWaalsContact O-CG 3.31Å; T192-L196 WeakPolarHBondContact O-CG 3.47Å; T192-L196 PolarHBondContact O-N 2.9Å; S193-L196 PolarHBondContact O-N 3.22Å; L196-Q198 VanDerWaalsContact C-N 3.35Å; L196-Q198 PolarHBondContact O-N 2.95Å; L196-Y200 HydrophobicContact CD2-CD2 3.92Å; L196-Y200 CarbonylContact O-C 3.09Å; L196-Y200 WeakPolarHBondContact O-CA 3.5Å; L196-Y200 PolarHBondContact O-N 3.29Å; L196-G201 PolarHBondContact O-N 2.79Å; L196-G202 PolarHBondContact O-N 2.85Å; L196-D203 WeakPolarHBondContact CD2-O 3.43Å; L196-I204 HydrophobicContact CD1-CG2 3.92Å; L196-L214 HydrophobicContact CD2-CD1 4.14Å; L196-L214 HydrophobicContact CD2-CD2 4.03Å
197Q98.6Very high98.3Very high75 Ų7551.6 Ų51.635%0.3526%0.26SS..Hα-helixtrans-60.1-44.9178.1-168.163.519.100112V161 D162 L165 S193 T194V161-Q197 HydrophobicContact CG1-CB 3.98Å; D162-Q197 PolarHBondContact OD1-OE1 3.38Å; L165-Q197 HydrophobicContact CD1-CB 3.9Å; L165-Q197 HydrophobicContact CD1-CG 4.13Å; S193-Q197 WeakPolarHBondContact O-CB 3.19Å; S193-Q197 PolarHBondContact O-N 3.01Å; T194-Q197 PolarHBondContact O-N 2.86Å
198Q98.3Very high98.3Very high147 Ų14747.5 Ų47.569%0.68725%0.245SC*.Hα-helixtrans-78.7-35.8-173.3-70.8175.4-9.700114T194 I195 L196T194-Q198 HydrophobicContact CG2-CG 4.44Å; T194-Q198 WeakPolarHBondContact O-CB 3.11Å; T194-Q198 VanDerWaalsContact O-CG 3.29Å; T194-Q198 WeakPolarHBondContact O-CG 3.43Å; T194-Q198 PolarHBondContact O-N 3.04Å; I195-Q198 PolarHBondContact O-N 3.43Å; L196-Q198 VanDerWaalsContact C-N 3.35Å; L196-Q198 PolarHBondContact O-N 2.95Å
199R98.2Very high98.3Very high189 Ų18946.8 Ų46.871%0.71326%0.259SS*.Hα-helixtrans-113.2-25.3-169.1-60.1-171.2-176.1-174.9-1.3114.5I195I195-R199 WeakPolarHBondContact O-CB 3.36Å; I195-R199 PolarHBondContact O-N 3.45Å
200Y98.1Very high98.3Very high62 Ų6250.6 Ų50.624%0.24328%0.277CS..SBendtrans-121.417.4-172.8-57.9-79.6000111.8I195 L196 G202 D203 P205I195-Y200 HydrophobicContact CG2-CD2 4.29Å; I195-Y200 HydrophobicContact CG2-CE2 3.91Å; L196-Y200 HydrophobicContact CD2-CD2 3.92Å; L196-Y200 CarbonylContact O-C 3.09Å; L196-Y200 WeakPolarHBondContact O-CA 3.5Å; L196-Y200 PolarHBondContact O-N 3.29Å; Y200-G202 PolarHBondContact O-N 3.42Å; Y200-G202 VanDerWaalsContact O-N 3.1Å; Y200-D203 WeakPolarHBondContact CB-O 3.47Å; Y200-D203 PolarHBondContact O-N 3.36Å; Y200-P205 HydrophobicContact CD1-CB 4.26Å; Y200-P205 HydrophobicContact CD1-CG 4.1Å; Y200-P205 HydrophobicContact CD2-CG 4.23Å; Y200-P205 HydrophobicContact CE1-CB 3.82Å; Y200-P205 HydrophobicContact CE1-CG 3.73Å; Y200-P205 HydrophobicContact CE2-CG 3.85Å; Y200-P205 HydrophobicContact CG-CG 4.34Å
201G97.1Very high98.3Very high52 Ų5249 Ų4954%0.53627%0.27SS..THydrogen-bonded Turntrans57.326.8-18000000113.5K126 L196K126-G201 WeakPolarHBondContact CE-O 3.24Å; K126-G201 PolarHBondContact NZ-O 2.97Å; L196-G201 PolarHBondContact O-N 2.79Å
202G97.3Very high98.3Very high4 Ų448 Ų484%0.04127%0.269CS..THydrogen-bonded Turntrans83.97.2-177.200000115.5K126 V161 L196 Y200K126-G202 WeakPolarHBondContact CE-O 3.47Å; V161-G202 WeakPolarHBondContact CG2-O 3.49Å; L196-G202 PolarHBondContact O-N 2.85Å; Y200-G202 PolarHBondContact O-N 3.42Å; Y200-G202 VanDerWaalsContact O-N 3.1Å
203D98.5Very high98.3Very high27 Ų2751.8 Ų51.814%0.14430%0.3CS..SBendtrans-99.5170.4170.8-152.3-15.5000110.6K126 R129 L196 Y200K126-D203 HydrophobicContact CD-CB 4.29Å; K126-D203 HydrophobicContact CG-CB 3.87Å; R129-D203 IonicContact CZ-OD1 3.8Å; R129-D203 IonicContact CZ-OD2 3.3Å; R129-D203 VanDerWaalsContact CZ-OD2 3.3Å; R129-D203 IonicContact NE-OD1 2.93Å; R129-D203 PolarHBondContact NE-OD1 2.97Å; R129-D203 IonicContact NE-OD2 3.17Å; R129-D203 PolarHBondContact NE-OD2 2.92Å; R129-D203 IonicContact NH2-OD1 3.8Å; R129-D203 IonicContact NH2-OD2 2.66Å; R129-D203 PolarHBondContact NH2-OD2 3.11Å; L196-D203 WeakPolarHBondContact CD2-O 3.43Å; Y200-D203 WeakPolarHBondContact CB-O 3.47Å; Y200-D203 PolarHBondContact O-N 3.36Å
204I98.5Very high98.3Very high5 Ų552 Ų523%0.02630%0.302CS..PPolyproline II helixtrans-83.4157.7172.673.5173.1000110.4R129 L133 L196 L211 A229 W230R129-I204 HydrophobicContact CB-CD1 3.84Å; R129-I204 HydrophobicContact CB-CG1 3.96Å; R129-I204 HydrophobicContact CG-CD1 4.45Å; L133-I204 HydrophobicContact CB-CG2 3.95Å; L133-I204 HydrophobicContact CD2-CB 4.25Å; L133-I204 HydrophobicContact CD2-CG2 3.55Å; L133-I204 HydrophobicContact CG-CG2 4.39Å; L196-I204 HydrophobicContact CD1-CG2 3.92Å; I204-L211 HydrophobicContact CB-CD2 4.47Å; I204-L211 HydrophobicContact CD1-CD2 4.45Å; I204-A229 HydrophobicContact CD1-CB 3.72Å; I204-W230 HydrophobicContact CG1-CZ2 3.85Å; I204-W230 WeakPolarHBondContact O-CZ2 3.44Å
205P98.3Very high98.2Very high2 Ų251 Ų511%0.01330%0.295CS..PPolyproline II helixtrans-65.4151.6172.8-1628.1000112.5Y200 E210 L211 L214 W230Y200-P205 HydrophobicContact CD1-CB 4.26Å; Y200-P205 HydrophobicContact CD1-CG 4.1Å; Y200-P205 HydrophobicContact CD2-CG 4.23Å; Y200-P205 HydrophobicContact CE1-CB 3.82Å; Y200-P205 HydrophobicContact CE1-CG 3.73Å; Y200-P205 HydrophobicContact CE2-CG 3.85Å; Y200-P205 HydrophobicContact CG-CG 4.34Å; P205-E210 HydrophobicContact CB-CB 3.43Å; P205-E210 VanDerWaalsContact CB-CB 3.43Å; P205-E210 HydrophobicContact CB-CG 4.49Å; P205-E210 HydrophobicContact CG-CB 3.96Å; P205-L211 HydrophobicContact CB-CG 4.32Å; P205-L211 HydrophobicContact CG-CD2 4.4Å; P205-L214 HydrophobicContact CG-CD1 4.22Å; P205-W230 PolarHBondContact O-NE1 3.1Å
206A97.5Very high98.1Very high60 Ų6051 Ų5150%0.49631%0.306SS..SBendtrans-101.121.6179.600000113.3M226 W230A206-M226 VanDerWaalsContact O-CE 3.25Å; A206-M226 WeakPolarHBondContact O-CE 3.15Å; A206-W230 HydrophobicContact CB-CD2 4.21Å; A206-W230 HydrophobicContact CB-CH2 4.24Å; A206-W230 HydrophobicContact CB-CZ2 3.87Å
207S98.3Very high98Very high37 Ų3751.5 Ų51.526%0.25931%0.309SS..SBendtrans-137.2148.8176.1800000111.9A209 E210 L211S207-A209 VanDerWaalsContact C-N 3.33Å; S207-A209 PolarHBondContact O-N 2.81Å; S207-E210 WeakPolarHBondContact CB-OE2 3.19Å; S207-E210 PolarHBondContact O-N 3.17Å; S207-E210 WeakPolarHBondContact OG-CB 3.45Å; S207-E210 VanDerWaalsContact OG-CG 3.23Å; S207-E210 WeakPolarHBondContact OG-CG 3.43Å; S207-E210 PolarHBondContact OG-N 3.27Å; S207-E210 PolarHBondContact OG-OE2 3.06Å; S207-L211 WeakPolarHBondContact O-CB 3.32Å; S207-L211 WeakPolarHBondContact O-CD1 3.41Å; S207-L211 VanDerWaalsContact O-CG 3.31Å; S207-L211 WeakPolarHBondContact O-CG 3.4Å; S207-L211 PolarHBondContact O-N 2.79Å
208V98.2Very high97.9Very high37 Ų3749.2 Ų49.222%0.22431%0.306CS..Hα-helixtrans-60.5-44178.6175.20000111E210 L211 V212 A222 M226 S234V208-E210 PolarHBondContact O-N 3.05Å; V208-L211 PolarHBondContact O-N 2.97Å; V208-V212 HydrophobicContact CG1-CG2 4.31Å; V208-V212 VanDerWaalsContact O-CG2 3.32Å; V208-V212 WeakPolarHBondContact O-CG2 3.48Å; V208-V212 PolarHBondContact O-N 3.33Å; V208-A222 HydrophobicContact CG1-CB 3.9Å; V208-M226 HydrophobicContact CG2-CG 3.75Å; V208-S234 WeakPolarHBondContact CG2-OG 3.09Å
209A98.3Very high97.8Very high81 Ų8144.9 Ų44.967%0.66929%0.29SS*.Hα-helixtrans-61.8-43.3-177.400000112.1S207 A213S207-A209 VanDerWaalsContact C-N 3.33Å; S207-A209 PolarHBondContact O-N 2.81Å; A209-A213 PolarHBondContact O-N 2.7Å
210E98.4Very high97.7Very high80 Ų8038.2 Ų38.237%0.37427%0.266SS..Hα-helixtrans-72.9-36.1178.4-68172.2113.500112.4P205 S207 V208 A213P205-E210 HydrophobicContact CB-CB 3.43Å; P205-E210 VanDerWaalsContact CB-CB 3.43Å; P205-E210 HydrophobicContact CB-CG 4.49Å; P205-E210 HydrophobicContact CG-CB 3.96Å; S207-E210 WeakPolarHBondContact CB-OE2 3.19Å; S207-E210 PolarHBondContact O-N 3.17Å; S207-E210 WeakPolarHBondContact OG-CB 3.45Å; S207-E210 VanDerWaalsContact OG-CG 3.23Å; S207-E210 WeakPolarHBondContact OG-CG 3.43Å; S207-E210 PolarHBondContact OG-N 3.27Å; S207-E210 PolarHBondContact OG-OE2 3.06Å; V208-E210 PolarHBondContact O-N 3.05Å; E210-A213 WeakPolarHBondContact O-CB 3.47Å; E210-A213 PolarHBondContact O-N 2.78Å
211L98.7Very high97.7Very high0 Ų036.3 Ų36.30%026%0.26CS..Hα-helixtrans-61.4-45.1173.5-77.1163.8000111.3L133 I204 P205 S207 V208 A213 L214 V217 A222 A225 M226L133-L211 HydrophobicContact CD1-CD2 4.39Å; I204-L211 HydrophobicContact CB-CD2 4.47Å; I204-L211 HydrophobicContact CD1-CD2 4.45Å; P205-L211 HydrophobicContact CB-CG 4.32Å; P205-L211 HydrophobicContact CG-CD2 4.4Å; S207-L211 WeakPolarHBondContact O-CB 3.32Å; S207-L211 WeakPolarHBondContact O-CD1 3.41Å; S207-L211 VanDerWaalsContact O-CG 3.31Å; S207-L211 WeakPolarHBondContact O-CG 3.4Å; S207-L211 PolarHBondContact O-N 2.79Å; V208-L211 PolarHBondContact O-N 2.97Å; L211-A213 PolarHBondContact O-N 3.34Å; L211-L214 HydrophobicContact CD2-CD1 4.21Å; L211-L214 VanDerWaalsContact O-CB 3.29Å; L211-L214 WeakPolarHBondContact O-CB 3.43Å; L211-L214 WeakPolarHBondContact O-CG 3.39Å; L211-L214 PolarHBondContact O-N 3.28Å; L211-V217 VanDerWaalsContact O-CB 3.28Å; L211-V217 WeakPolarHBondContact O-CB 3.24Å; L211-V217 WeakPolarHBondContact O-CG1 3.42Å; L211-A222 HydrophobicContact CB-CB 3.66Å; L211-A222 HydrophobicContact CD1-CB 4.31Å; L211-A225 HydrophobicContact CD1-CB 3.98Å; L211-A225 HydrophobicContact CD2-CB 4.34Å; L211-M226 HydrophobicContact CD1-CG 3.94Å; L211-M226 HydrophobicContact CD1-SD 3.72Å
