A0A087XMN4_POEFO Loading...

Nuclear receptor subfamily 2, group F, member 2

AlphaFold DB , UniProt , Accession A0A087XMN4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 405 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M31.1Very low30.1Very low243 Ų243157.8 Ų157.8100%1.19786%0.86SS**  0152.90-81.6163.9153.900108.1
2A28.6Very low30Very low97 Ų97157.6 Ų157.680%0.80286%0.857SS**  trans11.6101.6174.900000118
3M26.6Very low30.1Very low183 Ų183155.9 Ų155.990%0.90186%0.855SS**  trans-76.8135.1147.9-65.6-173.4-164.300107.9A5M3-A5 PolarHBondContact O-N 2.99Å
4V34Very low30.1Very low105 Ų105151.2 Ų151.264%0.63685%0.847SS**  trans-80117.7171.3177.40000108.6W6V4-W6 HydrophobicContact CG1-CD2 4.47Å; V4-W6 HydrophobicContact CG1-CZ2 4.34Å; V4-W6 VanDerWaalsContact O-CD1 3.28Å; V4-W6 PolarHBondContact O-N 3.49Å
5A31.8Very low29.9Very low97 Ų97151.5 Ų151.580%0.80285%0.845SS**  trans-83.2103178.400000110.4M3 R7M3-A5 PolarHBondContact O-N 2.99Å; A5-R7 PolarHBondContact O-N 2.91Å
6W34.8Very low29.9Very low232 Ų232148.8 Ų148.888%0.87983%0.834SS**  trans-77.9106.6177.6-61.891.5000110.9V4V4-W6 HydrophobicContact CG1-CD2 4.47Å; V4-W6 HydrophobicContact CG1-CZ2 4.34Å; V4-W6 VanDerWaalsContact O-CD1 3.28Å; V4-W6 PolarHBondContact O-N 3.49Å
7R29.7Very low29.8Very low240 Ų240151.4 Ų151.491%0.90684%0.838SS**PPolyproline II helixtrans-91.6127.5157.6-79-175.7175.4-99.71.1108.3A5A5-R7 PolarHBondContact O-N 2.91Å
8G26.9Very low29.7Very low75 Ų75147.6 Ų147.677%0.77384%0.839SS**PPolyproline II helixtrans-70.7140.8165.800000110.4
9S28.1Very low29.6Very low124 Ų124144.7 Ų144.787%0.86784%0.836SS**PPolyproline II helixtrans-69.5142.2161.3-61.10000109.3
10Q28.4Very low29.5Very low186 Ų186146 Ų14687%0.86984%0.838SS**  trans-136115.2171.7-172164.62.800106.7
11D31.4Very low29.4Very low154 Ų154143.8 Ų143.882%0.82483%0.832SS**  trans-71.1138.5177.9-58.2-70.8000110.2
12D28.9Very low29.3Very low155 Ų155138.1 Ų138.183%0.82982%0.816SS**  trans-155.3168.6157.2-130.9-40.1000112.1
13V31.5Very low29.3Very low136 Ų136142.3 Ų142.382%0.82482%0.819SS**  trans-92.5158.6-153.2-179.30000114.9
14A28.9Very low29.4Very low90 Ų90140.8 Ų140.874%0.74482%0.82SS**  trans-69160.7-174.300000116.3
15D27.6Very low29.3Very low155 Ų155145.4 Ų145.483%0.82984%0.835SS**  trans-153.9-169.9133.6-141.4-36.6000112.2
16T29.5Very low29.1Very low109 Ų109144.8 Ų144.867%0.66984%0.838SS**  trans-133.5159.6-140.5-35.10000115.6
17Q29.3Very low28.7Very low192 Ų192137.2 Ų137.290%0.89783%0.832SS**  trans82.5146.6161.9-50-172.112.900119.7
18G26.9Very low28.6Very low83 Ų83133.9 Ų133.986%0.85683%0.831SS**  trans137.2127172.400000112.9
19A27.6Very low28.6Very low94 Ų94135.5 Ų135.578%0.77783%0.83SS**  trans-141.4148.1-175.100000112.9
20L27.6Very low28.8Very low169 Ų169137 Ų13789%0.88583%0.828SS**  -179.2149.3125.7-97161000114.1
21S27.7Very low28.9Very low100 Ų100134 Ų13470%0.69982%0.824SS**  trans-51.5151.1-177.952.80000119.6
22S29.5Very low28.9Very low125 Ų125132.5 Ų132.587%0.87482%0.821SS**  -165.5171.1119.742.50000111.9
23Q29Very low29.3Very low185 Ų185130.5 Ų130.586%0.86482%0.817SS**  trans-106.1154.4-163.5-59.9168.5-2000113.8
24T29.5Very low29.2Very low150 Ų150132.7 Ų132.792%0.9282%0.818SS**  -163.1159.8129.34.90000111.3
25Q30.7Very low29.6Very low203 Ų203134.4 Ų134.495%0.94982%0.822SS**  trans-103.6154.2-172.7-66.2174.6-20.700112.6
26G28.6Very low29.6Very low84 Ų84130.8 Ų130.887%0.86682%0.821SS**  trans-178.666.5175.100000113.1
27G26.1Very low29.5Very low73 Ų73134.7 Ų134.775%0.75383%0.831SS**  trans-99.3139.9-177.900000113.8
28L27Very low29.4Very low170 Ų170134.1 Ų134.189%0.8983%0.834SS**  trans-143.3149.5171.5-82.1177.4000112.7
29S26.6Very low29.5Very low108 Ų108137.1 Ų137.176%0.75583%0.83SS**  trans55.8105156.757.60000120.7
30L31.9Very low29.6Very low156 Ų156141.2 Ų141.282%0.81784%0.838SS**  -148.6144.4110.8-141.174.6000108.7
31P30.5Very low29.6Very low122 Ų122139.6 Ų139.679%0.79284%0.835SS**  -150.7159.498.939.3-22.4000116.4
32T31.5Very low29.6Very low124 Ų124139.3 Ų139.376%0.76184%0.839SS**  trans-99175.2155.135.50000109.3
33P38.1Very low29.6Very low113 Ų113139.4 Ų139.473%0.73484%0.84SS**  cis-138.4-169.911.336.1-13.4000116.2
34Q30.2Very low29.6Very low182 Ų182139.3 Ų139.385%0.8584%0.839SS**  trans123.6148.8148.5-67.3-145.8-22.900117.5
35P36.9Very low29.6Very low126 Ų126140.6 Ų140.682%0.81884%0.839SS**  trans-103.5154.9-160.439.2-33.6000115.2
36G27.4Very low29.5Very low79 Ų79135.1 Ų135.181%0.81483%0.828SS**  trans-116.5145.7173.900000113.2
37Q27.3Very low30.2Very low190 Ų190136.9 Ų136.989%0.88882%0.824SS**  trans-79.9155.5-177.1-56.2157.1-52.100112.7
38L27.6Very low30.8Very low180 Ų180139 Ų13994%0.94283%0.825SS**  trans-140.1130.8145.4-82.2-177.2000111.1
39N27.5Very low31Very low147 Ų147137.2 Ų137.279%0.78682%0.821SS**  trans-89.6145.7171.4-91.3-25000110.5
40L29.9Very low31.8Very low179 Ų179137.1 Ų137.194%0.93782%0.818SS**  trans-138136.4148.2-79.6-179.2000109.9
41T29.1Very low31.6Very low135 Ų135138.3 Ų138.383%0.82882%0.819SS**  trans-97.9156.3-171.642.60000112.6
42A27.4Very low31.7Very low94 Ų94138.7 Ų138.778%0.77782%0.82SS**  trans-86.9160.6178.600000112.8
43S28.9Very low32.3Very low127 Ų127138.5 Ų138.589%0.88882%0.821SS**  trans-153.5147.1151.7-82.10000110.9
44Q28.6Very low32Very low183 Ų183139.7 Ų139.786%0.85583%0.825SS**  trans-105.3169.5178.2-57.7169.2-4.300109.4
45I29.6Very low32Very low177 Ų177140.3 Ų140.391%0.90883%0.828SS**  trans177.6143.6141.3-95.7152.3000111.6
46A28.8Very low31.6Very low89 Ų89137.7 Ų137.774%0.73682%0.824SS**  trans-169.2174.1164.400000108.2
47P43Very low32.4Very low120 Ų120140.2 Ų140.278%0.77983%0.826SS**  cis-112.7-160.3-31.738.7-23.4000110.3
48P39.3Very low33.6Very low119 Ų119137 Ų13777%0.77382%0.822SS**  -151.6174114.538.2-21.2000116.9
49T31.4Very low33.9Very low132 Ų132136.2 Ų136.281%0.8182%0.819SS**  trans-138162.5160.555.60000107.9
50P42.4Very low34Very low105 Ų105136.8 Ų136.868%0.68282%0.821SS**  -163.5-169.991.745-24000118
51Q28.8Very low34.1Very low181 Ų181133.1 Ų133.185%0.84682%0.817SS**  trans89.1150.7149.5-78.217216.700123.6
52T31.6Very low34.2Very low131 Ų131135.8 Ų135.880%0.80482%0.82SS**  trans-144.9161.5179.950.60000110
53P44.1Very low34.2Very low120 Ų120136 Ų13678%0.77982%0.817SS**  -131.2-154117.917.16000110
54V32.7Very low34.3Very low137 Ų137136.5 Ų136.583%0.8381%0.814SS**  cis-144.8-172.210.5-161.50000108.8
55Q29.3Very low35Very low195 Ų195133.3 Ų133.391%0.91181%0.809SS**  trans-127.9160.9179.7-61.6164.7-3800112.5
56G29.1Very low35Very low71 Ų71131.7 Ų131.773%0.73281%0.808SS**  trans-177.7147.7168.700000113.1
57P43.5Very low35.3Very low132 Ų132134.7 Ų134.786%0.85781%0.811SS**  trans-127-154.4-147.250.8-34.7000113.3
58P53.3Low34.9Very low122 Ų122138.1 Ų138.179%0.79282%0.817SS**  trans-126-172.2-134.431.7-6.1000115.1
59N33.1Very low34.8Very low165 Ų165139 Ų13988%0.88282%0.82SS**  trans-157.5161.1151.6-130.8-24.5000115.7
60N30.4Very low34.9Very low158 Ų158138.3 Ų138.385%0.84582%0.821SS**  trans-105.5155.9-178.7-87.6-33.9000112.7
61A32.2Very low35Very low103 Ų103142.6 Ų142.685%0.85183%0.832SS**  trans-165.7157.1143.700000111.8
62Q30.2Very low35.3Very low190 Ų190142.6 Ų142.689%0.88883%0.832SS**  trans-99.9163.9-166.6-73151.6-50.200115.5
63S28.9Very low36Very low100 Ų100146 Ų14670%0.69984%0.839SS**  trans-30.1153.5157550000116.3
64T30.5Very low35.5Very low136 Ų136145.4 Ų145.483%0.83484%0.838SS**  -157.617565.122.90000114.1
65P42Very low36.1Very low117 Ų117148.1 Ų148.176%0.7684%0.841SS**  trans-106163.8-158.640.2-36.3000117
66T30.8Very low36.6Very low143 Ų143148.4 Ų148.488%0.87784%0.839SS**  trans-141.3138.8161.8-30.20000111.2
67N34.8Very low37.5Very low151 Ų151153 Ų15381%0.80784%0.842SS**  trans-87.6130.4170.6-98.3-19.9000110.8