212V98.4Very high97.8Very high57 Ų5733.8 Ų33.835%0.34523%0.234SC..Hα-helixtrans-65.1-25176.7172.80000112.3V208 L214 P219 A222V208-V212 HydrophobicContact CG1-CG2 4.31Å; V208-V212 VanDerWaalsContact O-CG2 3.32Å; V208-V212 WeakPolarHBondContact O-CG2 3.48Å; V208-V212 PolarHBondContact O-N 3.33Å; V212-L214 PolarHBondContact O-N 2.75Å; V212-P219 HydrophobicContact CG2-CG 4.45Å; V212-A222 HydrophobicContact CG2-CB 3.62Å
213A98.3Very high97.8Very high78 Ų7834.3 Ų34.365%0.64524%0.235SC*.THydrogen-bonded Turntrans-71.6-12.5174.600000113.2A209 E210 L211A209-A213 PolarHBondContact O-N 2.7Å; E210-A213 WeakPolarHBondContact O-CB 3.47Å; E210-A213 PolarHBondContact O-N 2.78Å; L211-A213 PolarHBondContact O-N 3.34Å
214L98.6Very high97.8Very high6 Ų633.8 Ų33.83%0.03123%0.233CC..SBendtrans-74.9141.4176.8-60.5173.9000111.5L133 T192 I195 L196 P205 L211 V212 G216 V217L133-L214 HydrophobicContact CD2-CD1 3.9Å; T192-L214 HydrophobicContact CG2-CB 4.35Å; T192-L214 HydrophobicContact CG2-CD1 4.06Å; T192-L214 HydrophobicContact CG2-CD2 4.32Å; T192-L214 HydrophobicContact CG2-CG 4.48Å; I195-L214 HydrophobicContact CB-CD2 4.39Å; I195-L214 HydrophobicContact CG2-CD2 3.8Å; L196-L214 HydrophobicContact CD2-CD1 4.14Å; L196-L214 HydrophobicContact CD2-CD2 4.03Å; P205-L214 HydrophobicContact CG-CD1 4.22Å; L211-L214 HydrophobicContact CD2-CD1 4.21Å; L211-L214 VanDerWaalsContact O-CB 3.29Å; L211-L214 WeakPolarHBondContact O-CB 3.43Å; L211-L214 WeakPolarHBondContact O-CG 3.39Å; L211-L214 PolarHBondContact O-N 3.28Å; V212-L214 PolarHBondContact O-N 2.75Å; L214-G216 PolarHBondContact O-N 3.11Å; L214-V217 HydrophobicContact CB-CB 4.11Å; L214-V217 HydrophobicContact CB-CG2 3.72Å; L214-V217 HydrophobicContact CD1-CG2 4.47Å; L214-V217 PolarHBondContact O-N 3.1Å; L214-V217 VanDerWaalsContact O-N 3.13Å
215P97.8Very high97.8Very high31 Ų3133.6 Ų33.620%0.20123%0.232CC..THydrogen-bonded Turntrans-56.9123.4179.1-25.133.9000112.9M137 Y188 Q191 T192 I195 V217M137-P215 WeakPolarHBondContact CE-O 3.32Å; Y188-P215 HydrophobicContact CD1-CB 3.91Å; Y188-P215 HydrophobicContact CG-CB 4.47Å; Q191-P215 HydrophobicContact CB-CB 4.39Å; Q191-P215 HydrophobicContact CB-CG 3.98Å; T192-P215 PolarHBondContact OG1-O 3.39Å; I195-P215 HydrophobicContact CD1-CG 3.95Å; P215-V217 VanDerWaalsContact C-N 3.29Å; P215-V217 PolarHBondContact O-N 2.78Å
216G95.5Very high97.8Very high42 Ų4234 Ų3443%0.43323%0.234SC..THydrogen-bonded Turntrans79.45.1177.200000115L214L214-G216 PolarHBondContact O-N 3.11Å
217V98.1Very high97.8Very high10 Ų1032.9 Ų32.96%0.06122%0.224CC..  trans-98.9117.7176.2-177.30000109.8L133 M137 L211 L214 P215 M221L133-V217 HydrophobicContact CD1-CG2 4.01Å; M137-V217 HydrophobicContact CG-CG2 4.13Å; M137-V217 HydrophobicContact SD-CG2 4.39Å; L211-V217 VanDerWaalsContact O-CB 3.28Å; L211-V217 WeakPolarHBondContact O-CB 3.24Å; L211-V217 WeakPolarHBondContact O-CG1 3.42Å; L214-V217 HydrophobicContact CB-CB 4.11Å; L214-V217 HydrophobicContact CB-CG2 3.72Å; L214-V217 HydrophobicContact CD1-CG2 4.47Å; L214-V217 PolarHBondContact O-N 3.1Å; L214-V217 VanDerWaalsContact O-N 3.13Å; P215-V217 VanDerWaalsContact C-N 3.29Å; P215-V217 PolarHBondContact O-N 2.78Å; V217-M221 HydrophobicContact CG1-CB 3.88Å
218G96.5Very high97.7Very high27 Ų2732.5 Ų32.528%0.27822%0.22SC..  trans-99.8172176.100000113.4K220 M221 A222G218-K220 VanDerWaalsContact C-N 3.33Å; G218-K220 PolarHBondContact O-N 2.96Å; G218-M221 WeakPolarHBondContact O-CB 3.18Å; G218-M221 PolarHBondContact O-N 3.43Å; G218-A222 PolarHBondContact O-N 3.34Å
219P96.2Very high97.7Very high55 Ų5531.2 Ų31.236%0.35721%0.214SC..Hα-helixtrans-51.6-45-177.9-29.135.4000114.2V212 M221 A222 H223 E260V212-P219 HydrophobicContact CG2-CG 4.45Å; P219-M221 VanDerWaalsContact C-N 3.31Å; P219-M221 PolarHBondContact O-N 2.91Å; P219-A222 PolarHBondContact O-N 3.48Å; P219-A222 VanDerWaalsContact O-N 3.14Å; P219-H223 PolarHBondContact O-CD2 2.9Å; P219-H223 PolarHBondContact O-N 3.32Å; P219-E260 WeakPolarHBondContact CB-OE2 3.35Å
220K96Very high97.7Very high50 Ų5031 Ų3122%0.21720%0.195CC..Hα-helixtrans-57-42.6176.2-176.9-99.5179.1170.30113G218 L224 A237 V238 D239G218-K220 VanDerWaalsContact C-N 3.33Å; G218-K220 PolarHBondContact O-N 2.96Å; K220-L224 HydrophobicContact CD-CD1 3.93Å; K220-L224 VanDerWaalsContact NZ-CD1 3.28Å; K220-L224 WeakPolarHBondContact O-CG 3.25Å; K220-L224 PolarHBondContact O-N 3.23Å; K220-L224 VanDerWaalsContact O-N 3.11Å; K220-A237 HydrophobicContact CG-CB 4.25Å; K220-V238 WeakPolarHBondContact CB-O 3.27Å; K220-V238 WeakPolarHBondContact CG-O 3.44Å; K220-D239 HydrophobicContact CD-CB 4.27Å; K220-D239 HydrophobicContact CG-CB 4.31Å; K220-D239 IonicContact NZ-OD2 3.44Å
221M97.9Very high97.6Very high21 Ų2130.3 Ų30.310%0.10321%0.21CC..Hα-helixtrans-68.7-40.7178.4-64-179.5-175.600110.7L136 V217 G218 P219 L224 A225L136-M221 HydrophobicContact CB-CB 4.3Å; L136-M221 HydrophobicContact CB-CG 4.23Å; L136-M221 WeakPolarHBondContact CD1-O 3.24Å; L136-M221 VanDerWaalsContact O-CE 3.28Å; L136-M221 WeakPolarHBondContact O-CE 3.33Å; V217-M221 HydrophobicContact CG1-CB 3.88Å; G218-M221 WeakPolarHBondContact O-CB 3.18Å; G218-M221 PolarHBondContact O-N 3.43Å; P219-M221 VanDerWaalsContact C-N 3.31Å; P219-M221 PolarHBondContact O-N 2.91Å; M221-L224 PolarHBondContact O-N 3.31Å; M221-A225 VanDerWaalsContact O-CB 3.31Å; M221-A225 WeakPolarHBondContact O-CB 3.46Å; M221-A225 PolarHBondContact O-N 3.47Å
222A98.3Very high97.5Very high0 Ų033.6 Ų33.60%023%0.23CC..Hα-helixtrans-62.4-44.5178.100000111.9V208 L211 V212 G218 P219 A225 M226V208-A222 HydrophobicContact CG1-CB 3.9Å; L211-A222 HydrophobicContact CB-CB 3.66Å; L211-A222 HydrophobicContact CD1-CB 4.31Å; V212-A222 HydrophobicContact CG2-CB 3.62Å; G218-A222 PolarHBondContact O-N 3.34Å; P219-A222 PolarHBondContact O-N 3.48Å; P219-A222 VanDerWaalsContact O-N 3.14Å; A222-A225 PolarHBondContact O-N 3.03Å; A222-M226 WeakPolarHBondContact O-CG 3.12Å; A222-M226 PolarHBondContact O-N 2.88Å
223H98.1Very high97.4Very high14 Ų1433 Ų337%0.06523%0.227CC..Hα-helixtrans-63.1-42.8174.9-71-62000112.7P219 M226 A227 S234 G235 A237P219-H223 PolarHBondContact O-CD2 2.9Å; P219-H223 PolarHBondContact O-N 3.32Å; H223-M226 PolarHBondContact O-N 2.99Å; H223-A227 PolarHBondContact O-N 2.76Å; H223-S234 PolarHBondContact ND1-OG 3.31Å; H223-G235 PolarHBondContact ND1-N 2.96Å; H223-A237 HydrophobicContact CB-CB 4.29Å
224L97.8Very high97.4Very high17 Ų1731.2 Ų31.29%0.08921%0.209CC..Hα-helixtrans-64.7-39.2174.4-74.9-175.5000112.7V115 L136 K220 M221 A227 V228 A237V115-L224 HydrophobicContact CG1-CD1 4.43Å; L136-L224 HydrophobicContact CD1-CB 4.04Å; L136-L224 HydrophobicContact CD2-CB 3.77Å; L136-L224 HydrophobicContact CD2-CD1 3.53Å; L136-L224 HydrophobicContact CD2-CG 4.32Å; K220-L224 HydrophobicContact CD-CD1 3.93Å; K220-L224 VanDerWaalsContact NZ-CD1 3.28Å; K220-L224 WeakPolarHBondContact O-CG 3.25Å; K220-L224 PolarHBondContact O-N 3.23Å; K220-L224 VanDerWaalsContact O-N 3.11Å; M221-L224 PolarHBondContact O-N 3.31Å; L224-A227 PolarHBondContact O-N 2.85Å; L224-V228 WeakPolarHBondContact O-CB 3.43Å; L224-V228 WeakPolarHBondContact O-CG2 3.39Å; L224-V228 PolarHBondContact O-N 3.41Å; L224-A237 HydrophobicContact CD1-CB 4.48Å; L224-A237 HydrophobicContact CD2-CB 3.47Å; L224-A237 VanDerWaalsContact CD2-CB 3.47Å; L224-A237 HydrophobicContact CG-CB 3.57Å
225A98.3Very high97.3Very high0 Ų031.3 Ų31.30%021%0.211CC..Hα-helixtrans-64-42.7175.900000110.8L136 L211 M221 A222 A227 A229 W230L136-A225 HydrophobicContact CD1-CB 3.85Å; L211-A225 HydrophobicContact CD1-CB 3.98Å; L211-A225 HydrophobicContact CD2-CB 4.34Å; M221-A225 VanDerWaalsContact O-CB 3.31Å; M221-A225 WeakPolarHBondContact O-CB 3.46Å; M221-A225 PolarHBondContact O-N 3.47Å; A222-A225 PolarHBondContact O-N 3.03Å; A225-A227 PolarHBondContact O-N 3.11Å; A225-A229 WeakPolarHBondContact O-CA 3.45Å; A225-A229 WeakPolarHBondContact O-CB 3.29Å; A225-A229 PolarHBondContact O-N 3.23Å; A225-W230 PolarHBondContact O-N 3.24Å
226M98.5Very high97.3Very high12 Ų1229.8 Ų29.86%0.05920%0.202CC..Hα-helixtrans-59.5-45.5173.3-69.1-55.4-58.700112.1A206 V208 L211 A222 H223 W230 G231 T232 S234A206-M226 VanDerWaalsContact O-CE 3.25Å; A206-M226 WeakPolarHBondContact O-CE 3.15Å; V208-M226 HydrophobicContact CG2-CG 3.75Å; L211-M226 HydrophobicContact CD1-CG 3.94Å; L211-M226 HydrophobicContact CD1-SD 3.72Å; A222-M226 WeakPolarHBondContact O-CG 3.12Å; A222-M226 PolarHBondContact O-N 2.88Å; H223-M226 PolarHBondContact O-N 2.99Å; M226-W230 HydrophobicContact CE-CB 4.19Å; M226-W230 HydrophobicContact CE-CG 4.33Å; M226-W230 CarbonylContact O-C 3.57Å; M226-W230 WeakPolarHBondContact O-CA 3.31Å; M226-W230 VanDerWaalsContact O-CB 3.3Å; M226-W230 WeakPolarHBondContact O-CB 3.32Å; M226-W230 PolarHBondContact O-N 2.92Å; M226-W230 HydrophobicContact SD-CG 4.36Å; M226-G231 PolarHBondContact O-N 3.08Å; M226-G231 VanDerWaalsContact O-N 3.12Å; M226-T232 CarbonylContact C-O 3.32Å; M226-T232 WeakPolarHBondContact CB-O 3Å; M226-T232 HydrophobicContact CE-CG2 4.24Å; M226-T232 PolarHBondContact O-N 3.11Å; M226-S234 WeakPolarHBondContact CB-OG 3.31Å
227A97.3Very high97.4Very high36 Ų3628 Ų2830%0.29818%0.183SC..Hα-helixtrans-66.2-50.9-179.400000112.3H223 L224 A225 G231 T232H223-A227 PolarHBondContact O-N 2.76Å; L224-A227 PolarHBondContact O-N 2.85Å; A225-A227 PolarHBondContact O-N 3.11Å; A227-G231 WeakPolarHBondContact O-CA 3.41Å; A227-G231 PolarHBondContact O-N 3.45Å; A227-G231 VanDerWaalsContact O-N 3.12Å; A227-T232 WeakPolarHBondContact CA-O 3.29Å; A227-T232 PolarHBondContact N-O 3.09Å
228V97.3Very high97.4Very high29 Ų2927.9 Ų27.918%0.17618%0.182CC..Hα-helixtrans-85.8-39.9-170.7-178.10000112.4V115 E116 Y119 V132 L224V115-V228 HydrophobicContact CG1-CG2 4Å; V115-V228 HydrophobicContact CG2-CG1 4.33Å; V115-V228 HydrophobicContact CG2-CG2 4.47Å; E116-V228 HydrophobicContact CG-CG1 4.24Å; E116-V228 HydrophobicContact CG-CG2 3.92Å; Y119-V228 HydrophobicContact CE1-CG1 3.92Å; V132-V228 HydrophobicContact CG1-CB 4.09Å; V132-V228 HydrophobicContact CG1-CG1 4.07Å; V132-V228 HydrophobicContact CG2-CG1 3.93Å; L224-V228 WeakPolarHBondContact O-CB 3.43Å; L224-V228 WeakPolarHBondContact O-CG2 3.39Å; L224-V228 PolarHBondContact O-N 3.41Å
229A97.6Very high97.3Very high10 Ų1027.8 Ų27.88%0.08318%0.175CC..Hα-helixtrans-85.7-34.7-174.700000111.9R129 V132 I204 A225R129-A229 HydrophobicContact CB-CB 4.12Å; R129-A229 HydrophobicContact CG-CB 3.79Å; R129-A229 WeakPolarHBondContact CG-O 3.47Å; V132-A229 HydrophobicContact CB-CB 4.17Å; V132-A229 HydrophobicContact CG1-CB 3.9Å; I204-A229 HydrophobicContact CD1-CB 3.72Å; A225-A229 WeakPolarHBondContact O-CA 3.45Å; A225-A229 WeakPolarHBondContact O-CB 3.29Å; A225-A229 PolarHBondContact O-N 3.23Å
230W97.8Very high97.3Very high76 Ų7629.8 Ų29.829%0.28819%0.186SC..Hα-helixtrans-111.7-8.7-175.4-63.8112000114.5R129 I204 P205 A206 A225 M226 T232R129-W230 VanDerWaalsContact CD-CH2 3.44Å; I204-W230 HydrophobicContact CG1-CZ2 3.85Å; I204-W230 WeakPolarHBondContact O-CZ2 3.44Å; P205-W230 PolarHBondContact O-NE1 3.1Å; A206-W230 HydrophobicContact CB-CD2 4.21Å; A206-W230 HydrophobicContact CB-CH2 4.24Å; A206-W230 HydrophobicContact CB-CZ2 3.87Å; A225-W230 PolarHBondContact O-N 3.24Å; M226-W230 HydrophobicContact CE-CB 4.19Å; M226-W230 HydrophobicContact CE-CG 4.33Å; M226-W230 CarbonylContact O-C 3.57Å; M226-W230 WeakPolarHBondContact O-CA 3.31Å; M226-W230 VanDerWaalsContact O-CB 3.3Å; M226-W230 WeakPolarHBondContact O-CB 3.32Å; M226-W230 PolarHBondContact O-N 2.92Å; M226-W230 HydrophobicContact SD-CG 4.36Å; W230-T232 PolarHBondContact O-N 3.27Å
231G96.4Very high97.4Very high66 Ų6629.2 Ų29.268%0.6818%0.184SC*.SBendtrans70.817.7-177.400000113.7M226 A227M226-G231 PolarHBondContact O-N 3.08Å; M226-G231 VanDerWaalsContact O-N 3.12Å; A227-G231 WeakPolarHBondContact O-CA 3.41Å; A227-G231 PolarHBondContact O-N 3.45Å; A227-G231 VanDerWaalsContact O-N 3.12Å
232T97.2Very high97.4Very high69 Ų6928.2 Ų28.242%0.42318%0.179SC..  trans-117118.9-172.6-62.30000111.1M226 A227 W230 S234M226-T232 CarbonylContact C-O 3.32Å; M226-T232 WeakPolarHBondContact CB-O 3Å; M226-T232 HydrophobicContact CE-CG2 4.24Å; M226-T232 PolarHBondContact O-N 3.11Å; A227-T232 WeakPolarHBondContact CA-O 3.29Å; A227-T232 PolarHBondContact N-O 3.09Å; W230-T232 PolarHBondContact O-N 3.27Å; T232-S234 PolarHBondContact O-N 3.28Å; T232-S234 VanDerWaalsContact O-N 3.14Å
233V96.9Very high97.4Very high45 Ų4530 Ų3027%0.27319%0.188SC..  trans-8194.7174.5-174.70000109.5R272 W275 H276V233-R272 PolarHBondContact O-NH2 3.18Å; V233-W275 HydrophobicContact CG1-CB 3.76Å; V233-W275 HydrophobicContact CG1-CE3 4.35Å; V233-H276 HydrophobicContact CG2-CB 3.84Å
234S97Very high97.4Very high40 Ų4031.3 Ų31.328%0.2819%0.192SC..  trans-89.7-13.8-179.161.20000114.3V208 H223 M226 T232V208-S234 WeakPolarHBondContact CG2-OG 3.09Å; H223-S234 PolarHBondContact ND1-OG 3.31Å; M226-S234 WeakPolarHBondContact CB-OG 3.31Å; T232-S234 PolarHBondContact O-N 3.28Å; T232-S234 VanDerWaalsContact O-N 3.14Å
235G97.3Very high97.4Very high7 Ų730.5 Ų30.57%0.07219%0.188CC..SBendtrans167.9169.6-177.500000111.6H223 A237 E267H223-G235 PolarHBondContact ND1-N 2.96Å; G235-A237 PolarHBondContact O-N 3.18Å; G235-E267 WeakPolarHBondContact CA-OE1 3.47Å
236I97.8Very high97.4Very high0 Ų030.5 Ų30.50%019%0.188CC..  trans-76.9121.7178.2-58.1172.2000109V238 R263 L266 E267 L270 W275 I278I236-V238 HydrophobicContact CB-CG2 4.49Å; I236-V238 HydrophobicContact CG2-CG2 3.96Å; I236-V238 PolarHBondContact O-N 3.47Å; I236-V238 VanDerWaalsContact O-N 3.13Å; I236-R263 HydrophobicContact CB-CG 4.27Å; I236-R263 VanDerWaalsContact O-CD 3.28Å; I236-R263 WeakPolarHBondContact O-CD 3.29Å; I236-R263 VanDerWaalsContact O-CG 3.27Å; I236-R263 WeakPolarHBondContact O-CG 3.35Å; I236-L266 HydrophobicContact CD1-CB 3.58Å; I236-L266 HydrophobicContact CD1-CD1 4.49Å; I236-L266 HydrophobicContact CG2-CD1 4.42Å; I236-E267 HydrophobicContact CB-CG 4.39Å; I236-E267 HydrophobicContact CD1-CG 3.72Å; I236-E267 HydrophobicContact CG1-CG 3.83Å; I236-E267 PolarHBondContact N-OE1 2.79Å; I236-L270 HydrophobicContact CD1-CD2 3.88Å; I236-W275 HydrophobicContact CD1-CD2 4.21Å; I236-W275 HydrophobicContact CD1-CG 3.97Å; I236-W275 HydrophobicContact CG1-CB 3.81Å; I236-W275 HydrophobicContact CG1-CD2 3.71Å; I236-W275 HydrophobicContact CG1-CE3 4.23Å; I236-W275 HydrophobicContact CG1-CG 3.5Å; I236-W275 VanDerWaalsContact CG1-CG 3.5Å; I236-I278 HydrophobicContact CG2-CB 4.4Å; I236-I278 HydrophobicContact CG2-CG2 4.04Å
237A96.9Very high97.4Very high5 Ų531.8 Ų31.84%0.04120%0.195CC..  trans-73.6104.3172.500000110.5K220 H223 L224 G235 N279K220-A237 HydrophobicContact CG-CB 4.25Å; H223-A237 HydrophobicContact CB-CB 4.29Å; L224-A237 HydrophobicContact CD1-CB 4.48Å; L224-A237 HydrophobicContact CD2-CB 3.47Å; L224-A237 VanDerWaalsContact CD2-CB 3.47Å; L224-A237 HydrophobicContact CG-CB 3.57Å; G235-A237 PolarHBondContact O-N 3.18Å; A237-N279 HydrophobicContact CB-CB 4.02Å; A237-N279 WeakPolarHBondContact O-CB 3.4Å; A237-N279 PolarHBondContact O-ND2 3.16Å
238V97.6Very high97.4Very high7 Ų732.9 Ų32.94%0.04219%0.192CC..  trans-101.7117.1179.2-177.10000111.1K220 I236 V242 H243 P259 T262 R263 L266K220-V238 WeakPolarHBondContact CB-O 3.27Å; K220-V238 WeakPolarHBondContact CG-O 3.44Å; I236-V238 HydrophobicContact CB-CG2 4.49Å; I236-V238 HydrophobicContact CG2-CG2 3.96Å; I236-V238 PolarHBondContact O-N 3.47Å; I236-V238 VanDerWaalsContact O-N 3.13Å; V238-V242 HydrophobicContact CB-CB 4.44Å; V238-V242 HydrophobicContact CB-CG1 4.24Å; V238-V242 HydrophobicContact CG1-CB 3.94Å; V238-V242 HydrophobicContact CG1-CG1 3.89Å; V238-V242 HydrophobicContact CG2-CG1 3.91Å; V238-H243 HydrophobicContact CG1-CB 3.93Å; V238-P259 HydrophobicContact CB-CB 4.27Å; V238-P259 WeakPolarHBondContact CB-O 3.37Å; V238-P259 HydrophobicContact CG1-CB 3.83Å; V238-P259 WeakPolarHBondContact CG1-O 3.41Å; V238-T262 HydrophobicContact CG1-CG2 4.17Å; V238-R263 HydrophobicContact CB-CB 4.37Å; V238-R263 HydrophobicContact CG2-CB 3.64Å; V238-R263 HydrophobicContact CG2-CG 4.23Å; V238-L266 HydrophobicContact CG2-CD1 4.45Å
239D95.3Very high97.4Very high25 Ų2531.9 Ų31.913%0.13419%0.185CC..  trans-110.7-167.8167.163.122.2000111.9K220 H241 V242 H243 V283K220-D239 HydrophobicContact CD-CB 4.27Å; K220-D239 HydrophobicContact CG-CB 4.31Å; K220-D239 IonicContact NZ-OD2 3.44Å; D239-H241 PolarHBondContact O-N 3.37Å; D239-H241 WeakPolarHBondContact OD1-CA 3.4Å; D239-H241 WeakPolarHBondContact OD1-CB 3.13Å; D239-H241 IonicContact OD1-CD2 3.76Å; D239-H241 PolarHBondContact OD1-N 3.4Å; D239-V242 PolarHBondContact O-N 2.88Å; D239-V242 PolarHBondContact OD1-N 3.08Å; D239-V242 VanDerWaalsContact OD1-N 3.08Å; D239-H243 WeakPolarHBondContact O-CB 3.33Å; D239-H243 PolarHBondContact O-N 2.93Å; D239-V283 WeakPolarHBondContact OD2-CG2 3.5Å
240T95.6Very high97.4Very high96 Ų9639.3 Ų39.359%0.58921%0.211SC*.Hα-helixtrans-64.1-23.8-179.658.70000113.5R244T240-R244 WeakPolarHBondContact O-CB 3.5Å; T240-R244 PolarHBondContact O-N 3.31Å; T240-R244 PolarHBondContact O-NH1 2.88Å; T240-R244 VanDerWaalsContact O-NH1 3.1Å