68Q33.7Very low38Very low193 Ų193152.9 Ų152.990%0.90284%0.841SS**  -171.4158.6126.3-107.7163.683.600114
69T39.1Very low38.6Very low136 Ų136154.6 Ų154.683%0.83484%0.838SS**  trans-75.5136.3-177.322.90000113.8
70S33.1Very low41Very low119 Ų119152.6 Ų152.683%0.83282%0.823SS**  trans-156.8144.5146.4-83.80000110.4
71Q43.5Very low43.9Very low194 Ų194147.9 Ų147.991%0.90780%0.797SS**  trans-86.3121.1176.4-67174.5-12.200109.5
72Q34.3Very low47Very low181 Ų181148.4 Ų148.485%0.84678%0.782SS**  trans-150.8148.9165.4-110.4160.534.700111.2
73Q46.9Very low50.3Low204 Ų204139.4 Ų139.495%0.95374%0.741SS**  trans-66.2131.9-179.4-68.7166.8-27.400109.6
74S33.6Very low53.5Low107 Ų107137.9 Ų137.975%0.74873%0.727SS**  trans-136.1131.1179.435.90000110.8K76S74-K76 PolarHBondContact O-N 3.3Å
75E45.1Very low56.7Low193 Ų193131.4 Ų131.490%0.90269%0.687SS**  trans-65.5130177.1-61.6172.1113.800109.5Q77E75-Q77 PolarHBondContact O-N 2.86Å
76K41.1Very low59.4Low201 Ų201126 Ų12687%0.87465%0.652SS**  trans-75.799.2-175.2-74.9-174.7177178.20111.2S74S74-K76 PolarHBondContact O-N 3.3Å
77Q47.1Very low62.5Low169 Ų169120.8 Ų120.879%0.7963%0.627SS**  trans-47.2140.3155.5-67.9-175.4-3.300109.8E75 Q79E75-Q77 PolarHBondContact O-N 2.86Å; Q77-Q79 PolarHBondContact O-N 3.08Å
78P54Low65.4Low128 Ų128115.1 Ų115.183%0.83160%0.597SS**  trans-70.897-175.728.3-34.6000110.8H80P78-H80 PolarHBondContact O-N 3.42Å
79Q66.6Low68.4Low159 Ų159112.5 Ų112.574%0.74358%0.582SS**  trans-50128.8172.8-68.4-179.8-33.300110.2Q77 I81Q77-Q79 PolarHBondContact O-N 3.08Å; Q79-I81 VanDerWaalsContact C-N 3.29Å; Q79-I81 HydrophobicContact CB-CG1 4.26Å; Q79-I81 PolarHBondContact O-N 3.06Å
80H82.3Confident71.2Confident122 Ų122107 Ų10757%0.56555%0.549SS*.  trans-76.479.5-177.3-170.2-87.3000111.2P78P78-H80 PolarHBondContact O-N 3.42Å
81I93.1Very high74.1Confident59 Ų59103.9 Ų103.930%0.30353%0.528SS..  trans-82.4130.3-179.2-57.9171.4000110Q79 S90 F98Q79-I81 VanDerWaalsContact C-N 3.29Å; Q79-I81 HydrophobicContact CB-CG1 4.26Å; Q79-I81 PolarHBondContact O-N 3.06Å; I81-S90 WeakPolarHBondContact O-CB 3.48Å; I81-S90 PolarHBondContact O-N 2.91Å; I81-F98 HydrophobicContact CB-CD1 4.48Å; I81-F98 HydrophobicContact CD1-CD1 4.06Å; I81-F98 HydrophobicContact CD1-CE1 3.58Å; I81-F98 HydrophobicContact CD1-CE2 4.31Å; I81-F98 HydrophobicContact CD1-CZ 3.72Å; I81-F98 HydrophobicContact CG2-CB 3.63Å; I81-F98 HydrophobicContact CG2-CD1 3.74Å; I81-F98 HydrophobicContact CG2-CD2 4.06Å; I81-F98 HydrophobicContact CG2-CE1 4.35Å; I81-F98 HydrophobicContact CG2-CG 3.57Å
82E96.8Very high76.5Confident114 Ų11496 Ų9653%0.53350%0.498SS..EExtended strand (participates in β ladder)trans-89.9158.7178.8-70-170.6179.800113.1V84 G87E82-V84 PolarHBondContact O-N 3.1Å; E82-G87 VanDerWaalsContact CB-O 3.27Å; E82-G87 WeakPolarHBondContact CB-O 3.27Å; E82-G87 WeakPolarHBondContact CG-O 3.07Å
83C97.9Very high79.3Confident2 Ų294.1 Ų94.11%0.01449%0.487CS..EExtended strand (participates in β ladder)trans-75.8111.8173.3177.40000110.8V85 C86 G87 D88 T99 C100C83-V85 PolarHBondContact O-N 3.04Å; C83-C86 PolarHBondContact O-N 3.15Å; C83-G87 PolarHBondContact O-N 3.45Å; C83-D88 WeakPolarHBondContact CA-O 3.34Å; C83-D88 WeakPolarHBondContact CB-O 3.38Å; C83-D88 PolarHBondContact N-O 2.96Å; C83-T99 VanDerWaalsContact SG-CA 3.57Å; C83-C100 HydrophobicContact CB-CB 4.02Å; C83-C100 PolarHBondContact SG-N 2.86Å; C83-C100 VanDerWaalsContact SG-N 3.39Å; C83-C100 VanDerWaalsContact SG-SG 3.63Å
84V97.7Very high81.6Confident67 Ų6785.9 Ų85.941%0.40645%0.448SS..THydrogen-bonded Turntrans-57.8-15.9179.9-61.10000114.1E82 Q97 F98 T99 V146E82-V84 PolarHBondContact O-N 3.1Å; V84-Q97 HydrophobicContact CG2-CB 4.07Å; V84-F98 WeakPolarHBondContact CG2-O 3.37Å; V84-F98 PolarHBondContact N-O 3.21Å; V84-F98 VanDerWaalsContact N-O 3.14Å; V84-T99 HydrophobicContact CG2-CG2 4.46Å; V84-V146 HydrophobicContact CB-CB 4.5Å; V84-V146 HydrophobicContact CG2-CB 4Å; V84-V146 HydrophobicContact CG2-CG2 3.67Å
85V98.1Very high84.6Confident0 Ų082.6 Ų82.60%042%0.42CS..THydrogen-bonded Turntrans-83.3-34.2173.8-1750000112.7C83 T99 C103 I127 R139 K142 V146 M148C83-V85 PolarHBondContact O-N 3.04Å; V85-T99 HydrophobicContact CG2-CG2 4.06Å; V85-C103 HydrophobicContact CB-CB 4.18Å; V85-C103 HydrophobicContact CG1-CB 4.36Å; V85-C103 HydrophobicContact CG2-CB 4.35Å; V85-I127 HydrophobicContact CG1-CG2 4.16Å; V85-I127 WeakPolarHBondContact O-CG2 3.4Å; V85-R139 HydrophobicContact CG1-CG 4.43Å; V85-K142 VanDerWaalsContact O-CD 3.24Å; V85-K142 WeakPolarHBondContact O-CD 3.24Å; V85-K142 WeakPolarHBondContact O-CE 3.21Å; V85-K142 PolarHBondContact O-NZ 2.94Å; V85-V146 HydrophobicContact CG2-CG2 3.88Å; V85-M148 HydrophobicContact CG2-SD 3.73Å
86C97.3Very high86.9Confident5 Ų575.3 Ų75.33%0.03440%0.396CS..THydrogen-bonded Turntrans-15516.1-167.367.80000117.5C83 D88 I127 D128 Q129 R132C83-C86 PolarHBondContact O-N 3.15Å; C86-D88 PolarHBondContact O-N 2.85Å; C86-I127 HydrophobicContact CB-CG2 4.17Å; C86-D128 CarbonylContact O-C 3.39Å; C86-Q129 PolarHBondContact O-N 3.44Å; C86-R132 HydrophobicContact CB-CB 4.42Å; C86-R132 PolarHBondContact SG-NH1 3.31Å; C86-R132 VanDerWaalsContact SG-NH1 3.35Å
87G96.3Very high89.6Confident33 Ų3368.7 Ų68.734%0.3437%0.368SS..EExtended strand (participates in β ladder)trans77.1-45.3178.800000114.5E82 C83E82-G87 VanDerWaalsContact CB-O 3.27Å; E82-G87 WeakPolarHBondContact CB-O 3.27Å; E82-G87 WeakPolarHBondContact CG-O 3.07Å; C83-G87 PolarHBondContact O-N 3.45Å
88D96.6Very high92Very high32 Ų3263.7 Ų63.717%0.17134%0.344CS..EExtended strand (participates in β ladder)trans-38.3140.9176.3-176.224.3000114.4C83 C86 S90 C100 Q129 R132C83-D88 WeakPolarHBondContact CA-O 3.34Å; C83-D88 WeakPolarHBondContact CB-O 3.38Å; C83-D88 PolarHBondContact N-O 2.96Å; C86-D88 PolarHBondContact O-N 2.85Å; D88-S90 PolarHBondContact O-N 2.88Å; D88-C100 HydrophobicContact CB-CB 4.28Å; D88-C100 WeakPolarHBondContact OD2-CB 3.47Å; D88-C100 PolarHBondContact OD2-SG 2.88Å; D88-Q129 HydrophobicContact CB-CB 4.12Å; D88-Q129 HydrophobicContact CB-CG 3.95Å; D88-R132 IonicContact OD2-CZ 3.44Å; D88-R132 IonicContact OD2-NH1 2.77Å; D88-R132 PolarHBondContact OD2-NH1 3.05Å; D88-R132 IonicContact OD2-NH2 2.82Å; D88-R132 PolarHBondContact OD2-NH2 3.41Å
89K96.7Very high94Very high137 Ų13757.6 Ų57.660%0.59631%0.305SS*.EExtended strand (participates in β ladder)trans-52128-169.6-174.4172-177.7173.50112.9C100K89-C100 WeakPolarHBondContact O-CB 3.34Å
90S96.8Very high95.5Very high20 Ų2050.2 Ų50.214%0.1427%0.27CS..  trans-72.3142.5179.2-175.20000111.9I81 D88 G92 T99I81-S90 WeakPolarHBondContact O-CB 3.48Å; I81-S90 PolarHBondContact O-N 2.91Å; D88-S90 PolarHBondContact O-N 2.88Å; S90-G92 PolarHBondContact OG-N 2.85Å; S90-G92 PolarHBondContact OG-O 2.88Å; S90-G92 VanDerWaalsContact OG-O 3.1Å; S90-T99 WeakPolarHBondContact CA-O 3.18Å; S90-T99 PolarHBondContact OG-N 2.99Å; S90-T99 VanDerWaalsContact OG-N 3.14Å; S90-T99 PolarHBondContact OG-O 3.47Å
91S94.3Very high96.3Very high55 Ų5548.4 Ų48.439%0.38526%0.262SS..  trans-99.323.2167.656.70000112H94 T99 E101S91-H94 PolarHBondContact O-NE2 2.97Å; S91-H94 VanDerWaalsContact O-NE2 3.15Å; S91-H94 PolarHBondContact OG-NE2 3.2Å; S91-T99 PolarHBondContact N-O 3.14Å; S91-T99 PolarHBondContact OG-O 3.33Å; S91-E101 VanDerWaalsContact CB-OE1 3.32Å; S91-E101 WeakPolarHBondContact CB-OE1 3.44Å; S91-E101 PolarHBondContact OG-N 3.33Å; S91-E101 PolarHBondContact OG-OE1 2.95Å
92G92.8Very high96.5Very high27 Ų2747.1 Ų47.128%0.27826%0.263SS..SBendtrans103.1-170.5-177.500000114.6S90 H94 F98 T99S90-G92 PolarHBondContact OG-N 2.85Å; S90-G92 PolarHBondContact OG-O 2.88Å; S90-G92 VanDerWaalsContact OG-O 3.1Å; G92-H94 PolarHBondContact O-CD2 3.39Å; G92-F98 WeakPolarHBondContact O-CA 3.43Å; G92-T99 PolarHBondContact O-N 2.88Å; G92-T99 VanDerWaalsContact O-N 3.15Å