241H97.5Very high97.4Very high38 Ų3835.7 Ų35.718%0.17620%0.197CC..Hα-helixtrans-76-56.1174.5-65.7-100000109.8D239 H243 R244 I245 V283D239-H241 PolarHBondContact O-N 3.37Å; D239-H241 WeakPolarHBondContact OD1-CA 3.4Å; D239-H241 WeakPolarHBondContact OD1-CB 3.13Å; D239-H241 IonicContact OD1-CD2 3.76Å; D239-H241 PolarHBondContact OD1-N 3.4Å; H241-H243 VanDerWaalsContact C-N 3.33Å; H241-H243 PolarHBondContact O-N 3.16Å; H241-R244 PolarHBondContact ND1-NH2 3.28Å; H241-R244 PolarHBondContact O-N 3.26Å; H241-I245 HydrophobicContact CB-CD1 4.38Å; H241-I245 WeakPolarHBondContact O-CB 3.34Å; H241-I245 WeakPolarHBondContact O-CD1 3.47Å; H241-I245 VanDerWaalsContact O-CG1 3.27Å; H241-I245 WeakPolarHBondContact O-CG1 3.16Å; H241-I245 PolarHBondContact O-N 3.46Å; H241-V283 HydrophobicContact CB-CG2 4.09Å
242V98.3Very high97.4Very high0 Ų032.9 Ų32.90%017%0.167CC..Hα-helixtrans-57-48.7179.5179.90000110.3V238 D239 R244 I245 A246 L266 I278 L282V238-V242 HydrophobicContact CB-CB 4.44Å; V238-V242 HydrophobicContact CB-CG1 4.24Å; V238-V242 HydrophobicContact CG1-CB 3.94Å; V238-V242 HydrophobicContact CG1-CG1 3.89Å; V238-V242 HydrophobicContact CG2-CG1 3.91Å; D239-V242 PolarHBondContact O-N 2.88Å; D239-V242 PolarHBondContact OD1-N 3.08Å; D239-V242 VanDerWaalsContact OD1-N 3.08Å; V242-R244 PolarHBondContact O-N 3.24Å; V242-I245 PolarHBondContact O-N 3.14Å; V242-A246 WeakPolarHBondContact O-CB 3.23Å; V242-A246 PolarHBondContact O-N 3.4Å; V242-L266 HydrophobicContact CG1-CD1 4.04Å; V242-I278 HydrophobicContact CG1-CG2 4.18Å; V242-L282 HydrophobicContact CB-CD1 4.48Å; V242-L282 HydrophobicContact CG1-CD1 4.11Å; V242-L282 HydrophobicContact CG2-CB 4.12Å; V242-L282 HydrophobicContact CG2-CD1 4.45Å
243H98.4Very high97.2Very high39 Ų3935.1 Ų35.118%0.18117%0.171CC..Hα-helixtrans-55.7-51.9177.7177.766.7000112.2V238 D239 H241 N247 T256 S258 T262V238-H243 HydrophobicContact CG1-CB 3.93Å; D239-H243 WeakPolarHBondContact O-CB 3.33Å; D239-H243 PolarHBondContact O-N 2.93Å; H241-H243 VanDerWaalsContact C-N 3.33Å; H241-H243 PolarHBondContact O-N 3.16Å; H243-N247 PolarHBondContact CE1-ND2 3.42Å; H243-N247 PolarHBondContact ND1-ND2 2.91Å; H243-N247 PolarHBondContact O-N 3.28Å; H243-N247 PolarHBondContact O-ND2 3.15Å; H243-T256 PolarHBondContact CE1-O 3.39Å; H243-S258 PolarHBondContact ND1-O 3.4Å; H243-T262 PolarHBondContact CE1-OG1 2.95Å; H243-T262 PolarHBondContact ND1-OG1 3.21Å
244R98.3Very high97.1Very high40 Ų4041.2 Ų41.215%0.15119%0.194CC..Hα-helixtrans-63.8-46.3-179.3179.5-177.670.8-105.97.2112T240 H241 V242 N247 R248 G286 C290T240-R244 WeakPolarHBondContact O-CB 3.5Å; T240-R244 PolarHBondContact O-N 3.31Å; T240-R244 PolarHBondContact O-NH1 2.88Å; T240-R244 VanDerWaalsContact O-NH1 3.1Å; H241-R244 PolarHBondContact ND1-NH2 3.28Å; H241-R244 PolarHBondContact O-N 3.26Å; V242-R244 PolarHBondContact O-N 3.24Å; R244-N247 PolarHBondContact O-N 2.63Å; R244-R248 WeakPolarHBondContact O-CG 3.34Å; R244-R248 PolarHBondContact O-N 3.44Å; R244-G286 PolarHBondContact NH2-O 3.45Å; R244-C290 PolarHBondContact NE-O 3.5Å; R244-C290 PolarHBondContact NH2-O 3.26Å
245I98.5Very high97Very high1 Ų143.5 Ų43.51%0.00522%0.215CC..Hα-helixtrans-69.9-44.5-174.7-67.1159.9000110.4H241 V242 N247 R248 L249 L282 F285 C290H241-I245 HydrophobicContact CB-CD1 4.38Å; H241-I245 WeakPolarHBondContact O-CB 3.34Å; H241-I245 WeakPolarHBondContact O-CD1 3.47Å; H241-I245 VanDerWaalsContact O-CG1 3.27Å; H241-I245 WeakPolarHBondContact O-CG1 3.16Å; H241-I245 PolarHBondContact O-N 3.46Å; V242-I245 PolarHBondContact O-N 3.14Å; I245-N247 VanDerWaalsContact C-N 3.3Å; I245-N247 PolarHBondContact O-N 2.75Å; I245-R248 PolarHBondContact O-N 3.24Å; I245-R248 VanDerWaalsContact O-N 3.14Å; I245-L249 HydrophobicContact CG2-CD1 3.64Å; I245-L249 HydrophobicContact CG2-CG 4.17Å; I245-L249 WeakPolarHBondContact O-CB 3.35Å; I245-L249 WeakPolarHBondContact O-CG 3.5Å; I245-L249 PolarHBondContact O-N 2.86Å; I245-L282 HydrophobicContact CD1-CB 4.1Å; I245-L282 WeakPolarHBondContact CD1-O 3.39Å; I245-L282 HydrophobicContact CG2-CD1 4.35Å; I245-L282 HydrophobicContact CG2-CD2 4.03Å; I245-F285 HydrophobicContact CD1-CD1 3.96Å; I245-F285 HydrophobicContact CG1-CD1 4.47Å; I245-F285 HydrophobicContact CG2-CD1 4.25Å; I245-F285 HydrophobicContact CG2-CE1 4.31Å; I245-C290 HydrophobicContact CD1-CB 4.33Å; I245-C290 HydrophobicContact CG1-CB 4.03Å
246A98.4Very high97Very high0 Ų044.2 Ų44.20%022%0.218CC..Hα-helixtrans-57.2-44.117600000111.4V242 R250 W251 T262 L266V242-A246 WeakPolarHBondContact O-CB 3.23Å; V242-A246 PolarHBondContact O-N 3.4Å; A246-R250 PolarHBondContact O-N 3.25Å; A246-R250 VanDerWaalsContact O-N 3.08Å; A246-W251 HydrophobicContact CB-CB 4.1Å; A246-W251 PolarHBondContact O-N 3.21Å; A246-T262 HydrophobicContact CB-CG2 3.75Å; A246-L266 HydrophobicContact CB-CD1 4.38Å; A246-L266 HydrophobicContact CB-CD2 4.33Å
247N98.1Very high97Very high38 Ų3853.2 Ų53.220%0.20326%0.257CS..Hα-helixtrans-66.4-40.1175.8-79-76.6000112.8H243 R244 I245 R250 A255 T256H243-N247 PolarHBondContact CE1-ND2 3.42Å; H243-N247 PolarHBondContact ND1-ND2 2.91Å; H243-N247 PolarHBondContact O-N 3.28Å; H243-N247 PolarHBondContact O-ND2 3.15Å; R244-N247 PolarHBondContact O-N 2.63Å; I245-N247 VanDerWaalsContact C-N 3.3Å; I245-N247 PolarHBondContact O-N 2.75Å; N247-R250 PolarHBondContact O-N 3.46Å; N247-A255 WeakPolarHBondContact OD1-CA 3.35Å; N247-T256 PolarHBondContact ND2-OG1 3.48Å; N247-T256 PolarHBondContact OD1-N 3.32Å; N247-T256 PolarHBondContact OD1-OG1 2.92Å
248R97.5Very high97Very high60 Ų6054.6 Ų54.623%0.22627%0.267CS..Hα-helixtrans-64.7-39177.3-78.4178.8177173.9-0.7113R244 I245 R250 C290 L291 P292 A308R244-R248 WeakPolarHBondContact O-CG 3.34Å; R244-R248 PolarHBondContact O-N 3.44Å; I245-R248 PolarHBondContact O-N 3.24Å; I245-R248 VanDerWaalsContact O-N 3.14Å; R248-R250 PolarHBondContact O-N 2.87Å; R248-C290 PolarHBondContact NH1-SG 2.92Å; R248-L291 PolarHBondContact NH1-O 2.88Å; R248-L291 PolarHBondContact NH2-O 3.44Å; R248-P292 PolarHBondContact NH2-O 3.41Å; R248-A308 HydrophobicContact CB-CB 3.89Å; R248-A308 HydrophobicContact CG-CB 4.02Å
249L97.3Very high97Very high8 Ų856.9 Ų56.94%0.04228%0.281CS..THydrogen-bonded Turntrans-81.1-4.3177.1-64.4175.6000113I99 I245 W251 C306I99-L249 HydrophobicContact CD1-CD1 3.91Å; I245-L249 HydrophobicContact CG2-CD1 3.64Å; I245-L249 HydrophobicContact CG2-CG 4.17Å; I245-L249 WeakPolarHBondContact O-CB 3.35Å; I245-L249 WeakPolarHBondContact O-CG 3.5Å; I245-L249 PolarHBondContact O-N 2.86Å; L249-W251 VanDerWaalsContact C-N 3.27Å; L249-W251 HydrophobicContact CB-CD2 4.41Å; L249-W251 HydrophobicContact CB-CG 4.05Å; L249-W251 HydrophobicContact CD1-CD2 4.27Å; L249-W251 HydrophobicContact CD1-CH2 4.39Å; L249-W251 HydrophobicContact CD1-CZ2 3.75Å; L249-W251 PolarHBondContact O-N 3.01Å; L249-C306 HydrophobicContact CD2-CB 4.21Å
250R96.8Very high97.1Very high165 Ų16559.2 Ų59.262%0.62329%0.291SS*.THydrogen-bonded Turntrans55.739.9-172.2-59.1-172.8-179.6-1742.3113.2A246 N247 R248 T252 P307A246-R250 PolarHBondContact O-N 3.25Å; A246-R250 VanDerWaalsContact O-N 3.08Å; N247-R250 PolarHBondContact O-N 3.46Å; R248-R250 PolarHBondContact O-N 2.87Å; R250-T252 PolarHBondContact O-N 3Å; R250-T252 VanDerWaalsContact O-N 3.09Å; R250-P307 HydrophobicContact CB-CG 4.34Å; R250-P307 HydrophobicContact CG-CB 4.03Å; R250-P307 HydrophobicContact CG-CG 3.87Å
251W97.5Very high97.2Very high0 Ų058.9 Ų58.90%028%0.283CS..  trans-71.97.3171.5-74.810.4000114P89 Q95 L96 I99 A246 L249 L266 W269 I278 L282P89-W251 HydrophobicContact CG-CB 4.3Å; P89-W251 HydrophobicContact CG-CG 4.39Å; Q95-W251 HydrophobicContact CB-CZ2 4.34Å; L96-W251 HydrophobicContact CD1-CH2 4.24Å; I99-W251 HydrophobicContact CD1-CH2 4.32Å; I99-W251 HydrophobicContact CD1-CZ2 4.38Å; A246-W251 HydrophobicContact CB-CB 4.1Å; A246-W251 PolarHBondContact O-N 3.21Å; L249-W251 VanDerWaalsContact C-N 3.27Å; L249-W251 HydrophobicContact CB-CD2 4.41Å; L249-W251 HydrophobicContact CB-CG 4.05Å; L249-W251 HydrophobicContact CD1-CD2 4.27Å; L249-W251 HydrophobicContact CD1-CH2 4.39Å; L249-W251 HydrophobicContact CD1-CZ2 3.75Å; L249-W251 PolarHBondContact O-N 3.01Å; W251-L266 HydrophobicContact CB-CD2 3.83Å; W251-L266 HydrophobicContact CE3-CD2 4.15Å; W251-W269 HydrophobicContact CB-CZ2 3.98Å; W251-W269 HydrophobicContact CD2-CZ2 4.46Å; W251-W269 HydrophobicContact CG-CZ2 4.17Å; W251-W269 PolarHBondContact O-NE1 3.09Å; W251-I278 HydrophobicContact CZ3-CD1 4.21Å; W251-L282 HydrophobicContact CH2-CD2 4.41Å; W251-L282 HydrophobicContact CZ3-CD1 3.94Å; W251-L282 HydrophobicContact CZ3-CD2 4.43Å