93K94.3Very high96.6Very high143 Ų14341.7 Ų41.762%0.62224%0.238SC*.EExtended strand (participates in β ladder)trans-77.7121178.7-68.6-169.7-179.9-177.20110.9Q97 F98K93-Q97 CarbonylContact C-O 3.45Å; K93-Q97 WeakPolarHBondContact CA-O 3.2Å; K93-F98 HydrophobicContact CD-CE1 4.48Å; K93-F98 HydrophobicContact CD-CE2 4.3Å; K93-F98 HydrophobicContact CD-CZ 4.16Å; K93-F98 HydrophobicContact CG-CD1 3.73Å; K93-F98 HydrophobicContact CG-CD2 4.14Å; K93-F98 HydrophobicContact CG-CE1 3.56Å; K93-F98 HydrophobicContact CG-CE2 3.99Å; K93-F98 HydrophobicContact CG-CG 4.03Å; K93-F98 HydrophobicContact CG-CZ 3.7Å
94H95.8Very high96.5Very high30 Ų3043.7 Ų43.714%0.13925%0.246CC..EExtended strand (participates in β ladder)trans-126.7128.5172.9-55.9-70.2000108.9S91 G92 G96 Q97 E101 K104S91-H94 PolarHBondContact O-NE2 2.97Å; S91-H94 VanDerWaalsContact O-NE2 3.15Å; S91-H94 PolarHBondContact OG-NE2 3.2Å; G92-H94 PolarHBondContact O-CD2 3.39Å; H94-G96 PolarHBondContact O-N 2.7Å; H94-Q97 PolarHBondContact N-O 3.1Å; H94-Q97 PolarHBondContact O-N 3.07Å; H94-Q97 VanDerWaalsContact O-N 3.14Å; H94-Q97 VanDerWaalsContact O-O 3.05Å; H94-E101 IonicContact CE1-OE1 3.75Å; H94-E101 IonicContact NE2-OE1 3.56Å; H94-K104 HydrophobicContact CB-CB 4Å; H94-K104 HydrophobicContact CB-CD 4.33Å; H94-K104 HydrophobicContact CB-CG 3.82Å; H94-K104 VanDerWaalsContact CE1-CE 3.46Å; H94-K104 WeakPolarHBondContact CE1-CE 3.23Å; H94-K104 PolarHBondContact CE1-NZ 2.98Å; H94-K104 WeakPolarHBondContact ND1-CD 3.36Å; H94-K104 WeakPolarHBondContact ND1-CE 3.29Å
95Y96Very high96.5Very high39 Ų3941.8 Ų41.815%0.15324%0.236CC..THydrogen-bonded Turntrans54.439.7-180-46.3-60.2000113.1K104 F107 K108 M148 R149 A152 V153Y95-K104 HydrophobicContact CE2-CG 3.95Å; Y95-F107 AromaticContact CD2-CD1 3.61Å; Y95-F107 HydrophobicContact CD2-CD1 3.61Å; Y95-F107 HydrophobicContact CD2-CE1 4.26Å; Y95-F107 HydrophobicContact CE2-CD1 4.23Å; Y95-F107 AromaticContact CG-CD1 3.89Å; Y95-F107 HydrophobicContact CG-CD1 3.89Å; Y95-F107 HydrophobicContact CG-CE1 4.07Å; Y95-K108 HydrophobicContact CE2-CB 4.29Å; Y95-K108 WeakPolarHBondContact OH-CD 3.14Å; Y95-M148 HydrophobicContact CD2-CE 3.84Å; Y95-M148 WeakPolarHBondContact O-CA 3.38Å; Y95-R149 WeakPolarHBondContact O-CB 3.24Å; Y95-R149 PolarHBondContact O-N 2.91Å; Y95-A152 HydrophobicContact CD1-CB 3.92Å; Y95-A152 WeakPolarHBondContact CD1-O 3.28Å; Y95-A152 WeakPolarHBondContact CE1-O 3.49Å; Y95-V153 HydrophobicContact CD1-CB 4.4Å; Y95-V153 HydrophobicContact CD1-CG2 3.65Å; Y95-V153 HydrophobicContact CE1-CB 4.16Å; Y95-V153 HydrophobicContact CE1-CG1 4.29Å; Y95-V153 HydrophobicContact CE1-CG2 3.76Å; Y95-V153 HydrophobicContact CG-CG2 4.07Å
96G93.3Very high96.5Very high39 Ų3942.3 Ų42.340%0.40224%0.238SC..THydrogen-bonded Turntrans90.4-17.7179.900000115.8H94H94-G96 PolarHBondContact O-N 2.7Å
97Q97.4Very high96.5Very high62 Ų6242 Ų4229%0.2924%0.236SC..EExtended strand (participates in β ladder)trans-126.5150.6-170.9-65.9-62.9-12.200113.9V84 K93 H94 T99 V146 G147 M148V84-Q97 HydrophobicContact CG2-CB 4.07Å; K93-Q97 CarbonylContact C-O 3.45Å; K93-Q97 WeakPolarHBondContact CA-O 3.2Å; H94-Q97 PolarHBondContact N-O 3.1Å; H94-Q97 PolarHBondContact O-N 3.07Å; H94-Q97 VanDerWaalsContact O-N 3.14Å; H94-Q97 VanDerWaalsContact O-O 3.05Å; Q97-T99 HydrophobicContact CB-CG2 4.36Å; Q97-T99 PolarHBondContact O-N 3.38Å; Q97-V146 VanDerWaalsContact CG-O 3.26Å; Q97-V146 WeakPolarHBondContact CG-O 3.47Å; Q97-V146 PolarHBondContact NE2-O 2.84Å; Q97-G147 WeakPolarHBondContact CG-O 3.2Å; Q97-M148 HydrophobicContact CB-CG 4.17Å; Q97-M148 HydrophobicContact CG-CG 4.3Å
98F97.1Very high96.5Very high65 Ų6543.7 Ų43.729%0.28523%0.234SC..EExtended strand (participates in β ladder)trans-70.2113.1174.2-73.2-75.4000110.7I81 V84 G92 K93I81-F98 HydrophobicContact CB-CD1 4.48Å; I81-F98 HydrophobicContact CD1-CD1 4.06Å; I81-F98 HydrophobicContact CD1-CE1 3.58Å; I81-F98 HydrophobicContact CD1-CE2 4.31Å; I81-F98 HydrophobicContact CD1-CZ 3.72Å; I81-F98 HydrophobicContact CG2-CB 3.63Å; I81-F98 HydrophobicContact CG2-CD1 3.74Å; I81-F98 HydrophobicContact CG2-CD2 4.06Å; I81-F98 HydrophobicContact CG2-CE1 4.35Å; I81-F98 HydrophobicContact CG2-CG 3.57Å; V84-F98 WeakPolarHBondContact CG2-O 3.37Å; V84-F98 PolarHBondContact N-O 3.21Å; V84-F98 VanDerWaalsContact N-O 3.14Å; G92-F98 WeakPolarHBondContact O-CA 3.43Å; K93-F98 HydrophobicContact CD-CE1 4.48Å; K93-F98 HydrophobicContact CD-CE2 4.3Å; K93-F98 HydrophobicContact CD-CZ 4.16Å; K93-F98 HydrophobicContact CG-CD1 3.73Å; K93-F98 HydrophobicContact CG-CD2 4.14Å; K93-F98 HydrophobicContact CG-CE1 3.56Å; K93-F98 HydrophobicContact CG-CE2 3.99Å; K93-F98 HydrophobicContact CG-CG 4.03Å; K93-F98 HydrophobicContact CG-CZ 3.7Å
99T97.8Very high96.4Very high0 Ų048.8 Ų48.80%025%0.251CS..  trans-140.1164.6-178.5630000111.9C83 V84 V85 S90 S91 G92 Q97 M148C83-T99 VanDerWaalsContact SG-CA 3.57Å; V84-T99 HydrophobicContact CG2-CG2 4.46Å; V85-T99 HydrophobicContact CG2-CG2 4.06Å; S90-T99 WeakPolarHBondContact CA-O 3.18Å; S90-T99 PolarHBondContact OG-N 2.99Å; S90-T99 VanDerWaalsContact OG-N 3.14Å; S90-T99 PolarHBondContact OG-O 3.47Å; S91-T99 PolarHBondContact N-O 3.14Å; S91-T99 PolarHBondContact OG-O 3.33Å; G92-T99 PolarHBondContact O-N 2.88Å; G92-T99 VanDerWaalsContact O-N 3.15Å; Q97-T99 HydrophobicContact CB-CG2 4.36Å; Q97-T99 PolarHBondContact O-N 3.38Å; T99-M148 HydrophobicContact CG2-CE 3.9Å; T99-M148 HydrophobicContact CG2-CG 4.5Å; T99-M148 HydrophobicContact CG2-SD 3.89Å
100C98.1Very high96.4Very high3 Ų342.4 Ų42.42%0.0222%0.224CC..  trans-85.2159.2169.565.30000111.2C83 D88 K89 G102 C103 K104 R132C83-C100 HydrophobicContact CB-CB 4.02Å; C83-C100 PolarHBondContact SG-N 2.86Å; C83-C100 VanDerWaalsContact SG-N 3.39Å; C83-C100 VanDerWaalsContact SG-SG 3.63Å; D88-C100 HydrophobicContact CB-CB 4.28Å; D88-C100 WeakPolarHBondContact OD2-CB 3.47Å; D88-C100 PolarHBondContact OD2-SG 2.88Å; K89-C100 WeakPolarHBondContact O-CB 3.34Å; C100-G102 PolarHBondContact O-N 2.92Å; C100-G102 VanDerWaalsContact O-N 3.07Å; C100-C103 PolarHBondContact O-N 3.24Å; C100-K104 PolarHBondContact O-N 3.15Å; C100-R132 PolarHBondContact SG-NH1 3.15Å
101E97.5Very high96.2Very high85 Ų8543.2 Ų43.240%0.39723%0.228SC..Hα-helixtrans-53.1-32.9179.5-71.6-57.3117.100113.6S91 H94 K104 S105S91-E101 VanDerWaalsContact CB-OE1 3.32Å; S91-E101 WeakPolarHBondContact CB-OE1 3.44Å; S91-E101 PolarHBondContact OG-N 3.33Å; S91-E101 PolarHBondContact OG-OE1 2.95Å; H94-E101 IonicContact CE1-OE1 3.75Å; H94-E101 IonicContact NE2-OE1 3.56Å; E101-K104 VanDerWaalsContact OE1-CD 3.25Å; E101-K104 WeakPolarHBondContact OE1-CD 3.45Å; E101-K104 IonicContact OE1-NZ 2.68Å; E101-K104 PolarHBondContact OE1-NZ 3.14Å; E101-K104 VanDerWaalsContact OE2-CD 3.24Å; E101-K104 WeakPolarHBondContact OE2-CD 3.26Å; E101-K104 WeakPolarHBondContact OE2-CE 3.39Å; E101-K104 IonicContact OE2-NZ 2.7Å; E101-K104 PolarHBondContact OE2-NZ 2.9Å; E101-S105 WeakPolarHBondContact O-CB 3.43Å; E101-S105 PolarHBondContact O-N 3.36Å; E101-S105 PolarHBondContact O-OG 2.85Å
102G97.6Very high95.9Very high31 Ų3146.1 Ų46.132%0.3223%0.23SC..Hα-helixtrans-65.1-42.6177.400000113.4C100 F106 R139C100-G102 PolarHBondContact O-N 2.92Å; C100-G102 VanDerWaalsContact O-N 3.07Å; G102-F106 VanDerWaalsContact O-CB 3.24Å; G102-F106 WeakPolarHBondContact O-CB 3.4Å; G102-F106 PolarHBondContact O-N 2.99Å; G102-R139 PolarHBondContact O-NH2 3.29Å
103C98.3Very high95.6Very high0 Ų054 Ų540%025%0.251CS..Hα-helixtrans-80.3-39.2179-740000112.3V85 C100 S105 F106 F107 R139V85-C103 HydrophobicContact CB-CB 4.18Å; V85-C103 HydrophobicContact CG1-CB 4.36Å; V85-C103 HydrophobicContact CG2-CB 4.35Å; C100-C103 PolarHBondContact O-N 3.24Å; C103-S105 PolarHBondContact O-N 2.82Å; C103-F106 PolarHBondContact O-N 3.23Å; C103-F107 VanDerWaalsContact O-CB 3.28Å; C103-F107 WeakPolarHBondContact O-CB 2.87Å; C103-F107 PolarHBondContact O-N 3.14Å; C103-R139 PolarHBondContact SG-NH2 3.39Å; C103-R139 VanDerWaalsContact SG-NH2 3.39Å
104K97.7Very high95.2Very high45 Ų4553.8 Ų53.820%0.19626%0.257CS..Hα-helixtrans-49.6-54.1165.4170.3-161-170.6-178.80111.7H94 Y95 C100 E101 F107 K108H94-K104 HydrophobicContact CB-CB 4Å; H94-K104 HydrophobicContact CB-CD 4.33Å; H94-K104 HydrophobicContact CB-CG 3.82Å; H94-K104 VanDerWaalsContact CE1-CE 3.46Å; H94-K104 WeakPolarHBondContact CE1-CE 3.23Å; H94-K104 PolarHBondContact CE1-NZ 2.98Å; H94-K104 WeakPolarHBondContact ND1-CD 3.36Å; H94-K104 WeakPolarHBondContact ND1-CE 3.29Å; Y95-K104 HydrophobicContact CE2-CG 3.95Å; C100-K104 PolarHBondContact O-N 3.15Å; E101-K104 VanDerWaalsContact OE1-CD 3.25Å; E101-K104 WeakPolarHBondContact OE1-CD 3.45Å; E101-K104 IonicContact OE1-NZ 2.68Å; E101-K104 PolarHBondContact OE1-NZ 3.14Å; E101-K104 VanDerWaalsContact OE2-CD 3.24Å; E101-K104 WeakPolarHBondContact OE2-CD 3.26Å; E101-K104 WeakPolarHBondContact OE2-CE 3.39Å; E101-K104 IonicContact OE2-NZ 2.7Å; E101-K104 PolarHBondContact OE2-NZ 2.9Å; K104-F107 PolarHBondContact O-N 2.93Å; K104-K108 WeakPolarHBondContact O-CB 3.3Å; K104-K108 PolarHBondContact O-N 2.59Å
105S96.9Very high95Very high27 Ų2755.3 Ų55.319%0.18927%0.266CS..Hα-helixtrans-72.9-33.4-175.5-65.10000113.3E101 C103 R109E101-S105 WeakPolarHBondContact O-CB 3.43Å; E101-S105 PolarHBondContact O-N 3.36Å; E101-S105 PolarHBondContact O-OG 2.85Å; C103-S105 PolarHBondContact O-N 2.82Å; S105-R109 WeakPolarHBondContact O-CG 3.49Å; S105-R109 PolarHBondContact O-N 2.68Å
106F98.3Very high94.8Very high10 Ų1059.7 Ų59.74%0.04430%0.297CS..Hα-helixtrans-60-56.3169.2171.6-96.9000110.7G102 C103 K108 R109 S110 Y117 Q136 R139 L140G102-F106 VanDerWaalsContact O-CB 3.24Å; G102-F106 WeakPolarHBondContact O-CB 3.4Å; G102-F106 PolarHBondContact O-N 2.99Å; C103-F106 PolarHBondContact O-N 3.23Å; F106-K108 VanDerWaalsContact C-N 3.35Å; F106-K108 PolarHBondContact O-N 2.7Å; F106-R109 PolarHBondContact O-N 2.92Å; F106-R109 VanDerWaalsContact O-N 3.07Å; F106-S110 PolarHBondContact O-N 3.42Å; F106-S110 PolarHBondContact O-OG 3.43Å; F106-S110 VanDerWaalsContact O-OG 3.06Å; F106-Y117 AromaticContact CE2-CE2 3.96Å; F106-Y117 HydrophobicContact CE2-CE2 3.96Å; F106-Y117 HydrophobicContact CZ-CD2 4.35Å; F106-Y117 AromaticContact CZ-CE2 3.63Å; F106-Y117 HydrophobicContact CZ-CE2 3.63Å; F106-Q136 HydrophobicContact CE2-CB 4.14Å; F106-Q136 HydrophobicContact CE2-CG 4.19Å; F106-Q136 HydrophobicContact CZ-CB 4.28Å; F106-Q136 WeakPolarHBondContact CZ-O 3.39Å; F106-R139 HydrophobicContact CD1-CG 3.98Å; F106-R139 HydrophobicContact CE1-CB 3.95Å; F106-R139 HydrophobicContact CE1-CG 3.79Å; F106-R139 HydrophobicContact CZ-CB 4.06Å; F106-R139 HydrophobicContact CZ-CG 4.26Å; F106-L140 HydrophobicContact CE1-CB 3.88Å; F106-L140 HydrophobicContact CE1-CD1 4.2Å; F106-L140 HydrophobicContact CZ-CB 4.05Å
107F97.8Very high94.9Very high0 Ų059.6 Ų59.60%029%0.285CS..Hα-helixtrans-58.2-44.8-178.9-171.2-101.9000112.1Y95 C103 K104 R109 S110 V111 L140 C143 L144 M148 R149 R150 V153Y95-F107 AromaticContact CD2-CD1 3.61Å; Y95-F107 HydrophobicContact CD2-CD1 3.61Å; Y95-F107 HydrophobicContact CD2-CE1 4.26Å; Y95-F107 HydrophobicContact CE2-CD1 4.23Å; Y95-F107 AromaticContact CG-CD1 3.89Å; Y95-F107 HydrophobicContact CG-CD1 3.89Å; Y95-F107 HydrophobicContact CG-CE1 4.07Å; C103-F107 VanDerWaalsContact O-CB 3.28Å; C103-F107 WeakPolarHBondContact O-CB 2.87Å; C103-F107 PolarHBondContact O-N 3.14Å; K104-F107 PolarHBondContact O-N 2.93Å; F107-R109 VanDerWaalsContact C-N 3.31Å; F107-R109 PolarHBondContact O-N 3.4Å; F107-S110 PolarHBondContact O-N 3.44Å; F107-V111 HydrophobicContact CD1-CG2 4.23Å; F107-V111 HydrophobicContact CD2-CG2 4.34Å; F107-V111 HydrophobicContact CE1-CG2 3.94Å; F107-V111 HydrophobicContact CE2-CG2 4.05Å; F107-V111 HydrophobicContact CG-CG2 4.43Å; F107-V111 HydrophobicContact CZ-CG2 3.85Å; F107-V111 WeakPolarHBondContact O-CG2 3.2Å; F107-V111 PolarHBondContact O-N 3.37Å; F107-L140 HydrophobicContact CD2-CD1 3.93Å; F107-L140 HydrophobicContact CE2-CD1 4.25Å; F107-C143 HydrophobicContact CD2-CB 3.57Å; F107-C143 HydrophobicContact CE2-CB 3.97Å; F107-L144 HydrophobicContact CE2-CD2 3.81Å; F107-L144 HydrophobicContact CE2-CG 4.3Å; F107-L144 HydrophobicContact CZ-CD2 4.17Å; F107-M148 HydrophobicContact CB-CE 3.75Å; F107-M148 HydrophobicContact CB-SD 4.38Å; F107-M148 HydrophobicContact CD1-CB 4.32Å; F107-M148 HydrophobicContact CD1-CE 3.89Å; F107-M148 HydrophobicContact CD2-CB 4.15Å; F107-M148 HydrophobicContact CD2-CE 4.37Å; F107-M148 HydrophobicContact CD2-SD 4.26Å; F107-M148 HydrophobicContact CE1-CB 3.93Å; F107-M148 HydrophobicContact CE2-CB 3.75Å; F107-M148 HydrophobicContact CG-CB 4.41Å; F107-M148 HydrophobicContact CG-CE 3.76Å; F107-M148 HydrophobicContact CG-SD 4.22Å; F107-M148 HydrophobicContact CZ-CB 3.63Å; F107-M148 VanDerWaalsContact CZ-O 3.24Å; F107-M148 WeakPolarHBondContact CZ-O 3.45Å; F107-R149 WeakPolarHBondContact CE1-O 3.47Å; F107-R150 HydrophobicContact CZ-CG 3.98Å; F107-V153 HydrophobicContact CD1-CG2 3.7Å; F107-V153 HydrophobicContact CE1-CG2 3.48Å; F107-V153 VanDerWaalsContact CE1-CG2 3.48Å
108K95.6Very high94.7Very high68 Ų6862.2 Ų62.230%0.29631%0.305SS..Hα-helixtrans-53.8-44.5174.4-174.8176.469-177.50112.6Y95 K104 F106 R112 V153Y95-K108 HydrophobicContact CE2-CB 4.29Å; Y95-K108 WeakPolarHBondContact OH-CD 3.14Å; K104-K108 WeakPolarHBondContact O-CB 3.3Å; K104-K108 PolarHBondContact O-N 2.59Å; F106-K108 VanDerWaalsContact C-N 3.35Å; F106-K108 PolarHBondContact O-N 2.7Å; K108-R112 VanDerWaalsContact O-CB 3.26Å; K108-R112 WeakPolarHBondContact O-CB 3.49Å; K108-R112 VanDerWaalsContact O-CG 3.32Å; K108-R112 WeakPolarHBondContact O-CG 3.46Å; K108-R112 PolarHBondContact O-N 2.71Å; K108-R112 VanDerWaalsContact O-N 3.09Å; K108-V153 HydrophobicContact CB-CG1 4.35Å; K108-V153 HydrophobicContact CG-CG1 4.03Å
109R95.4Very high94.7Very high139 Ų13959.8 Ų59.853%0.52530%0.296SS..Hα-helixtrans-72-44.5179.1-72.2-174.7-59.4-1082.3111.9S105 F106 F107 V111 R113S105-R109 WeakPolarHBondContact O-CG 3.49Å; S105-R109 PolarHBondContact O-N 2.68Å; F106-R109 PolarHBondContact O-N 2.92Å; F106-R109 VanDerWaalsContact O-N 3.07Å; F107-R109 VanDerWaalsContact C-N 3.31Å; F107-R109 PolarHBondContact O-N 3.4Å; R109-V111 PolarHBondContact O-N 3.46Å; R109-R113 WeakPolarHBondContact O-CB 3.43Å; R109-R113 PolarHBondContact O-N 2.9Å; R109-R113 VanDerWaalsContact O-N 3.14Å
110S95.3Very high94.6Very high3 Ų372.1 Ų72.12%0.02134%0.343CS..Hα-helixtrans-61.3-44.2-179.7-53.70000111.9F106 F107 N114 L115 Y117F106-S110 PolarHBondContact O-N 3.42Å; F106-S110 PolarHBondContact O-OG 3.43Å; F106-S110 VanDerWaalsContact O-OG 3.06Å; F107-S110 PolarHBondContact O-N 3.44Å; S110-N114 WeakPolarHBondContact O-CA 3.32Å; S110-N114 PolarHBondContact O-N 3Å; S110-L115 PolarHBondContact O-N 2.88Å; S110-Y117 WeakPolarHBondContact OG-CE2 3.11Å; S110-Y117 PolarHBondContact OG-OH 2.96Å