252T96.7Very high97.2Very high8 Ų857 Ų575%0.04928%0.275CS..SBendtrans-129.3139.4176.961.60000108.9W87 R250 K254 T256 T262 A265W87-T252 VanDerWaalsContact CH2-C 3.46Å; R250-T252 PolarHBondContact O-N 3Å; R250-T252 VanDerWaalsContact O-N 3.09Å; T252-K254 VanDerWaalsContact CB-O 3.28Å; T252-K254 WeakPolarHBondContact CB-O 3.26Å; T252-K254 PolarHBondContact O-N 2.98Å; T252-K254 VanDerWaalsContact O-N 3.12Å; T252-K254 PolarHBondContact OG1-O 3.41Å; T252-T256 HydrophobicContact CG2-CG2 4.07Å; T252-T262 HydrophobicContact CG2-CG2 4.2Å; T252-A265 HydrophobicContact CG2-CB 3.74Å
253K93.6Very high97.2Very high115 Ų11559.2 Ų59.250%0.528%0.283SS..SBendtrans-51.9-37.4179.5-70.9171-177.3153.30112.8W87 E268W87-K253 VanDerWaalsContact CB-CE 3.44Å; W87-K253 HydrophobicContact CD2-CD 4.14Å; W87-K253 HydrophobicContact CD2-CG 3.37Å; W87-K253 HydrophobicContact CE3-CD 4.13Å; W87-K253 HydrophobicContact CE3-CG 3.35Å; W87-K253 HydrophobicContact CG-CD 4.35Å; W87-K253 HydrophobicContact CG-CG 4Å; W87-K253 HydrophobicContact CH2-CB 4.41Å; W87-K253 HydrophobicContact CH2-CG 3.92Å; W87-K253 VanDerWaalsContact CH2-N 3.29Å; W87-K253 HydrophobicContact CZ2-CB 4.42Å; W87-K253 HydrophobicContact CZ2-CG 3.93Å; W87-K253 HydrophobicContact CZ3-CB 4.48Å; W87-K253 HydrophobicContact CZ3-CG 3.64Å; K253-E268 IonicContact NZ-OE2 2.66Å; K253-E268 PolarHBondContact NZ-OE2 3.24Å
254K94.6Very high97.1Very high173 Ų17359.3 Ų59.375%0.75229%0.291SS*.SBendtrans-132.6154.6176.4-62.6-179.5-177.21770108.4T252 T256T252-K254 VanDerWaalsContact CB-O 3.28Å; T252-K254 WeakPolarHBondContact CB-O 3.26Å; T252-K254 PolarHBondContact O-N 2.98Å; T252-K254 VanDerWaalsContact O-N 3.12Å; T252-K254 PolarHBondContact OG1-O 3.41Å; K254-T256 PolarHBondContact O-N 3.12Å
255A95.8Very high97.1Very high88 Ų8858.1 Ų58.173%0.72729%0.29SS*.  trans-58.9126.2171.900000109.4N247N247-A255 WeakPolarHBondContact OD1-CA 3.35Å
256T97.6Very high97.1Very high22 Ų2258.1 Ų58.114%0.13529%0.289CS..  trans-94.5148.1-179.248.40000109.7H243 N247 T252 K254 E261 T262 A265H243-T256 PolarHBondContact CE1-O 3.39Å; N247-T256 PolarHBondContact ND2-OG1 3.48Å; N247-T256 PolarHBondContact OD1-N 3.32Å; N247-T256 PolarHBondContact OD1-OG1 2.92Å; T252-T256 HydrophobicContact CG2-CG2 4.07Å; K254-T256 PolarHBondContact O-N 3.12Å; T256-E261 HydrophobicContact CG2-CB 3.89Å; T256-T262 PolarHBondContact OG1-OG1 3.42Å; T256-A265 HydrophobicContact CG2-CB 4.31Å
257K97Very high97Very high190 Ų19060.3 Ų60.383%0.82630%0.3SS*.SBendtrans-102.5-17.9-176.2-63.9-178.6-178.8178.90113.1E261K257-E261 PolarHBondContact N-OE2 3.16Å
258S97.3Very high96.9Very high34 Ų3463.8 Ų63.824%0.23832%0.315CS..SBendtrans-131.4153.7-179.466.90000112H243 E260 E261 T262H243-S258 PolarHBondContact ND1-O 3.4Å; S258-E260 PolarHBondContact O-N 2.88Å; S258-E261 PolarHBondContact O-N 3.09Å; S258-E261 WeakPolarHBondContact OG-CB 3.3Å; S258-E261 VanDerWaalsContact OG-CG 3.23Å; S258-E261 WeakPolarHBondContact OG-CG 3.24Å; S258-E261 PolarHBondContact OG-N 2.83Å; S258-E261 PolarHBondContact OG-OE1 3.02Å; S258-T262 PolarHBondContact O-N 3.5Å; S258-T262 VanDerWaalsContact O-N 3.11Å; S258-T262 PolarHBondContact O-OG1 2.84Å
259P96.9Very high96.9Very high54 Ų5461.8 Ų61.835%0.35131%0.307SS..Hα-helixtrans-57-34.5173.4-28.336.8000113.6V238 T262 R263V238-P259 HydrophobicContact CB-CB 4.27Å; V238-P259 WeakPolarHBondContact CB-O 3.37Å; V238-P259 HydrophobicContact CG1-CB 3.83Å; V238-P259 WeakPolarHBondContact CG1-O 3.41Å; P259-T262 PolarHBondContact O-N 3.5Å; P259-R263 PolarHBondContact O-N 3.08Å
260E96.7Very high96.9Very high74 Ų7461.7 Ų61.735%0.34631%0.307SS..Hα-helixtrans-69.3-41.3179.4-168.858.2-142.900111.8P219 S258 T262 R263 A264P219-E260 WeakPolarHBondContact CB-OE2 3.35Å; S258-E260 PolarHBondContact O-N 2.88Å; E260-T262 VanDerWaalsContact C-N 3.31Å; E260-T262 PolarHBondContact O-N 2.77Å; E260-R263 WeakPolarHBondContact O-CB 3.36Å; E260-R263 PolarHBondContact O-N 2.87Å; E260-R263 IonicContact OE1-CZ 2.67Å; E260-R263 IonicContact OE1-NE 3.53Å; E260-R263 PolarHBondContact OE1-NE 3.38Å; E260-R263 IonicContact OE1-NH2 2.98Å; E260-R263 PolarHBondContact OE1-NH2 3.4Å; E260-R263 IonicContact OE2-NE 2.78Å; E260-A264 PolarHBondContact O-N 3.08Å
261E97.8Very high96.9Very high89 Ų8956.1 Ų56.142%0.41629%0.292SS..Hα-helixtrans-60.5-41171.1-76.2161.3-135.900111.7T256 K257 S258 A265T256-E261 HydrophobicContact CG2-CB 3.89Å; K257-E261 PolarHBondContact N-OE2 3.16Å; S258-E261 PolarHBondContact O-N 3.09Å; S258-E261 WeakPolarHBondContact OG-CB 3.3Å; S258-E261 VanDerWaalsContact OG-CG 3.23Å; S258-E261 WeakPolarHBondContact OG-CG 3.24Å; S258-E261 PolarHBondContact OG-N 2.83Å; S258-E261 PolarHBondContact OG-OE1 3.02Å; E261-A265 VanDerWaalsContact O-CB 3.29Å; E261-A265 WeakPolarHBondContact O-CB 3.24Å; E261-A265 PolarHBondContact O-N 3.26Å
262T98.4Very high96.8Very high0 Ų063.6 Ų63.60%032%0.32CS..Hα-helixtrans-64.4-40.7175.2-53.90000111.9V238 H243 A246 T252 T256 S258 P259 E260 A265 L266V238-T262 HydrophobicContact CG1-CG2 4.17Å; H243-T262 PolarHBondContact CE1-OG1 2.95Å; H243-T262 PolarHBondContact ND1-OG1 3.21Å; A246-T262 HydrophobicContact CB-CG2 3.75Å; T252-T262 HydrophobicContact CG2-CG2 4.2Å; T256-T262 PolarHBondContact OG1-OG1 3.42Å; S258-T262 PolarHBondContact O-N 3.5Å; S258-T262 VanDerWaalsContact O-N 3.11Å; S258-T262 PolarHBondContact O-OG1 2.84Å; P259-T262 PolarHBondContact O-N 3.5Å; E260-T262 VanDerWaalsContact C-N 3.31Å; E260-T262 PolarHBondContact O-N 2.77Å; T262-A265 PolarHBondContact O-N 2.87Å; T262-L266 HydrophobicContact CG2-CD1 3.87Å; T262-L266 HydrophobicContact CG2-CG 4.1Å; T262-L266 WeakPolarHBondContact O-CB 3.45Å; T262-L266 VanDerWaalsContact O-CG 3.29Å; T262-L266 WeakPolarHBondContact O-CG 3.48Å; T262-L266 PolarHBondContact O-N 3.27Å
263R98.1Very high96.8Very high45 Ų4569.9 Ų69.917%0.1735%0.349CS..Hα-helixtrans-57.4-55.5177.4-176.5-172.472.278.28.7110.1I236 V238 P259 E260 A265 L266 E267I236-R263 HydrophobicContact CB-CG 4.27Å; I236-R263 VanDerWaalsContact O-CD 3.28Å; I236-R263 WeakPolarHBondContact O-CD 3.29Å; I236-R263 VanDerWaalsContact O-CG 3.27Å; I236-R263 WeakPolarHBondContact O-CG 3.35Å; V238-R263 HydrophobicContact CB-CB 4.37Å; V238-R263 HydrophobicContact CG2-CB 3.64Å; V238-R263 HydrophobicContact CG2-CG 4.23Å; P259-R263 PolarHBondContact O-N 3.08Å; E260-R263 WeakPolarHBondContact O-CB 3.36Å; E260-R263 PolarHBondContact O-N 2.87Å; E260-R263 IonicContact OE1-CZ 2.67Å; E260-R263 IonicContact OE1-NE 3.53Å; E260-R263 PolarHBondContact OE1-NE 3.38Å; E260-R263 IonicContact OE1-NH2 2.98Å; E260-R263 PolarHBondContact OE1-NH2 3.4Å; E260-R263 IonicContact OE2-NE 2.78Å; R263-A265 VanDerWaalsContact C-N 3.28Å; R263-A265 PolarHBondContact O-N 3.4Å; R263-L266 PolarHBondContact O-N 2.84Å; R263-L266 VanDerWaalsContact O-N 3.14Å; R263-E267 WeakPolarHBondContact CD-OE1 3.26Å; R263-E267 HydrophobicContact CG-CG 4.34Å; R263-E267 VanDerWaalsContact CG-OE1 3.24Å; R263-E267 WeakPolarHBondContact CG-OE1 3.2Å; R263-E267 IonicContact CZ-OE1 3.44Å; R263-E267 IonicContact CZ-OE2 3.16Å; R263-E267 IonicContact NH1-OE1 3.74Å; R263-E267 PolarHBondContact NH1-OE1 3.44Å; R263-E267 IonicContact NH1-OE2 3.7Å; R263-E267 PolarHBondContact NH1-OE2 3.38Å; R263-E267 WeakPolarHBondContact O-CG 3.35Å; R263-E267 PolarHBondContact O-N 3.16Å
264A97.4Very high97Very high42 Ų4265.8 Ų65.835%0.34733%0.332SS..Hα-helixtrans-56-45.1178.600000111.4E260 L266 E267 E268E260-A264 PolarHBondContact O-N 3.08Å; A264-L266 PolarHBondContact O-N 2.88Å; A264-E267 PolarHBondContact O-N 3.01Å; A264-E268 WeakPolarHBondContact O-CG 3.46Å; A264-E268 PolarHBondContact O-N 3.12Å; A264-E268 VanDerWaalsContact O-N 3.12Å
265A97.5Very high97.1Very high15 Ų1559 Ų5912%0.12430%0.302CS..Hα-helixtrans-65.2-33.5179.200000113.9T252 T256 E261 T262 R263 W269T252-A265 HydrophobicContact CG2-CB 3.74Å; T256-A265 HydrophobicContact CG2-CB 4.31Å; E261-A265 VanDerWaalsContact O-CB 3.29Å; E261-A265 WeakPolarHBondContact O-CB 3.24Å; E261-A265 PolarHBondContact O-N 3.26Å; T262-A265 PolarHBondContact O-N 2.87Å; R263-A265 VanDerWaalsContact C-N 3.28Å; R263-A265 PolarHBondContact O-N 3.4Å; A265-W269 PolarHBondContact O-NE1 2.69Å
266L97.9Very high97.1Very high0 Ų060.8 Ų60.80%030%0.295CS..Hα-helixtrans-75-42.5175.5-71.1175.1000111.3I236 V238 V242 A246 W251 T262 R263 A264 E268 W269 L270I236-L266 HydrophobicContact CD1-CB 3.58Å; I236-L266 HydrophobicContact CD1-CD1 4.49Å; I236-L266 HydrophobicContact CG2-CD1 4.42Å; V238-L266 HydrophobicContact CG2-CD1 4.45Å; V242-L266 HydrophobicContact CG1-CD1 4.04Å; A246-L266 HydrophobicContact CB-CD1 4.38Å; A246-L266 HydrophobicContact CB-CD2 4.33Å; W251-L266 HydrophobicContact CB-CD2 3.83Å; W251-L266 HydrophobicContact CE3-CD2 4.15Å; T262-L266 HydrophobicContact CG2-CD1 3.87Å; T262-L266 HydrophobicContact CG2-CG 4.1Å; T262-L266 WeakPolarHBondContact O-CB 3.45Å; T262-L266 VanDerWaalsContact O-CG 3.29Å; T262-L266 WeakPolarHBondContact O-CG 3.48Å; T262-L266 PolarHBondContact O-N 3.27Å; R263-L266 PolarHBondContact O-N 2.84Å; R263-L266 VanDerWaalsContact O-N 3.14Å; A264-L266 PolarHBondContact O-N 2.88Å; L266-E268 PolarHBondContact O-N 3.1Å; L266-W269 HydrophobicContact CD2-CZ2 3.91Å; L266-W269 PolarHBondContact O-N 3.27Å; L266-L270 WeakPolarHBondContact O-CB 3.07Å; L266-L270 PolarHBondContact O-N 3.15Å