111V93.6Very high94.4Very high36 Ų3674.9 Ų74.922%0.21837%0.366CS..Hα-helixtrans-72.8-49.4178.4178.10000111.6F107 R109 R113 N114 R150 V153F107-V111 HydrophobicContact CD1-CG2 4.23Å; F107-V111 HydrophobicContact CD2-CG2 4.34Å; F107-V111 HydrophobicContact CE1-CG2 3.94Å; F107-V111 HydrophobicContact CE2-CG2 4.05Å; F107-V111 HydrophobicContact CG-CG2 4.43Å; F107-V111 HydrophobicContact CZ-CG2 3.85Å; F107-V111 WeakPolarHBondContact O-CG2 3.2Å; F107-V111 PolarHBondContact O-N 3.37Å; R109-V111 PolarHBondContact O-N 3.46Å; V111-R113 VanDerWaalsContact C-N 3.26Å; V111-R113 PolarHBondContact O-N 3.17Å; V111-N114 PolarHBondContact O-N 3.32Å; V111-N114 VanDerWaalsContact O-N 3.07Å; V111-R150 HydrophobicContact CG1-CB 4.08Å; V111-R150 HydrophobicContact CG2-CB 4.3Å; V111-R150 HydrophobicContact CG2-CG 4.08Å; V111-V153 HydrophobicContact CB-CB 4.14Å; V111-V153 HydrophobicContact CB-CG1 4.22Å; V111-V153 HydrophobicContact CB-CG2 3.98Å; V111-V153 HydrophobicContact CG1-CB 3.84Å; V111-V153 HydrophobicContact CG1-CG1 4.32Å; V111-V153 HydrophobicContact CG1-CG2 3.99Å; V111-V153 HydrophobicContact CG2-CG2 4.16Å
112R87.4Confident94.2Very high117 Ų11776.9 Ų76.944%0.44238%0.379SS..Hα-helixtrans-62.5-27.9-177.4-77.1-174.5174.3-179.3-0.5114.7K108 V153 Q154K108-R112 VanDerWaalsContact O-CB 3.26Å; K108-R112 WeakPolarHBondContact O-CB 3.49Å; K108-R112 VanDerWaalsContact O-CG 3.32Å; K108-R112 WeakPolarHBondContact O-CG 3.46Å; K108-R112 PolarHBondContact O-N 2.71Å; K108-R112 VanDerWaalsContact O-N 3.09Å; R112-V153 HydrophobicContact CG-CG1 3.79Å; R112-Q154 VanDerWaalsContact CZ-O 3.23Å; R112-Q154 PolarHBondContact NE-O 2.87Å; R112-Q154 PolarHBondContact NH2-O 3.07Å
113R85.9Confident94.1Very high192 Ų19282 Ų8273%0.72539%0.389SS*.THydrogen-bonded Turntrans-103.910.6177.2-68.1-176.9176.5-174.6-2.4113.1R109 V111 L115R109-R113 WeakPolarHBondContact O-CB 3.43Å; R109-R113 PolarHBondContact O-N 2.9Å; R109-R113 VanDerWaalsContact O-N 3.14Å; V111-R113 VanDerWaalsContact C-N 3.26Å; V111-R113 PolarHBondContact O-N 3.17Å; R113-L115 VanDerWaalsContact C-N 3.26Å; R113-L115 HydrophobicContact CB-CD1 4.16Å; R113-L115 HydrophobicContact CB-CD2 3.78Å; R113-L115 HydrophobicContact CB-CG 3.7Å; R113-L115 PolarHBondContact O-N 3.2Å
114N86Confident93.9Very high138 Ų13887.8 Ų87.874%0.73842%0.42SS*.THydrogen-bonded Turntrans43.946.4-176.7-160.532.2000114.1S110 V111 T116S110-N114 WeakPolarHBondContact O-CA 3.32Å; S110-N114 PolarHBondContact O-N 3Å; V111-N114 PolarHBondContact O-N 3.32Å; V111-N114 VanDerWaalsContact O-N 3.07Å; N114-T116 PolarHBondContact O-N 3.41Å
115L91.4Very high93.9Very high62 Ų6287.2 Ų87.233%0.32542%0.421SS..  trans-78.4110.2-169.6-60.8178000112S110 R113 Y117S110-L115 PolarHBondContact O-N 2.88Å; R113-L115 VanDerWaalsContact C-N 3.26Å; R113-L115 HydrophobicContact CB-CD1 4.16Å; R113-L115 HydrophobicContact CB-CD2 3.78Å; R113-L115 HydrophobicContact CB-CG 3.7Å; R113-L115 PolarHBondContact O-N 3.2Å; L115-Y117 HydrophobicContact CB-CE1 4.06Å; L115-Y117 HydrophobicContact CB-CE2 4.37Å; L115-Y117 HydrophobicContact CD1-CE1 4.39Å; L115-Y117 WeakPolarHBondContact CD1-OH 3.48Å
116T91.6Very high93.8Very high132 Ų13290.4 Ų90.481%0.8144%0.441SS*.  trans-76.2131.6164.2-61.30000109.9N114N114-T116 PolarHBondContact O-N 3.41Å
117Y95.6Very high93.8Very high37 Ų3790.5 Ų90.515%0.14544%0.442CS..  trans-116.8152.6175.5-59.8-58.9000110.5F106 S110 L115 Q136 Y137 L140F106-Y117 AromaticContact CE2-CE2 3.96Å; F106-Y117 HydrophobicContact CE2-CE2 3.96Å; F106-Y117 HydrophobicContact CZ-CD2 4.35Å; F106-Y117 AromaticContact CZ-CE2 3.63Å; F106-Y117 HydrophobicContact CZ-CE2 3.63Å; S110-Y117 WeakPolarHBondContact OG-CE2 3.11Å; S110-Y117 PolarHBondContact OG-OH 2.96Å; L115-Y117 HydrophobicContact CB-CE1 4.06Å; L115-Y117 HydrophobicContact CB-CE2 4.37Å; L115-Y117 HydrophobicContact CD1-CE1 4.39Å; L115-Y117 WeakPolarHBondContact CD1-OH 3.48Å; Y117-Q136 HydrophobicContact CD1-CB 3.75Å; Y117-Q136 VanDerWaalsContact CD1-OE1 3.23Å; Y117-Q136 HydrophobicContact CD2-CB 3.83Å; Y117-Q136 HydrophobicContact CE1-CB 3.97Å; Y117-Q136 HydrophobicContact CE1-CG 4.46Å; Y117-Q136 HydrophobicContact CE2-CB 4.03Å; Y117-Q136 HydrophobicContact CG-CB 3.68Å; Y117-Y137 WeakPolarHBondContact O-CD2 3.47Å; Y117-L140 HydrophobicContact CD2-CB 4.18Å; Y117-L140 HydrophobicContact CD2-CD2 3.86Å; Y117-L140 HydrophobicContact CE2-CB 4.37Å; Y117-L140 HydrophobicContact CE2-CD2 3.95Å
118T94.6Very high93.7Very high117 Ų11792.8 Ų92.872%0.71845%0.454SS*.  trans-111.9137.3174.1-56.70000110.3
119C96.8Very high93.7Very high14 Ų1493.8 Ų93.810%0.09546%0.46CS..  trans-84.8133.3170.1-1670000109.8A121 R123 Y137C119-A121 PolarHBondContact O-N 2.78Å; C119-A121 PolarHBondContact SG-N 2.86Å; C119-A121 PolarHBondContact SG-O 3.36Å; C119-A121 VanDerWaalsContact SG-O 3.36Å; C119-R123 HydrophobicContact CB-CG 3.81Å; C119-Y137 HydrophobicContact CB-CD1 3.64Å; C119-Y137 HydrophobicContact CB-CE1 4.31Å; C119-Y137 HydrophobicContact CB-CG 4.04Å
120R95.8Very high93.6Very high259 Ų25993.9 Ų93.998%0.97747%0.466SS*.SBendtrans-88.815.4173.2-61.5-177.7178.8175.9-2.2113.1
121A93.8Very high93.5Very high61 Ų6197.6 Ų97.650%0.50448%0.483SS..SBendtrans-150.1-167.1-175.400000109.9C119 R123C119-A121 PolarHBondContact O-N 2.78Å; C119-A121 PolarHBondContact SG-N 2.86Å; C119-A121 PolarHBondContact SG-O 3.36Å; C119-A121 VanDerWaalsContact SG-O 3.36Å; A121-R123 PolarHBondContact O-N 2.69Å
122N93.8Very high93.6Very high126 Ų12697.6 Ų97.667%0.67448%0.479SS*.SBendtrans-62.617.3-174.470.73.6000117.5N124N122-N124 PolarHBondContact O-N 3.33Å; N122-N124 PolarHBondContact OD1-N 2.81Å
123R93.8Very high94Very high138 Ų13897.7 Ų97.752%0.52149%0.488SS..SBendtrans57.418.5-179-65.1-178.4-176.4-133.47.1114.6C119 A121 Y137 C138 K141C119-R123 HydrophobicContact CB-CG 3.81Å; A121-R123 PolarHBondContact O-N 2.69Å; R123-Y137 HydrophobicContact CB-CD1 4.49Å; R123-Y137 HydrophobicContact CB-CE1 3.75Å; R123-Y137 HydrophobicContact CG-CD1 4.38Å; R123-Y137 HydrophobicContact CG-CE1 3.73Å; R123-Y137 PolarHBondContact NH1-OH 2.81Å; R123-C138 VanDerWaalsContact C-SG 3.59Å; R123-K141 PolarHBondContact O-NZ 3.28Å
124N95.3Very high94.5Very high122 Ų12295.8 Ų95.865%0.65249%0.488SS*.  trans-135.731.2-177.7-159.248.1000113.4N122N122-N124 PolarHBondContact O-N 3.33Å; N122-N124 PolarHBondContact OD1-N 2.81Å
125C96.6Very high95.1Very high33 Ų3389.8 Ų89.822%0.22346%0.457CS..  trans-59.7141.2178.6-49.10000111.8C135 C138C125-C135 HydrophobicContact CB-CB 3.99Å; C125-C138 HydrophobicContact CB-CB 3.89Å; C125-C138 PolarHBondContact N-SG 2.7Å; C125-C138 VanDerWaalsContact N-SG 3.4Å
126P95.8Very high95.4Very high95 Ų9591.7 Ų91.762%0.61746%0.464SS*.  trans-62.8151.2173.528.2-35000111.3
127I97.8Very high95.7Very high12 Ų1288.1 Ų88.16%0.06244%0.436CS..  trans-136.796.4-179.3-57.4-67.4000108V85 C86 R132 C138 R139 K142V85-I127 HydrophobicContact CG1-CG2 4.16Å; V85-I127 WeakPolarHBondContact O-CG2 3.4Å; C86-I127 HydrophobicContact CB-CG2 4.17Å; I127-R132 HydrophobicContact CG2-CB 3.9Å; I127-C138 HydrophobicContact CD1-CB 4.05Å; I127-C138 HydrophobicContact CG1-CB 4.35Å; I127-R139 HydrophobicContact CD1-CB 3.92Å; I127-R139 HydrophobicContact CG2-CG 4.21Å; I127-K142 HydrophobicContact CB-CD 3.78Å; I127-K142 HydrophobicContact CG1-CD 4.25Å; I127-K142 HydrophobicContact CG2-CD 4.15Å; I127-K142 PolarHBondContact O-NZ 2.93Å
128D96.2Very high95.8Very high48 Ų4886.6 Ų86.626%0.25743%0.43SS..  trans-119.4-176.8176.162.767000111C86 H130 H131 R132C86-D128 CarbonylContact O-C 3.39Å; D128-H130 VanDerWaalsContact C-N 3.29Å; D128-H130 PolarHBondContact O-N 3.44Å; D128-H130 WeakPolarHBondContact OD1-CA 3.35Å; D128-H130 PolarHBondContact OD1-N 2.91Å; D128-H131 VanDerWaalsContact CG-ND1 3.33Å; D128-H131 IonicContact OD1-CE1 3.49Å; D128-H131 IonicContact OD1-CG 2.74Å; D128-H131 PolarHBondContact OD1-N 2.93Å; D128-H131 IonicContact OD1-ND1 3.24Å; D128-H131 PolarHBondContact OD1-ND1 3.44Å; D128-H131 VanDerWaalsContact OD1-ND1 3.15Å; D128-H131 WeakPolarHBondContact OD2-CB 3.39Å; D128-H131 IonicContact OD2-CE1 2.77Å; D128-H131 IonicContact OD2-CG 3.56Å; D128-H131 IonicContact OD2-ND1 2.78Å; D128-H131 PolarHBondContact OD2-ND1 2.95Å; D128-R132 WeakPolarHBondContact O-CB 3.46Å; D128-R132 WeakPolarHBondContact O-CD 3.31Å; D128-R132 WeakPolarHBondContact O-CG 3.31Å; D128-R132 PolarHBondContact O-N 3.38Å; D128-R132 VanDerWaalsContact O-N 3.15Å