267E97.3Very high97Very high46 Ų4661.8 Ų61.822%0.21530%0.298CS..Hα-helixtrans-66.6-21.5-179.9-69.9-178.3-172.600113.2G235 I236 R263 A264 W269 W275G235-E267 WeakPolarHBondContact CA-OE1 3.47Å; I236-E267 HydrophobicContact CB-CG 4.39Å; I236-E267 HydrophobicContact CD1-CG 3.72Å; I236-E267 HydrophobicContact CG1-CG 3.83Å; I236-E267 PolarHBondContact N-OE1 2.79Å; R263-E267 WeakPolarHBondContact CD-OE1 3.26Å; R263-E267 HydrophobicContact CG-CG 4.34Å; R263-E267 VanDerWaalsContact CG-OE1 3.24Å; R263-E267 WeakPolarHBondContact CG-OE1 3.2Å; R263-E267 IonicContact CZ-OE1 3.44Å; R263-E267 IonicContact CZ-OE2 3.16Å; R263-E267 IonicContact NH1-OE1 3.74Å; R263-E267 PolarHBondContact NH1-OE1 3.44Å; R263-E267 IonicContact NH1-OE2 3.7Å; R263-E267 PolarHBondContact NH1-OE2 3.38Å; R263-E267 WeakPolarHBondContact O-CG 3.35Å; R263-E267 PolarHBondContact O-N 3.16Å; A264-E267 PolarHBondContact O-N 3.01Å; E267-W269 PolarHBondContact O-N 3.12Å; E267-W275 HydrophobicContact CB-CH2 3.72Å; E267-W275 HydrophobicContact CB-CZ2 3.56Å; E267-W275 HydrophobicContact CG-CD2 4.3Å; E267-W275 HydrophobicContact CG-CE3 4.28Å; E267-W275 HydrophobicContact CG-CH2 3.51Å; E267-W275 HydrophobicContact CG-CZ2 3.53Å; E267-W275 HydrophobicContact CG-CZ3 3.9Å
268E96.3Very high97Very high111 Ų11152.8 Ų52.852%0.51926%0.259SS..THydrogen-bonded Turntrans-61.7-27.1173.9-84178.6-153.100113.7V86 K253 A264 L266V86-E268 WeakPolarHBondContact CG1-O 3.43Å; K253-E268 IonicContact NZ-OE2 2.66Å; K253-E268 PolarHBondContact NZ-OE2 3.24Å; A264-E268 WeakPolarHBondContact O-CG 3.46Å; A264-E268 PolarHBondContact O-N 3.12Å; A264-E268 VanDerWaalsContact O-N 3.12Å; L266-E268 PolarHBondContact O-N 3.1Å
269W96.4Very high97Very high19 Ų1952 Ų527%0.07225%0.252CS..THydrogen-bonded Turntrans-139.1-28.2-170.470.4-95.5000115.5V86 W87 E88 P89 W92 W251 A265 L266 E267 P271V86-W269 HydrophobicContact CG1-CB 3.7Å; W87-W269 AromaticContact CE3-CD1 3.97Å; W87-W269 HydrophobicContact CE3-CG 4.35Å; W87-W269 AromaticContact CZ3-CD1 3.74Å; W87-W269 HydrophobicContact CZ3-CG 4.38Å; W87-W269 AromaticContact CZ3-NE1 3.81Å; W87-W269 WeakPolarHBondContact O-CB 3.31Å; E88-W269 HydrophobicContact CB-CE3 4.03Å; P89-W269 VanDerWaalsContact CD-CD2 3.48Å; P89-W269 VanDerWaalsContact CD-CE2 3.46Å; P89-W269 HydrophobicContact CG-CD2 4.2Å; P89-W269 HydrophobicContact CG-CE3 4.45Å; P89-W269 HydrophobicContact CG-CH2 3.72Å; P89-W269 HydrophobicContact CG-CZ2 3.39Å; P89-W269 HydrophobicContact CG-CZ3 4.24Å; W92-W269 HydrophobicContact CB-CH2 4Å; W92-W269 HydrophobicContact CB-CZ3 4.18Å; W92-W269 AromaticContact CD1-CZ3 3.97Å; W92-W269 HydrophobicContact CD2-CH2 4.04Å; W92-W269 AromaticContact CD2-CZ3 3.49Å; W92-W269 HydrophobicContact CD2-CZ3 3.49Å; W92-W269 VanDerWaalsContact CD2-CZ3 3.49Å; W92-W269 AromaticContact CE2-CZ3 3.76Å; W92-W269 HydrophobicContact CE3-CH2 4.2Å; W92-W269 AromaticContact CE3-CZ3 3.87Å; W92-W269 HydrophobicContact CE3-CZ3 3.87Å; W92-W269 AromaticContact CG-CH2 3.97Å; W92-W269 HydrophobicContact CG-CH2 3.97Å; W92-W269 AromaticContact CG-CZ3 3.64Å; W92-W269 HydrophobicContact CG-CZ3 3.64Å; W92-W269 HydrophobicContact CZ2-CZ3 4.36Å; W92-W269 HydrophobicContact CZ3-CZ3 4.46Å; W251-W269 HydrophobicContact CB-CZ2 3.98Å; W251-W269 HydrophobicContact CD2-CZ2 4.46Å; W251-W269 HydrophobicContact CG-CZ2 4.17Å; W251-W269 PolarHBondContact O-NE1 3.09Å; A265-W269 PolarHBondContact O-NE1 2.69Å; L266-W269 HydrophobicContact CD2-CZ2 3.91Å; L266-W269 PolarHBondContact O-N 3.27Å; E267-W269 PolarHBondContact O-N 3.12Å; W269-P271 WeakPolarHBondContact O-CD 3.16Å
270L97Very high97Very high6 Ų650.8 Ų50.83%0.03125%0.249CC..SBendtrans-70.6128.3-177-174.276000109.8W92 I236 L266 R272 L274 W275 I278W92-L270 HydrophobicContact CE3-CD1 4.38Å; W92-L270 HydrophobicContact CZ3-CD1 4.11Å; I236-L270 HydrophobicContact CD1-CD2 3.88Å; L266-L270 WeakPolarHBondContact O-CB 3.07Å; L266-L270 PolarHBondContact O-N 3.15Å; L270-R272 PolarHBondContact O-N 3.4Å; L270-L274 HydrophobicContact CD1-CB 4.45Å; L270-L274 HydrophobicContact CD1-CD1 3.88Å; L270-L274 HydrophobicContact CD2-CB 4.2Å; L270-L274 HydrophobicContact CG-CB 4.23Å; L270-L274 HydrophobicContact CG-CD1 4.39Å; L270-W275 PolarHBondContact O-NE1 2.88Å; L270-I278 HydrophobicContact CD2-CD1 3.8Å; L270-I278 HydrophobicContact CD2-CG1 3.45Å; L270-I278 VanDerWaalsContact CD2-CG1 3.45Å
271P97.1Very high97Very high47 Ų4748.4 Ų48.431%0.30524%0.239SC..  trans-51.9134.5176.5-27.734000112.5W92 W269 E273 L274W92-P271 HydrophobicContact CH2-CG 4.01Å; W92-P271 HydrophobicContact CZ2-CG 4.35Å; W269-P271 WeakPolarHBondContact O-CD 3.16Å; P271-E273 WeakPolarHBondContact CB-OE2 3.38Å; P271-E273 PolarHBondContact O-N 2.72Å; P271-L274 HydrophobicContact CB-CD1 4.26Å; P271-L274 HydrophobicContact CB-CG 4.25Å; P271-L274 HydrophobicContact CG-CD1 4.22Å; P271-L274 WeakPolarHBondContact O-CB 3.49Å; P271-L274 PolarHBondContact O-N 2.91Å
272R95.8Very high97.1Very high158 Ų15844.1 Ų44.160%0.59622%0.219SC*.G310 helixtrans-61.6-30.1-170.5-170172.5-179.6-144-3.6112.8V233 L270 L274 W275V233-R272 PolarHBondContact O-NH2 3.18Å; L270-R272 PolarHBondContact O-N 3.4Å; R272-L274 PolarHBondContact O-N 3.47Å; R272-W275 HydrophobicContact CG-CD2 4.1Å; R272-W275 HydrophobicContact CG-CE3 4.23Å; R272-W275 WeakPolarHBondContact O-CB 3.27Å; R272-W275 PolarHBondContact O-N 2.79Å; R272-W275 VanDerWaalsContact O-N 3.13Å
273E96.7Very high97.1Very high140 Ų14044.5 Ų44.565%0.65422%0.221SC*.G310 helixtrans-61.3-28.4178.4-5769.3-146.300111.2P271 H276P271-E273 WeakPolarHBondContact CB-OE2 3.38Å; P271-E273 PolarHBondContact O-N 2.72Å; E273-H276 PolarHBondContact O-CE1 3.28Å; E273-H276 PolarHBondContact O-ND1 3.5Å
274L97Very high97.1Very high28 Ų2842.4 Ų42.415%0.14721%0.213CC..G310 helixtrans-83.9-17.4-179.4-54.7-178.1000112.8W92 L96 R100 L270 P271 R272 H276 E277 I278W92-L274 HydrophobicContact CH2-CD1 3.93Å; W92-L274 HydrophobicContact CZ3-CD1 3.74Å; L96-L274 HydrophobicContact CD2-CD1 3.87Å; R100-L274 VanDerWaalsContact NH2-CD2 3.32Å; L270-L274 HydrophobicContact CD1-CB 4.45Å; L270-L274 HydrophobicContact CD1-CD1 3.88Å; L270-L274 HydrophobicContact CD2-CB 4.2Å; L270-L274 HydrophobicContact CG-CB 4.23Å; L270-L274 HydrophobicContact CG-CD1 4.39Å; P271-L274 HydrophobicContact CB-CD1 4.26Å; P271-L274 HydrophobicContact CB-CG 4.25Å; P271-L274 HydrophobicContact CG-CD1 4.22Å; P271-L274 WeakPolarHBondContact O-CB 3.49Å; P271-L274 PolarHBondContact O-N 2.91Å; R272-L274 PolarHBondContact O-N 3.47Å; L274-H276 PolarHBondContact O-N 2.7Å; L274-E277 HydrophobicContact CB-CG 4.4Å; L274-E277 WeakPolarHBondContact O-CG 3.44Å; L274-E277 PolarHBondContact O-N 3.43Å; L274-I278 WeakPolarHBondContact O-CG1 3.33Å; L274-I278 PolarHBondContact O-N 3.46Å
275W97.6Very high97.1Very high32 Ų3240.6 Ų40.612%0.12120%0.197CC..Hα-helixtrans-58.5-33.1-170.1-70.415.1000113.6V233 I236 E267 L270 R272V233-W275 HydrophobicContact CG1-CB 3.76Å; V233-W275 HydrophobicContact CG1-CE3 4.35Å; I236-W275 HydrophobicContact CD1-CD2 4.21Å; I236-W275 HydrophobicContact CD1-CG 3.97Å; I236-W275 HydrophobicContact CG1-CB 3.81Å; I236-W275 HydrophobicContact CG1-CD2 3.71Å; I236-W275 HydrophobicContact CG1-CE3 4.23Å; I236-W275 HydrophobicContact CG1-CG 3.5Å; I236-W275 VanDerWaalsContact CG1-CG 3.5Å; E267-W275 HydrophobicContact CB-CH2 3.72Å; E267-W275 HydrophobicContact CB-CZ2 3.56Å; E267-W275 HydrophobicContact CG-CD2 4.3Å; E267-W275 HydrophobicContact CG-CE3 4.28Å; E267-W275 HydrophobicContact CG-CH2 3.51Å; E267-W275 HydrophobicContact CG-CZ2 3.53Å; E267-W275 HydrophobicContact CG-CZ3 3.9Å; L270-W275 PolarHBondContact O-NE1 2.88Å; R272-W275 HydrophobicContact CG-CD2 4.1Å; R272-W275 HydrophobicContact CG-CE3 4.23Å; R272-W275 WeakPolarHBondContact O-CB 3.27Å; R272-W275 PolarHBondContact O-N 2.79Å; R272-W275 VanDerWaalsContact O-N 3.13Å
276H94.6Very high97.2Very high125 Ų12539.9 Ų39.958%0.57919%0.192SC*.Hα-helixtrans-67.6-38179.182.5-80000112.7V233 E273 L274V233-H276 HydrophobicContact CG2-CB 3.84Å; E273-H276 PolarHBondContact O-CE1 3.28Å; E273-H276 PolarHBondContact O-ND1 3.5Å; L274-H276 PolarHBondContact O-N 2.7Å