129Q95.1Very high96Very high89 Ų8981.5 Ų81.542%0.41640%0.398SS..THydrogen-bonded Turntrans-60-32.8-176.2176.9166.6-30.600114.3C86 D88 R132C86-Q129 PolarHBondContact O-N 3.44Å; D88-Q129 HydrophobicContact CB-CB 4.12Å; D88-Q129 HydrophobicContact CB-CG 3.95Å; Q129-R132 WeakPolarHBondContact O-CD 3.24Å; Q129-R132 PolarHBondContact O-NE 2.77Å; Q129-R132 PolarHBondContact O-NH2 3.48Å
130H93.8Very high96.1Very high140 Ų14082.1 Ų82.165%0.64840%0.4SS*.THydrogen-bonded Turntrans-93.7-46.8-175.3-55.5-87.5000110.7D128D128-H130 VanDerWaalsContact C-N 3.29Å; D128-H130 PolarHBondContact O-N 3.44Å; D128-H130 WeakPolarHBondContact OD1-CA 3.35Å; D128-H130 PolarHBondContact OD1-N 2.91Å
131H92.6Very high96.2Very high82 Ų8274.2 Ų74.238%0.3837%0.373SS..G310 helixtrans-92.6-7.2-169.2-50116.4000114.7D128 N133 Q134D128-H131 VanDerWaalsContact CG-ND1 3.33Å; D128-H131 IonicContact OD1-CE1 3.49Å; D128-H131 IonicContact OD1-CG 2.74Å; D128-H131 PolarHBondContact OD1-N 2.93Å; D128-H131 IonicContact OD1-ND1 3.24Å; D128-H131 PolarHBondContact OD1-ND1 3.44Å; D128-H131 VanDerWaalsContact OD1-ND1 3.15Å; D128-H131 WeakPolarHBondContact OD2-CB 3.39Å; D128-H131 IonicContact OD2-CE1 2.77Å; D128-H131 IonicContact OD2-CG 3.56Å; D128-H131 IonicContact OD2-ND1 2.78Å; D128-H131 PolarHBondContact OD2-ND1 2.95Å; H131-N133 PolarHBondContact O-N 3.09Å; H131-Q134 HydrophobicContact CB-CG 4.37Å; H131-Q134 PolarHBondContact CD2-NE2 3.47Å; H131-Q134 VanDerWaalsContact CD2-NE2 3.34Å; H131-Q134 WeakPolarHBondContact O-CB 3.37Å; H131-Q134 WeakPolarHBondContact O-CG 3.08Å; H131-Q134 PolarHBondContact O-N 3.02Å
132R96.2Very high96.4Very high36 Ų3674.6 Ų74.614%0.13636%0.363CS..G310 helixtrans-49.7-16174.556-170.5174.6169.6-8.7116.7C86 D88 C100 I127 D128 Q129 R139C86-R132 HydrophobicContact CB-CB 4.42Å; C86-R132 PolarHBondContact SG-NH1 3.31Å; C86-R132 VanDerWaalsContact SG-NH1 3.35Å; D88-R132 IonicContact OD2-CZ 3.44Å; D88-R132 IonicContact OD2-NH1 2.77Å; D88-R132 PolarHBondContact OD2-NH1 3.05Å; D88-R132 IonicContact OD2-NH2 2.82Å; D88-R132 PolarHBondContact OD2-NH2 3.41Å; C100-R132 PolarHBondContact SG-NH1 3.15Å; I127-R132 HydrophobicContact CG2-CB 3.9Å; D128-R132 WeakPolarHBondContact O-CB 3.46Å; D128-R132 WeakPolarHBondContact O-CD 3.31Å; D128-R132 WeakPolarHBondContact O-CG 3.31Å; D128-R132 PolarHBondContact O-N 3.38Å; D128-R132 VanDerWaalsContact O-N 3.15Å; Q129-R132 WeakPolarHBondContact O-CD 3.24Å; Q129-R132 PolarHBondContact O-NE 2.77Å; Q129-R132 PolarHBondContact O-NH2 3.48Å; R132-R139 VanDerWaalsContact O-CD 3.3Å; R132-R139 WeakPolarHBondContact O-CD 3.35Å; R132-R139 PolarHBondContact O-NH1 3.44Å
133N96.1Very high96.6Very high119 Ų11968.6 Ų68.664%0.63633%0.331SS*.G310 helixtrans-88.7-19.1175.8-68.1-16.9000113.3H131 C135 R139H131-N133 PolarHBondContact O-N 3.09Å; N133-C135 PolarHBondContact O-N 3.39Å; N133-R139 PolarHBondContact OD1-NH1 3.3Å
134Q96.1Very high96.7Very high151 Ų15164.4 Ų64.471%0.70632%0.319SS*.THydrogen-bonded Turntrans-67.3-35.5-174.5-65.9178.3-1000113.6H131H131-Q134 HydrophobicContact CB-CG 4.37Å; H131-Q134 PolarHBondContact CD2-NE2 3.47Å; H131-Q134 VanDerWaalsContact CD2-NE2 3.34Å; H131-Q134 WeakPolarHBondContact O-CB 3.37Å; H131-Q134 WeakPolarHBondContact O-CG 3.08Å; H131-Q134 PolarHBondContact O-N 3.02Å
135C97.8Very high96.8Very high13 Ų1367.3 Ų67.39%0.08833%0.326CS..  trans-134.497.6178.8-166.90000112.8C125 N133 Y137 C138 R139C125-C135 HydrophobicContact CB-CB 3.99Å; N133-C135 PolarHBondContact O-N 3.39Å; C135-Y137 VanDerWaalsContact C-N 3.3Å; C135-Y137 PolarHBondContact O-N 2.87Å; C135-C138 HydrophobicContact CB-CB 4.04Å; C135-C138 PolarHBondContact O-N 2.83Å; C135-R139 PolarHBondContact O-N 2.82Å
136Q97.9Very high96.8Very high101 Ų10167.8 Ų67.847%0.47233%0.327SS..Hα-helixtrans-59.6-37.9178-63.6174.7-18.900112.5F106 Y117 R139 L140F106-Q136 HydrophobicContact CE2-CB 4.14Å; F106-Q136 HydrophobicContact CE2-CG 4.19Å; F106-Q136 HydrophobicContact CZ-CB 4.28Å; F106-Q136 WeakPolarHBondContact CZ-O 3.39Å; Y117-Q136 HydrophobicContact CD1-CB 3.75Å; Y117-Q136 VanDerWaalsContact CD1-OE1 3.23Å; Y117-Q136 HydrophobicContact CD2-CB 3.83Å; Y117-Q136 HydrophobicContact CE1-CB 3.97Å; Y117-Q136 HydrophobicContact CE1-CG 4.46Å; Y117-Q136 HydrophobicContact CE2-CB 4.03Å; Y117-Q136 HydrophobicContact CG-CB 3.68Å; Q136-R139 PolarHBondContact O-N 3.15Å; Q136-L140 WeakPolarHBondContact O-CB 3.23Å; Q136-L140 PolarHBondContact O-N 2.89Å
137Y98.3Very high96.7Very high57 Ų5764.8 Ų64.822%0.22431%0.314CS..Hα-helixtrans-60.1-53.7174.6174.7-92.8000112.1Y117 C119 R123 C135 R139 L140 K141Y117-Y137 WeakPolarHBondContact O-CD2 3.47Å; C119-Y137 HydrophobicContact CB-CD1 3.64Å; C119-Y137 HydrophobicContact CB-CE1 4.31Å; C119-Y137 HydrophobicContact CB-CG 4.04Å; R123-Y137 HydrophobicContact CB-CD1 4.49Å; R123-Y137 HydrophobicContact CB-CE1 3.75Å; R123-Y137 HydrophobicContact CG-CD1 4.38Å; R123-Y137 HydrophobicContact CG-CE1 3.73Å; R123-Y137 PolarHBondContact NH1-OH 2.81Å; C135-Y137 VanDerWaalsContact C-N 3.3Å; C135-Y137 PolarHBondContact O-N 2.87Å; Y137-R139 VanDerWaalsContact C-N 3.28Å; Y137-R139 PolarHBondContact O-N 3.15Å; Y137-L140 PolarHBondContact O-N 3.04Å; Y137-K141 HydrophobicContact CE1-CD 3.87Å; Y137-K141 VanDerWaalsContact O-CB 3.26Å; Y137-K141 WeakPolarHBondContact O-CB 3.31Å; Y137-K141 PolarHBondContact O-N 3.03Å
138C98.1Very high96.7Very high5 Ų564.5 Ų64.53%0.03431%0.313CS..Hα-helixtrans-64.8-34.3-179-66.30000111.6R123 C125 I127 C135 K142R123-C138 VanDerWaalsContact C-SG 3.59Å; C125-C138 HydrophobicContact CB-CB 3.89Å; C125-C138 PolarHBondContact N-SG 2.7Å; C125-C138 VanDerWaalsContact N-SG 3.4Å; I127-C138 HydrophobicContact CD1-CB 4.05Å; I127-C138 HydrophobicContact CG1-CB 4.35Å; C135-C138 HydrophobicContact CB-CB 4.04Å; C135-C138 PolarHBondContact O-N 2.83Å; C138-K142 WeakPolarHBondContact O-CB 3.26Å; C138-K142 PolarHBondContact O-N 3.47Å
139R98.4Very high96.5Very high11 Ų1169.1 Ų69.14%0.04233%0.326CS..Hα-helixtrans-63-49.7172.8-164.7-172.2-167.2150.2-7.7112.2V85 G102 C103 F106 I127 R132 N133 C135 Q136 Y137 K142 C143V85-R139 HydrophobicContact CG1-CG 4.43Å; G102-R139 PolarHBondContact O-NH2 3.29Å; C103-R139 PolarHBondContact SG-NH2 3.39Å; C103-R139 VanDerWaalsContact SG-NH2 3.39Å; F106-R139 HydrophobicContact CD1-CG 3.98Å; F106-R139 HydrophobicContact CE1-CB 3.95Å; F106-R139 HydrophobicContact CE1-CG 3.79Å; F106-R139 HydrophobicContact CZ-CB 4.06Å; F106-R139 HydrophobicContact CZ-CG 4.26Å; I127-R139 HydrophobicContact CD1-CB 3.92Å; I127-R139 HydrophobicContact CG2-CG 4.21Å; R132-R139 VanDerWaalsContact O-CD 3.3Å; R132-R139 WeakPolarHBondContact O-CD 3.35Å; R132-R139 PolarHBondContact O-NH1 3.44Å; N133-R139 PolarHBondContact OD1-NH1 3.3Å; C135-R139 PolarHBondContact O-N 2.82Å; Q136-R139 PolarHBondContact O-N 3.15Å; Y137-R139 VanDerWaalsContact C-N 3.28Å; Y137-R139 PolarHBondContact O-N 3.15Å; R139-K142 PolarHBondContact O-N 2.93Å; R139-C143 PolarHBondContact O-N 2.99Å; R139-C143 PolarHBondContact O-SG 3.22Å; R139-C143 VanDerWaalsContact O-SG 3.39Å
140L98.1Very high96.3Very high27 Ų2772 Ų7214%0.14133%0.333CS..Hα-helixtrans-65.8-41.7179.5-173.861.4000111.4F106 F107 Y117 Q136 Y137 K142 C143 L144F106-L140 HydrophobicContact CE1-CB 3.88Å; F106-L140 HydrophobicContact CE1-CD1 4.2Å; F106-L140 HydrophobicContact CZ-CB 4.05Å; F107-L140 HydrophobicContact CD2-CD1 3.93Å; F107-L140 HydrophobicContact CE2-CD1 4.25Å; Y117-L140 HydrophobicContact CD2-CB 4.18Å; Y117-L140 HydrophobicContact CD2-CD2 3.86Å; Y117-L140 HydrophobicContact CE2-CB 4.37Å; Y117-L140 HydrophobicContact CE2-CD2 3.95Å; Q136-L140 WeakPolarHBondContact O-CB 3.23Å; Q136-L140 PolarHBondContact O-N 2.89Å; Y137-L140 PolarHBondContact O-N 3.04Å; L140-K142 VanDerWaalsContact C-N 3.3Å; L140-K142 PolarHBondContact O-N 3.12Å; L140-C143 WeakPolarHBondContact O-CB 3.35Å; L140-C143 PolarHBondContact O-N 3.12Å; L140-L144 HydrophobicContact CG-CD1 4.28Å; L140-L144 WeakPolarHBondContact O-CG 3.35Å; L140-L144 PolarHBondContact O-N 3.26Å