277E95.5Very high97.1Very high43 Ų4342.3 Ų42.320%0.20120%0.203CC..Hα-helixtrans-82.2-26.7-174.757.9156.9-152.200113R100 L274 N279 G280 L281R100-E277 IonicContact CZ-OE1 3.51Å; R100-E277 IonicContact CZ-OE2 2.77Å; R100-E277 IonicContact NE-OE1 3.66Å; R100-E277 IonicContact NE-OE2 2.71Å; R100-E277 PolarHBondContact NE-OE2 2.99Å; R100-E277 IonicContact NH2-OE1 2.9Å; R100-E277 PolarHBondContact NH2-OE1 3.35Å; R100-E277 IonicContact NH2-OE2 2.76Å; R100-E277 PolarHBondContact NH2-OE2 2.99Å; L274-E277 HydrophobicContact CB-CG 4.4Å; L274-E277 WeakPolarHBondContact O-CG 3.44Å; L274-E277 PolarHBondContact O-N 3.43Å; E277-N279 PolarHBondContact O-N 3.25Å; E277-G280 PolarHBondContact O-N 2.81Å; E277-L281 WeakPolarHBondContact O-CB 3.43Å; E277-L281 PolarHBondContact O-N 2.88Å
278I97.3Very high97.1Very high1 Ų142.1 Ų42.11%0.00520%0.202CC..Hα-helixtrans-57-45.5-169-71.1-59.8000112.6L96 I236 V242 W251 L270 L274 L282L96-I278 HydrophobicContact CD1-CD1 4.35Å; I236-I278 HydrophobicContact CG2-CB 4.4Å; I236-I278 HydrophobicContact CG2-CG2 4.04Å; V242-I278 HydrophobicContact CG1-CG2 4.18Å; W251-I278 HydrophobicContact CZ3-CD1 4.21Å; L270-I278 HydrophobicContact CD2-CD1 3.8Å; L270-I278 HydrophobicContact CD2-CG1 3.45Å; L270-I278 VanDerWaalsContact CD2-CG1 3.45Å; L274-I278 WeakPolarHBondContact O-CG1 3.33Å; L274-I278 PolarHBondContact O-N 3.46Å; I278-L282 HydrophobicContact CG2-CD1 3.83Å; I278-L282 HydrophobicContact CG2-CG 4.26Å; I278-L282 VanDerWaalsContact O-CB 3.32Å; I278-L282 WeakPolarHBondContact O-CB 3.15Å; I278-L282 VanDerWaalsContact O-CG 3.31Å; I278-L282 WeakPolarHBondContact O-CG 3.28Å; I278-L282 PolarHBondContact O-N 3.27Å
279N97.3Very high97.2Very high16 Ų1637.9 Ų37.99%0.08618%0.184CC..Hα-helixtrans-63.4-57.9-176-177.3-95.3000111.1A237 E277 L281 L282 V283A237-N279 HydrophobicContact CB-CB 4.02Å; A237-N279 WeakPolarHBondContact O-CB 3.4Å; A237-N279 PolarHBondContact O-ND2 3.16Å; E277-N279 PolarHBondContact O-N 3.25Å; N279-L281 VanDerWaalsContact C-N 3.3Å; N279-L281 PolarHBondContact O-N 3.14Å; N279-L282 PolarHBondContact O-N 2.75Å; N279-V283 VanDerWaalsContact O-CB 3.29Å; N279-V283 WeakPolarHBondContact O-CB 3.1Å; N279-V283 WeakPolarHBondContact O-CG2 3.3Å; N279-V283 PolarHBondContact O-N 2.83Å
280G96.9Very high97.3Very high29 Ų2937.7 Ų37.730%0.29919%0.186SC..Hα-helixtrans-58.5-43-178.600000112.2E277 G284E277-G280 PolarHBondContact O-N 2.81Å; G280-G284 PolarHBondContact O-N 3.43Å; G280-G284 VanDerWaalsContact O-N 3.08Å
281L98.3Very high97.3Very high24 Ų2439.5 Ų39.513%0.12620%0.195CC..Hα-helixtrans-61.2-52.3179.7-175.267.7000112.1L96 I99 R100 R103 E277 N279 F285L96-L281 HydrophobicContact CD1-CD2 3.49Å; L96-L281 VanDerWaalsContact CD1-CD2 3.49Å; I99-L281 HydrophobicContact CG2-CD1 3.97Å; I99-L281 HydrophobicContact CG2-CD2 3.92Å; I99-L281 HydrophobicContact CG2-CG 3.68Å; R100-L281 HydrophobicContact CG-CD1 4.29Å; R100-L281 HydrophobicContact CG-CD2 3.92Å; R103-L281 HydrophobicContact CB-CD1 3.68Å; R103-L281 HydrophobicContact CG-CD1 3.98Å; E277-L281 WeakPolarHBondContact O-CB 3.43Å; E277-L281 PolarHBondContact O-N 2.88Å; N279-L281 VanDerWaalsContact C-N 3.3Å; N279-L281 PolarHBondContact O-N 3.14Å; L281-F285 WeakPolarHBondContact O-CB 3.43Å; L281-F285 PolarHBondContact O-N 3.11Å
282L98.5Very high97.3Very high0 Ų041.2 Ų41.20%021%0.206CC..Hα-helixtrans-75.2-30-177-63.9-170.2000112.9I99 V242 I245 W251 I278 N279 G286I99-L282 HydrophobicContact CD1-CD2 3.88Å; I99-L282 HydrophobicContact CG2-CD2 4.27Å; V242-L282 HydrophobicContact CB-CD1 4.48Å; V242-L282 HydrophobicContact CG1-CD1 4.11Å; V242-L282 HydrophobicContact CG2-CB 4.12Å; V242-L282 HydrophobicContact CG2-CD1 4.45Å; I245-L282 HydrophobicContact CD1-CB 4.1Å; I245-L282 WeakPolarHBondContact CD1-O 3.39Å; I245-L282 HydrophobicContact CG2-CD1 4.35Å; I245-L282 HydrophobicContact CG2-CD2 4.03Å; W251-L282 HydrophobicContact CH2-CD2 4.41Å; W251-L282 HydrophobicContact CZ3-CD1 3.94Å; W251-L282 HydrophobicContact CZ3-CD2 4.43Å; I278-L282 HydrophobicContact CG2-CD1 3.83Å; I278-L282 HydrophobicContact CG2-CG 4.26Å; I278-L282 VanDerWaalsContact O-CB 3.32Å; I278-L282 WeakPolarHBondContact O-CB 3.15Å; I278-L282 VanDerWaalsContact O-CG 3.31Å; I278-L282 WeakPolarHBondContact O-CG 3.28Å; I278-L282 PolarHBondContact O-N 3.27Å; N279-L282 PolarHBondContact O-N 2.75Å; L282-G286 PolarHBondContact O-N 3.36Å
283V97.9Very high97.3Very high8 Ų838.9 Ų38.95%0.04821%0.209CC..Hα-helixtrans-60.8-53.7171.7171.20000109.6V110 D239 H241 N279 F285 G286 Q287V110-V283 HydrophobicContact CB-CG1 3.77Å; V110-V283 HydrophobicContact CG1-CB 4.34Å; V110-V283 HydrophobicContact CG1-CG1 3.97Å; V110-V283 HydrophobicContact CG2-CB 4.31Å; V110-V283 HydrophobicContact CG2-CG1 3.8Å; D239-V283 WeakPolarHBondContact OD2-CG2 3.5Å; H241-V283 HydrophobicContact CB-CG2 4.09Å; N279-V283 VanDerWaalsContact O-CB 3.29Å; N279-V283 WeakPolarHBondContact O-CB 3.1Å; N279-V283 WeakPolarHBondContact O-CG2 3.3Å; N279-V283 PolarHBondContact O-N 2.83Å; V283-F285 PolarHBondContact O-N 3.31Å; V283-G286 CarbonylContact O-C 3.43Å; V283-G286 PolarHBondContact O-N 3.08Å; V283-G286 VanDerWaalsContact O-N 3.09Å; V283-Q287 HydrophobicContact CG1-CG 4.38Å; V283-Q287 VanDerWaalsContact O-CG 3.31Å; V283-Q287 WeakPolarHBondContact O-CG 3.12Å; V283-Q287 PolarHBondContact O-N 3.23Å
284G98.2Very high97.2Very high0 Ų043 Ų430%022%0.219CC..Hα-helixtrans-61.5-42.517900000112.5G280 G286 Q287 Q288G280-G284 PolarHBondContact O-N 3.43Å; G280-G284 VanDerWaalsContact O-N 3.08Å; G284-G286 VanDerWaalsContact C-N 3.3Å; G284-G286 PolarHBondContact O-N 2.92Å; G284-Q287 WeakPolarHBondContact O-CB 3.36Å; G284-Q287 PolarHBondContact O-N 2.8Å; G284-Q287 VanDerWaalsContact O-N 3.11Å; G284-Q288 PolarHBondContact O-N 3.5Å; G284-Q288 VanDerWaalsContact O-N 3.14Å
285F98.6Very high97.2Very high4 Ų443.6 Ų43.62%0.01822%0.224CC..Hα-helixtrans-60.2-39.6173.9-179.7-118.8000112.6I99 M102 R103 I245 L281 V283 Q287 T289 C290I99-F285 HydrophobicContact CD1-CD1 4.31Å; I99-F285 HydrophobicContact CD1-CE1 4.27Å; I99-F285 HydrophobicContact CG1-CD1 4.2Å; I99-F285 HydrophobicContact CG1-CD2 4.49Å; I99-F285 HydrophobicContact CG1-CE1 4.11Å; I99-F285 HydrophobicContact CG1-CE2 4.42Å; I99-F285 HydrophobicContact CG1-CG 4.39Å; I99-F285 HydrophobicContact CG1-CZ 4.24Å; I99-F285 HydrophobicContact CG2-CB 3.98Å; I99-F285 HydrophobicContact CG2-CD1 4.36Å; I99-F285 HydrophobicContact CG2-CD2 4.27Å; I99-F285 HydrophobicContact CG2-CG 3.96Å; M102-F285 HydrophobicContact CE-CD2 4.15Å; M102-F285 HydrophobicContact CE-CE2 3.34Å; M102-F285 HydrophobicContact CE-CZ 3.9Å; M102-F285 HydrophobicContact SD-CE2 3.89Å; R103-F285 HydrophobicContact CG-CB 4.18Å; I245-F285 HydrophobicContact CD1-CD1 3.96Å; I245-F285 HydrophobicContact CG1-CD1 4.47Å; I245-F285 HydrophobicContact CG2-CD1 4.25Å; I245-F285 HydrophobicContact CG2-CE1 4.31Å; L281-F285 WeakPolarHBondContact O-CB 3.43Å; L281-F285 PolarHBondContact O-N 3.11Å; V283-F285 PolarHBondContact O-N 3.31Å; F285-Q287 VanDerWaalsContact C-N 3.34Å; F285-T289 HydrophobicContact CD2-CG2 4.3Å; F285-T289 VanDerWaalsContact CE2-CB 3.45Å; F285-T289 HydrophobicContact CE2-CG2 3.51Å; F285-T289 HydrophobicContact CZ-CG2 4.04Å; F285-T289 WeakPolarHBondContact O-CA 3.49Å; F285-T289 PolarHBondContact O-N 3.14Å; F285-C290 HydrophobicContact CD1-CB 3.8Å; F285-C290 HydrophobicContact CE1-CB 3.41Å; F285-C290 VanDerWaalsContact CE1-CB 3.41Å; F285-C290 HydrophobicContact CZ-CB 3.9Å; F285-C290 PolarHBondContact O-N 3.37Å
286G98.3Very high97.2Very high1 Ų149.5 Ų49.51%0.0125%0.247CC..Hα-helixtrans-74.6-19.9176.100000114.5R244 L282 V283 G284R244-G286 PolarHBondContact NH2-O 3.45Å; L282-G286 PolarHBondContact O-N 3.36Å; V283-G286 CarbonylContact O-C 3.43Å; V283-G286 PolarHBondContact O-N 3.08Å; V283-G286 VanDerWaalsContact O-N 3.09Å; G284-G286 VanDerWaalsContact C-N 3.3Å; G284-G286 PolarHBondContact O-N 2.92Å
287Q97.3Very high97.3Very high51 Ų5144.5 Ų44.524%0.23823%0.225CC..Hα-helixtrans-79.9-29.4174.2-74.5175.7-17.500112.2D144 V283 G284 F285 L291D144-Q287 PolarHBondContact OD2-NE2 3.21Å; V283-Q287 HydrophobicContact CG1-CG 4.38Å; V283-Q287 VanDerWaalsContact O-CG 3.31Å; V283-Q287 WeakPolarHBondContact O-CG 3.12Å; V283-Q287 PolarHBondContact O-N 3.23Å; G284-Q287 WeakPolarHBondContact O-CB 3.36Å; G284-Q287 PolarHBondContact O-N 2.8Å; G284-Q287 VanDerWaalsContact O-N 3.11Å; F285-Q287 VanDerWaalsContact C-N 3.34Å; Q287-L291 VanDerWaalsContact O-CD2 3.3Å; Q287-L291 WeakPolarHBondContact O-CD2 3.4Å
288Q97.6Very high97.2Very high41 Ų4150.3 Ų50.319%0.19225%0.253CS..Hα-helixtrans-110.7-37.3-172.5-65.2175.7-3700114.6D107 A108 G284 R296D107-Q288 PolarHBondContact O-NE2 2.61Å; D107-Q288 PolarHBondContact OD1-NE2 2.9Å; A108-Q288 HydrophobicContact CB-CG 4.12Å; G284-Q288 PolarHBondContact O-N 3.5Å; G284-Q288 VanDerWaalsContact O-N 3.14Å; Q288-R296 WeakPolarHBondContact O-CD 3.35Å; Q288-R296 PolarHBondContact O-NH1 3.31Å