141K97.8Very high95.9Very high92 Ų9271.8 Ų71.840%0.433%0.333SS..Hα-helixtrans-56-42.8171179.3178.3170.2-175.80111.4R123 Y137 K145R123-K141 PolarHBondContact O-NZ 3.28Å; Y137-K141 HydrophobicContact CE1-CD 3.87Å; Y137-K141 VanDerWaalsContact O-CB 3.26Å; Y137-K141 WeakPolarHBondContact O-CB 3.31Å; Y137-K141 PolarHBondContact O-N 3.03Å; K141-K145 VanDerWaalsContact O-CB 3.31Å; K141-K145 WeakPolarHBondContact O-CB 3.47Å; K141-K145 PolarHBondContact O-N 3.09Å
142K98.2Very high95.5Very high69 Ų6969.9 Ų69.930%0.333%0.331SS..Hα-helixtrans-69.7-44176.5-167.1175.5177.2-170.10112.4V85 I127 C138 R139 L140 L144 K145 V146V85-K142 VanDerWaalsContact O-CD 3.24Å; V85-K142 WeakPolarHBondContact O-CD 3.24Å; V85-K142 WeakPolarHBondContact O-CE 3.21Å; V85-K142 PolarHBondContact O-NZ 2.94Å; I127-K142 HydrophobicContact CB-CD 3.78Å; I127-K142 HydrophobicContact CG1-CD 4.25Å; I127-K142 HydrophobicContact CG2-CD 4.15Å; I127-K142 PolarHBondContact O-NZ 2.93Å; C138-K142 WeakPolarHBondContact O-CB 3.26Å; C138-K142 PolarHBondContact O-N 3.47Å; R139-K142 PolarHBondContact O-N 2.93Å; L140-K142 VanDerWaalsContact C-N 3.3Å; L140-K142 PolarHBondContact O-N 3.12Å; K142-L144 VanDerWaalsContact C-N 3.28Å; K142-L144 PolarHBondContact O-N 2.95Å; K142-K145 PolarHBondContact O-N 3.32Å; K142-V146 HydrophobicContact CG-CG1 4.37Å; K142-V146 WeakPolarHBondContact O-CG2 3.34Å; K142-V146 PolarHBondContact O-N 3.41Å
143C98.1Very high95Very high0 Ų068.7 Ų68.70%033%0.328CS..Hα-helixtrans-50.7-47.6172.1-74.30000112F107 R139 L140 V146 M148F107-C143 HydrophobicContact CD2-CB 3.57Å; F107-C143 HydrophobicContact CE2-CB 3.97Å; R139-C143 PolarHBondContact O-N 2.99Å; R139-C143 PolarHBondContact O-SG 3.22Å; R139-C143 VanDerWaalsContact O-SG 3.39Å; L140-C143 WeakPolarHBondContact O-CB 3.35Å; L140-C143 PolarHBondContact O-N 3.12Å; C143-V146 WeakPolarHBondContact O-CG2 3.09Å; C143-M148 HydrophobicContact CB-CB 4.4Å; C143-M148 HydrophobicContact CB-CG 4.31Å; C143-M148 HydrophobicContact CB-SD 3.59Å; C143-M148 VanDerWaalsContact CB-SD 3.59Å; C143-M148 WeakPolarHBondContact O-CB 3.41Å; C143-M148 VanDerWaalsContact O-CG 3.3Å; C143-M148 WeakPolarHBondContact O-CG 3.48Å; C143-M148 PolarHBondContact O-N 3.47Å
144L97.3Very high94.1Very high51 Ų5170.3 Ų70.327%0.26733%0.332SS..Hα-helixtrans-69.6-43178.2-65.4168.5000111.9F107 L140 K142 V146 G147 R150F107-L144 HydrophobicContact CE2-CD2 3.81Å; F107-L144 HydrophobicContact CE2-CG 4.3Å; F107-L144 HydrophobicContact CZ-CD2 4.17Å; L140-L144 HydrophobicContact CG-CD1 4.28Å; L140-L144 WeakPolarHBondContact O-CG 3.35Å; L140-L144 PolarHBondContact O-N 3.26Å; K142-L144 VanDerWaalsContact C-N 3.28Å; K142-L144 PolarHBondContact O-N 2.95Å; L144-V146 VanDerWaalsContact C-N 3.29Å; L144-V146 PolarHBondContact O-N 3.01Å; L144-G147 PolarHBondContact O-N 3.39Å; L144-R150 HydrophobicContact CD2-CG 3.65Å
145K96.7Very high92.1Very high183 Ų18371.9 Ų71.980%0.79633%0.331SS*.Hα-helixtrans-61-33.7178.4-175.1177.1178.4-177.60113.1K141 K142 G147K141-K145 VanDerWaalsContact O-CB 3.31Å; K141-K145 WeakPolarHBondContact O-CB 3.47Å; K141-K145 PolarHBondContact O-N 3.09Å; K142-K145 PolarHBondContact O-N 3.32Å; K145-G147 PolarHBondContact O-N 3.44Å
146V96.2Very high89.6Confident42 Ų4273.1 Ų73.126%0.25535%0.346SS..THydrogen-bonded Turntrans-857.6175-54.60000113.3V84 V85 Q97 K142 C143 L144 M148V84-V146 HydrophobicContact CB-CB 4.5Å; V84-V146 HydrophobicContact CG2-CB 4Å; V84-V146 HydrophobicContact CG2-CG2 3.67Å; V85-V146 HydrophobicContact CG2-CG2 3.88Å; Q97-V146 VanDerWaalsContact CG-O 3.26Å; Q97-V146 WeakPolarHBondContact CG-O 3.47Å; Q97-V146 PolarHBondContact NE2-O 2.84Å; K142-V146 HydrophobicContact CG-CG1 4.37Å; K142-V146 WeakPolarHBondContact O-CG2 3.34Å; K142-V146 PolarHBondContact O-N 3.41Å; C143-V146 WeakPolarHBondContact O-CG2 3.09Å; L144-V146 VanDerWaalsContact C-N 3.29Å; L144-V146 PolarHBondContact O-N 3.01Å; V146-M148 HydrophobicContact CG2-CG 4.26Å
147G94.4Very high87Confident33 Ų3380.5 Ų80.534%0.3437%0.37SS..THydrogen-bonded Turntrans80.529.9173.900000115.2Q97 L144 K145 R149Q97-G147 WeakPolarHBondContact CG-O 3.2Å; L144-G147 PolarHBondContact O-N 3.39Å; K145-G147 PolarHBondContact O-N 3.44Å; G147-R149 PolarHBondContact O-N 3.02Å
148M97.6Very high84.4Confident6 Ų683.6 Ų83.63%0.0339%0.394CS..  trans-69.1121.3165.3-63.3-174.574.900110V85 Y95 Q97 T99 F107 C143 V146V85-M148 HydrophobicContact CG2-SD 3.73Å; Y95-M148 HydrophobicContact CD2-CE 3.84Å; Y95-M148 WeakPolarHBondContact O-CA 3.38Å; Q97-M148 HydrophobicContact CB-CG 4.17Å; Q97-M148 HydrophobicContact CG-CG 4.3Å; T99-M148 HydrophobicContact CG2-CE 3.9Å; T99-M148 HydrophobicContact CG2-CG 4.5Å; T99-M148 HydrophobicContact CG2-SD 3.89Å; F107-M148 HydrophobicContact CB-CE 3.75Å; F107-M148 HydrophobicContact CB-SD 4.38Å; F107-M148 HydrophobicContact CD1-CB 4.32Å; F107-M148 HydrophobicContact CD1-CE 3.89Å; F107-M148 HydrophobicContact CD2-CB 4.15Å; F107-M148 HydrophobicContact CD2-CE 4.37Å; F107-M148 HydrophobicContact CD2-SD 4.26Å; F107-M148 HydrophobicContact CE1-CB 3.93Å; F107-M148 HydrophobicContact CE2-CB 3.75Å; F107-M148 HydrophobicContact CG-CB 4.41Å; F107-M148 HydrophobicContact CG-CE 3.76Å; F107-M148 HydrophobicContact CG-SD 4.22Å; F107-M148 HydrophobicContact CZ-CB 3.63Å; F107-M148 VanDerWaalsContact CZ-O 3.24Å; F107-M148 WeakPolarHBondContact CZ-O 3.45Å; C143-M148 HydrophobicContact CB-CB 4.4Å; C143-M148 HydrophobicContact CB-CG 4.31Å; C143-M148 HydrophobicContact CB-SD 3.59Å; C143-M148 VanDerWaalsContact CB-SD 3.59Å; C143-M148 WeakPolarHBondContact O-CB 3.41Å; C143-M148 VanDerWaalsContact O-CG 3.3Å; C143-M148 WeakPolarHBondContact O-CG 3.48Å; C143-M148 PolarHBondContact O-N 3.47Å; V146-M148 HydrophobicContact CG2-CG 4.26Å
149R92.8Very high81.5Confident145 Ų14587.7 Ų87.755%0.54742%0.421SS..  trans-78.7116.5-173-71.5-174.2-177.2-144.34.7112.2Y95 F107 G147 E151 A152Y95-R149 WeakPolarHBondContact O-CB 3.24Å; Y95-R149 PolarHBondContact O-N 2.91Å; F107-R149 WeakPolarHBondContact CE1-O 3.47Å; G147-R149 PolarHBondContact O-N 3.02Å; R149-E151 VanDerWaalsContact C-OE2 3.24Å; R149-E151 WeakPolarHBondContact CA-OE2 3.35Å; R149-E151 VanDerWaalsContact CB-CD 3.49Å; R149-E151 HydrophobicContact CB-CG 4.47Å; R149-E151 WeakPolarHBondContact CB-OE1 3.37Å; R149-E151 WeakPolarHBondContact CB-OE2 3.43Å; R149-E151 VanDerWaalsContact CD-OE1 3.23Å; R149-E151 WeakPolarHBondContact CD-OE1 3.38Å; R149-E151 WeakPolarHBondContact CG-OE1 3.28Å; R149-A152 HydrophobicContact CB-CB 3.78Å; R149-A152 PolarHBondContact O-N 3.19Å
150R90.9Very high78.6Confident148 Ų14893.7 Ų93.756%0.55846%0.461SS*.SBendtrans-68.9-39.8179.4-60.3-170.8-130-148.83.9111.2F107 V111 L144 A152 V153F107-R150 HydrophobicContact CZ-CG 3.98Å; V111-R150 HydrophobicContact CG1-CB 4.08Å; V111-R150 HydrophobicContact CG2-CB 4.3Å; V111-R150 HydrophobicContact CG2-CG 4.08Å; L144-R150 HydrophobicContact CD2-CG 3.65Å; R150-A152 PolarHBondContact O-N 3.35Å; R150-V153 VanDerWaalsContact O-CB 3.28Å; R150-V153 WeakPolarHBondContact O-CB 3.42Å; R150-V153 WeakPolarHBondContact O-CG2 3.41Å; R150-V153 PolarHBondContact O-N 2.76Å