289T98Very high97.1Very high22 Ų2254.1 Ų54.114%0.13529%0.285CS..THydrogen-bonded Turntrans-122.5-61.1-168.4-53.90000112.1M102 F285 L291 R296 C300M102-T289 HydrophobicContact SD-CG2 4.35Å; F285-T289 HydrophobicContact CD2-CG2 4.3Å; F285-T289 VanDerWaalsContact CE2-CB 3.45Å; F285-T289 HydrophobicContact CE2-CG2 3.51Å; F285-T289 HydrophobicContact CZ-CG2 4.04Å; F285-T289 WeakPolarHBondContact O-CA 3.49Å; F285-T289 PolarHBondContact O-N 3.14Å; T289-L291 PolarHBondContact O-N 2.99Å; T289-R296 HydrophobicContact CG2-CB 4.42Å; T289-R296 PolarHBondContact O-N 3.06Å; T289-C300 HydrophobicContact CG2-CB 4.07Å
290C98.1Very high97.1Very high16 Ų1654.2 Ų54.211%0.10829%0.286CS..SBendtrans-86.359.2-177.5-164.60000111.7R244 I245 R248 F285R244-C290 PolarHBondContact NE-O 3.5Å; R244-C290 PolarHBondContact NH2-O 3.26Å; I245-C290 HydrophobicContact CD1-CB 4.33Å; I245-C290 HydrophobicContact CG1-CB 4.03Å; R248-C290 PolarHBondContact NH1-SG 2.92Å; F285-C290 HydrophobicContact CD1-CB 3.8Å; F285-C290 HydrophobicContact CE1-CB 3.41Å; F285-C290 VanDerWaalsContact CE1-CB 3.41Å; F285-C290 HydrophobicContact CZ-CB 3.9Å; F285-C290 PolarHBondContact O-N 3.37Å
291L97.7Very high97.2Very high43 Ų4357.5 Ų57.523%0.22530%0.296CS..  trans-59.6151.2-177.2-58178.6000111.9R248 Q287 T289 V293 R296R248-L291 PolarHBondContact NH1-O 2.88Å; R248-L291 PolarHBondContact NH2-O 3.44Å; Q287-L291 VanDerWaalsContact O-CD2 3.3Å; Q287-L291 WeakPolarHBondContact O-CD2 3.4Å; T289-L291 PolarHBondContact O-N 2.99Å; L291-V293 VanDerWaalsContact C-N 3.29Å; L291-V293 WeakPolarHBondContact CB-O 3.37Å; L291-V293 PolarHBondContact O-N 3.01Å; L291-R296 HydrophobicContact CD1-CG 4.45Å
292P95.9Very high97.1Very high83 Ų8356.4 Ų56.454%0.53929%0.29SS..SBendtrans-59.7-41.6177.823.3-32.9000111.9R248R248-P292 PolarHBondContact NH2-O 3.41Å
293V95.6Very high97Very high110 Ų11059.9 Ų59.967%0.66731%0.307SS*.SBendtrans-116.1134177.5-179.50000108.7L291L291-V293 VanDerWaalsContact C-N 3.29Å; L291-V293 WeakPolarHBondContact CB-O 3.37Å; L291-V293 PolarHBondContact O-N 3.01Å
294R94.6Very high96.9Very high225 Ų22563.7 Ų63.785%0.84934%0.339SS*.SBendtrans47.564.3-179-63.6178.6-172.9171.71.6112.5
295P97.2Very high96.8Very high41 Ų4166 Ų6627%0.26635%0.351SS..  trans-56.9148.5174.326.9-34.9000110.8C297P295-C297 PolarHBondContact O-N 3.24Å
296R96.9Very high96.6Very high156 Ų15666.6 Ų66.659%0.58936%0.356SS*.  trans-80.356.1-177.8-62.1-178.2176.2170.9-7.1111.5Q288 T289 L291 Q298 A299 C300Q288-R296 WeakPolarHBondContact O-CD 3.35Å; Q288-R296 PolarHBondContact O-NH1 3.31Å; T289-R296 HydrophobicContact CG2-CB 4.42Å; T289-R296 PolarHBondContact O-N 3.06Å; L291-R296 HydrophobicContact CD1-CG 4.45Å; R296-Q298 VanDerWaalsContact C-N 3.3Å; R296-Q298 PolarHBondContact O-N 3.33Å; R296-A299 PolarHBondContact O-N 3.23Å; R296-C300 PolarHBondContact O-N 3.48Å
297C96.9Very high96.4Very high20 Ų2068 Ų6814%0.13537%0.365CS..G310 helixtrans-59.6-36.8-172.7-66.30000113.3P295 A299 C300 A309 L312P295-C297 PolarHBondContact O-N 3.24Å; C297-A299 PolarHBondContact O-N 2.78Å; C297-C300 VanDerWaalsContact O-CB 3.27Å; C297-C300 WeakPolarHBondContact O-CB 3.27Å; C297-C300 PolarHBondContact O-N 3.06Å; C297-A309 HydrophobicContact CB-CB 4.25Å; C297-L312 HydrophobicContact CB-CD1 3.85Å
298Q94.6Very high96.2Very high166 Ų16668.2 Ų68.278%0.77638%0.375SS*.G310 helixtrans-62.6-29-179.5-67.1174.5-6.400113.6R296R296-Q298 VanDerWaalsContact C-N 3.3Å; R296-Q298 PolarHBondContact O-N 3.33Å
299A94.4Very high95.8Very high81 Ų8166.5 Ų66.567%0.66937%0.368SS*.G310 helixtrans-100.45.1177.500000112.5R296 C297R296-A299 PolarHBondContact O-N 3.23Å; C297-A299 PolarHBondContact O-N 2.78Å
300C97.7Very high94.9Very high17 Ų1772 Ų7212%0.11539%0.392CS..  trans-88.3124.7-176.3-175.30000109.9T289 R296 C297 N302 Q303T289-C300 HydrophobicContact CG2-CB 4.07Å; R296-C300 PolarHBondContact O-N 3.48Å; C297-C300 VanDerWaalsContact O-CB 3.27Å; C297-C300 WeakPolarHBondContact O-CB 3.27Å; C297-C300 PolarHBondContact O-N 3.06Å; C300-N302 PolarHBondContact O-N 2.91Å; C300-Q303 WeakPolarHBondContact O-CB 3.45Å; C300-Q303 PolarHBondContact O-N 3.11Å
301L97.9Very high93.4Very high98 Ų9875.5 Ų75.551%0.51343%0.43SS..THydrogen-bonded Turntrans-60.6-17.5176.1-62.2-176.3000113.3N98 A101 M102N98-L301 HydrophobicContact CB-CB 3.81Å; N98-L301 PolarHBondContact ND2-O 3.4Å; N98-L301 VanDerWaalsContact ND2-O 3.16Å; A101-L301 HydrophobicContact CB-CD1 4.01Å; M102-L301 HydrophobicContact CE-CB 4.12Å; M102-L301 HydrophobicContact CG-CB 4.32Å; M102-L301 HydrophobicContact CG-CD1 3.8Å; M102-L301 HydrophobicContact CG-CG 3.78Å; M102-L301 HydrophobicContact SD-CB 4.12Å; M102-L301 HydrophobicContact SD-CG 4.06Å; M102-L301 PolarHBondContact SD-N 3.31Å; M102-L301 VanDerWaalsContact SD-N 3.43Å
302N97.5Very high91.8Very high1 Ų180.6 Ų80.61%0.00546%0.457CS..THydrogen-bonded Turntrans-90.37.1174.5-73.6-30.7000114.4Q95 N98 I99 C300 A304 L305 C306Q95-N302 VanDerWaalsContact CA-OD1 3.3Å; Q95-N302 WeakPolarHBondContact CA-OD1 2.99Å; Q95-N302 PolarHBondContact O-ND2 3.21Å; N98-N302 WeakPolarHBondContact CB-OD1 3.49Å; N98-N302 PolarHBondContact ND2-OD1 2.96Å; I99-N302 WeakPolarHBondContact CG1-ND2 3.39Å; C300-N302 PolarHBondContact O-N 2.91Å; N302-A304 VanDerWaalsContact C-N 3.32Å; N302-A304 PolarHBondContact O-N 3.44Å; N302-L305 CarbonylContact O-C 3.56Å; N302-L305 PolarHBondContact O-N 2.94Å; N302-C306 HydrophobicContact CB-CB 4.39Å; N302-C306 WeakPolarHBondContact O-CA 3.49Å; N302-C306 WeakPolarHBondContact O-CB 3.48Å; N302-C306 PolarHBondContact O-N 2.77Å
303Q96.5Very high91.5Very high73 Ų7380.5 Ų80.534%0.34145%0.453SS..THydrogen-bonded Turntrans-51.6-49.3-175.4-172.3-175.520.400112.7C300 L305 A309C300-Q303 WeakPolarHBondContact O-CB 3.45Å; C300-Q303 PolarHBondContact O-N 3.11Å; Q303-L305 VanDerWaalsContact C-N 3.34Å; Q303-L305 PolarHBondContact O-N 2.97Å; Q303-A309 HydrophobicContact CG-CB 4.42Å
304A95Very high91.3Very high89 Ų8978.9 Ų78.974%0.73644%0.442SS*.THydrogen-bonded Turntrans-70.7-28.4-179.500000113.6N302N302-A304 VanDerWaalsContact C-N 3.32Å; N302-A304 PolarHBondContact O-N 3.44Å
305L95.6Very high91.2Very high48 Ų4870.8 Ų70.825%0.25142%0.419SS..THydrogen-bonded Turntrans-94.2-14.6-176-56.8178000113.3D91 Q94 Q95 N302 Q303 P307D91-L305 HydrophobicContact CB-CD2 4.39Å; Q94-L305 HydrophobicContact CB-CD1 3.98Å; Q94-L305 HydrophobicContact CG-CD1 3.54Å; Q95-L305 HydrophobicContact CG-CB 4.08Å; Q95-L305 HydrophobicContact CG-CD1 4.35Å; Q95-L305 PolarHBondContact NE2-O 3.39Å; Q95-L305 VanDerWaalsContact NE2-O 3.08Å; N302-L305 CarbonylContact O-C 3.56Å; N302-L305 PolarHBondContact O-N 2.94Å; Q303-L305 VanDerWaalsContact C-N 3.34Å; Q303-L305 PolarHBondContact O-N 2.97Å; L305-P307 WeakPolarHBondContact O-CD 3.03Å
306C96.3Very high90.8Very high16 Ų1672.5 Ų72.511%0.10843%0.428CS..  trans-89.5116.6-171.41790000110.2L249 N302 A308 A309 Q310L249-C306 HydrophobicContact CD2-CB 4.21Å; N302-C306 HydrophobicContact CB-CB 4.39Å; N302-C306 WeakPolarHBondContact O-CA 3.49Å; N302-C306 WeakPolarHBondContact O-CB 3.48Å; N302-C306 PolarHBondContact O-N 2.77Å; C306-A308 PolarHBondContact O-N 3.35Å; C306-A308 VanDerWaalsContact O-N 3.11Å; C306-A309 HydrophobicContact CB-CB 3.95Å; C306-A309 PolarHBondContact O-N 3.4Å; C306-Q310 PolarHBondContact O-N 3.27Å
307P93.1Very high90.4Very high32 Ų3267.3 Ų67.321%0.20842%0.418CS..THydrogen-bonded Turntrans-60.4-26.5179.4-25.236.3000113.6R250 L305 A309R250-P307 HydrophobicContact CB-CG 4.34Å; R250-P307 HydrophobicContact CG-CB 4.03Å; R250-P307 HydrophobicContact CG-CG 3.87Å; L305-P307 WeakPolarHBondContact O-CD 3.03Å; P307-A309 VanDerWaalsContact C-N 3.33Å
308A92.9Very high90Very high55 Ų5570.5 Ų70.546%0.45544%0.437SS..THydrogen-bonded Turntrans-82.3-6.5177.400000114.3R248 C306R248-A308 HydrophobicContact CB-CB 3.89Å; R248-A308 HydrophobicContact CG-CB 4.02Å; C306-A308 PolarHBondContact O-N 3.35Å; C306-A308 VanDerWaalsContact O-N 3.11Å
309A90.3Very high89.7Confident5 Ų563.6 Ų63.64%0.04141%0.413CS..THydrogen-bonded Turntrans-107.5-6177.500000113.4C297 Q303 C306 P307 G311 L312C297-A309 HydrophobicContact CB-CB 4.25Å; Q303-A309 HydrophobicContact CG-CB 4.42Å; C306-A309 HydrophobicContact CB-CB 3.95Å; C306-A309 PolarHBondContact O-N 3.4Å; P307-A309 VanDerWaalsContact C-N 3.33Å; A309-G311 PolarHBondContact O-N 3.32Å; A309-L312 HydrophobicContact CB-CD1 4.42Å; A309-L312 PolarHBondContact O-N 2.88Å
310Q77.4Confident89.3Confident138 Ų13862.3 Ų62.365%0.64539%0.393SS*.THydrogen-bonded Turntrans-65122.9177.1-69.1176.9-10.800110.1C306C306-Q310 PolarHBondContact O-N 3.27Å
311G66.4Low88.6Confident88 Ų8866.1 Ų66.191%0.90742%0.416SS*.THydrogen-bonded Turntrans90.111.3179.900000115.9A309A309-G311 PolarHBondContact O-N 3.32Å
312L64.1Low87.7Confident150 Ų15063.2 Ų63.279%0.78541%0.408SS*.  trans-90.80168.9-73.4174.1000113C297 A309C297-L312 HydrophobicContact CB-CD1 3.85Å; A309-L312 HydrophobicContact CB-CD1 4.42Å; A309-L312 PolarHBondContact O-N 2.88Å

Retrieved 312 of 312 residues in 93.9 ms (Link to these results)