151E83.7Confident75.6Confident136 Ų13697.6 Ų97.664%0.63649%0.486SS*.THydrogen-bonded Turntrans-59.7-30.6176.670.4-75.8-175.100112.6R149 V153R149-E151 VanDerWaalsContact C-OE2 3.24Å; R149-E151 WeakPolarHBondContact CA-OE2 3.35Å; R149-E151 VanDerWaalsContact CB-CD 3.49Å; R149-E151 HydrophobicContact CB-CG 4.47Å; R149-E151 WeakPolarHBondContact CB-OE1 3.37Å; R149-E151 WeakPolarHBondContact CB-OE2 3.43Å; R149-E151 VanDerWaalsContact CD-OE1 3.23Å; R149-E151 WeakPolarHBondContact CD-OE1 3.38Å; R149-E151 WeakPolarHBondContact CG-OE1 3.28Å; E151-V153 PolarHBondContact O-N 3.23Å
152A84.7Confident72.5Confident42 Ų42101.8 Ų101.835%0.34751%0.507SS..THydrogen-bonded Turntrans-72.6-7.6173.700000113.5Y95 R149 R150 Q154Y95-A152 HydrophobicContact CD1-CB 3.92Å; Y95-A152 WeakPolarHBondContact CD1-O 3.28Å; Y95-A152 WeakPolarHBondContact CE1-O 3.49Å; R149-A152 HydrophobicContact CB-CB 3.78Å; R149-A152 PolarHBondContact O-N 3.19Å; R150-A152 PolarHBondContact O-N 3.35Å; A152-Q154 VanDerWaalsContact C-N 3.26Å; A152-Q154 PolarHBondContact O-N 2.65Å; A152-Q154 VanDerWaalsContact O-N 3.09Å
153V86Confident69.6Low11 Ų11104.3 Ų104.37%0.06753%0.531CS..SBendtrans-86.765.6176.4-164.60000110.4Y95 F107 K108 V111 R112 R150 E151 R155Y95-V153 HydrophobicContact CD1-CB 4.4Å; Y95-V153 HydrophobicContact CD1-CG2 3.65Å; Y95-V153 HydrophobicContact CE1-CB 4.16Å; Y95-V153 HydrophobicContact CE1-CG1 4.29Å; Y95-V153 HydrophobicContact CE1-CG2 3.76Å; Y95-V153 HydrophobicContact CG-CG2 4.07Å; F107-V153 HydrophobicContact CD1-CG2 3.7Å; F107-V153 HydrophobicContact CE1-CG2 3.48Å; F107-V153 VanDerWaalsContact CE1-CG2 3.48Å; K108-V153 HydrophobicContact CB-CG1 4.35Å; K108-V153 HydrophobicContact CG-CG1 4.03Å; V111-V153 HydrophobicContact CB-CB 4.14Å; V111-V153 HydrophobicContact CB-CG1 4.22Å; V111-V153 HydrophobicContact CB-CG2 3.98Å; V111-V153 HydrophobicContact CG1-CB 3.84Å; V111-V153 HydrophobicContact CG1-CG1 4.32Å; V111-V153 HydrophobicContact CG1-CG2 3.99Å; V111-V153 HydrophobicContact CG2-CG2 4.16Å; R112-V153 HydrophobicContact CG-CG1 3.79Å; R150-V153 VanDerWaalsContact O-CB 3.28Å; R150-V153 WeakPolarHBondContact O-CB 3.42Å; R150-V153 WeakPolarHBondContact O-CG2 3.41Å; R150-V153 PolarHBondContact O-N 2.76Å; E151-V153 PolarHBondContact O-N 3.23Å; V153-R155 PolarHBondContact O-N 3.48Å
154Q77.1Confident66.4Low154 Ų154113 Ų11372%0.7257%0.571SS**  trans-44.2136.3174.9-66.9175.9-17.300111.6R112 A152R112-Q154 VanDerWaalsContact CZ-O 3.23Å; R112-Q154 PolarHBondContact NE-O 2.87Å; R112-Q154 PolarHBondContact NH2-O 3.07Å; A152-Q154 VanDerWaalsContact C-N 3.26Å; A152-Q154 PolarHBondContact O-N 2.65Å; A152-Q154 VanDerWaalsContact O-N 3.09Å
155R53.8Low63.9Low183 Ų183119 Ų11969%0.69160%0.597SS**PPolyproline II helixtrans-60144.6157.7-64.3-174.6-178.2-154.71107.1V153V153-R155 PolarHBondContact O-N 3.48Å
156G45.9Very low61.2Low39 Ų39113.2 Ų113.240%0.40259%0.59SS.*PPolyproline II helixtrans-65.7158.4-167.500000113V158G156-V158 WeakPolarHBondContact O-CG2 3.46Å; G156-V158 PolarHBondContact O-N 2.92Å; G156-V158 VanDerWaalsContact O-N 3.08Å
157R44Very low58.3Low256 Ų256119 Ų11997%0.96661%0.614SS**PPolyproline II helixtrans-54.1117161.2-66.9-178.9-174.2158.4-0.4107.6
158V42.9Very low55.6Low123 Ų123123 Ų12375%0.74562%0.622SS**PPolyproline II helixtrans-88.5133.7176.2-165.70000107.6G156G156-V158 WeakPolarHBondContact O-CG2 3.46Å; G156-V158 PolarHBondContact O-N 2.92Å; G156-V158 VanDerWaalsContact O-N 3.08Å
159P37.1Very low52.7Low91 Ų91126 Ų12659%0.59165%0.649SS**PPolyproline II helixtrans-60155.5167.6-21.834.1000111.4T161P159-T161 VanDerWaalsContact C-N 3.34Å; P159-T161 PolarHBondContact O-N 2.81Å
160P37.6Very low50Low137 Ų137124.1 Ų124.189%0.8965%0.649SS**SBendtrans-75.582.3-18031.4-35.2000111.4
161T35.8Very low47.3Very low109 Ų109122.6 Ų122.667%0.66966%0.656SS**  trans-137.8113.2176.253.10000111.7P159P159-T161 VanDerWaalsContact C-N 3.34Å; P159-T161 PolarHBondContact O-N 2.81Å
162Q32.5Very low45.5Very low179 Ų179124.6 Ų124.684%0.83667%0.671SS**  trans33.7123.1160.9-61.6-66.88.900119.9H164Q162-H164 PolarHBondContact O-N 2.93Å
163P37.6Very low43.3Very low123 Ų123125.3 Ų125.380%0.79968%0.683SS**PPolyproline II helixtrans-75.3118.8176.831.6-33000111.9
164H30.4Very low40.9Very low182 Ų182129.5 Ų129.584%0.84370%0.704SS**PPolyproline II helixtrans-99139.7162.5-163-71.9000109.6Q162Q162-H164 PolarHBondContact O-N 2.93Å
165H44.1Very low39.4Very low176 Ų176126.3 Ų126.382%0.81570%0.697SS**SBendtrans-63.9159.8179.4-61.4-45.4000113.1
166G39.4Very low39Very low63 Ų63123.7 Ų123.765%0.64970%0.696SS**  trans128.52.3151.100000119.9
167Q35.7Very low39.1Very low162 Ų162128.7 Ų128.776%0.75771%0.709SS**  trans-141.681.8178.7-69.6-165.39.400115.3
168F37.8Very low39.6Very low117 Ų117119.5 Ų119.551%0.51368%0.683SS.*  trans-102.681.8167.5-63.7-68.6000111.2Y181 F236F168-Y181 AromaticContact CD1-CE2 3.97Å; F168-Y181 HydrophobicContact CD1-CE2 3.97Å; F168-F236 HydrophobicContact CB-CE1 3.86Å; F168-F236 HydrophobicContact CB-CZ 4.11Å; F168-F236 AromaticContact CD2-CE1 3.68Å; F168-F236 HydrophobicContact CD2-CE1 3.68Å; F168-F236 AromaticContact CD2-CZ 4Å; F168-F236 HydrophobicContact CD2-CZ 4Å; F168-F236 HydrophobicContact CG-CE1 4.08Å; F168-F236 HydrophobicContact CG-CZ 4.17Å
169A36.9Very low40.4Very low70 Ų70117.4 Ų117.458%0.57967%0.665SS**  trans-81.4118.1174.200000110.9T171A169-T171 PolarHBondContact O-N 3.33Å
170L35.2Very low41.9Very low106 Ų106117 Ų11756%0.55567%0.665SS**  trans-66.4120.7166.2-70.5171000109.2Y181L170-Y181 HydrophobicContact CD2-CE1 3.96Å
171T35.5Very low43.7Very low115 Ų115113.6 Ų113.671%0.70663%0.634SS**  trans-134.7113.7170.558.30000109.6A169 G173A169-T171 PolarHBondContact O-N 3.33Å; T171-G173 PolarHBondContact O-N 3.11Å; T171-G173 VanDerWaalsContact O-N 3.09Å
172N45.1Very low45.9Very low179 Ų179108.9 Ų108.996%0.95761%0.605SS**  trans-60.5112.9176.1-67.6-0.9000110.1
173G38.4Very low48.5Very low57 Ų57103.7 Ų103.759%0.58859%0.589SS**  trans174.6120.6178.900000112.7T171T171-G173 PolarHBondContact O-N 3.11Å; T171-G173 VanDerWaalsContact O-N 3.09Å
174D36.4Very low51.1Low98 Ų9899.4 Ų99.452%0.52457%0.566SS.*  trans66.3109.1177-156.5-21.4000115.4L176 H177 C178D174-L176 PolarHBondContact O-N 2.99Å; D174-L176 VanDerWaalsContact O-N 3.15Å; D174-L176 PolarHBondContact OD1-N 3.45Å; D174-H177 PolarHBondContact O-N 3.44Å; D174-C178 PolarHBondContact O-N 3.48Å
175P44.8Very low54.1Low87 Ų8791 Ų9157%0.56553%0.527SS*.Hα-helixtrans-51.9-38.1178.2-27.335.3000113.2H177 C178 H179P175-H177 PolarHBondContact O-N 2.78Å; P175-C178 WeakPolarHBondContact O-CA 3.24Å; P175-C178 WeakPolarHBondContact O-CB 3.25Å; P175-C178 PolarHBondContact O-N 3.05Å; P175-H179 VanDerWaalsContact C-CD2 3.43Å; P175-H179 PolarHBondContact O-CD2 3.15Å; P175-H179 PolarHBondContact O-N 2.84Å
176L45.4Very low56.5Low128 Ų12883 Ų8367%0.6749%0.491SS*.Hα-helixtrans-61.8-29.4-178.7-64.1174.5000113.1D174D174-L176 PolarHBondContact O-N 2.99Å; D174-L176 VanDerWaalsContact O-N 3.15Å; D174-L176 PolarHBondContact OD1-N 3.45Å
177H49.1Very low59.1Low144 Ų14482.8 Ų82.867%0.66748%0.479SS*.Hα-helixtrans-80.5-32.2171.2-104.470.2000112.7D174 P175 S180 Y181D174-H177 PolarHBondContact O-N 3.44Å; P175-H177 PolarHBondContact O-N 2.78Å; H177-S180 PolarHBondContact O-N 3.34Å; H177-Y181 WeakPolarHBondContact O-CB 3.44Å; H177-Y181 PolarHBondContact O-N 3.4Å
178C54.9Low61.9Low64 Ų6478.6 Ų78.643%0.43246%0.461SS..Hα-helixtrans-64.9-48.8176-164.80000111.8D174 P175 S180 Y181 L182D174-C178 PolarHBondContact O-N 3.48Å; P175-C178 WeakPolarHBondContact O-CA 3.24Å; P175-C178 WeakPolarHBondContact O-CB 3.25Å; P175-C178 PolarHBondContact O-N 3.05Å; C178-S180 VanDerWaalsContact C-N 3.27Å; C178-S180 PolarHBondContact O-N 3.31Å; C178-Y181 PolarHBondContact O-N 3.02Å; C178-Y181 VanDerWaalsContact O-N 3.12Å; C178-L182 WeakPolarHBondContact O-CG 3.47Å; C178-L182 PolarHBondContact O-N 3.25Å
179H59.5Low64.7Low78 Ų7873 Ų7336%0.36144%0.437SS..Hα-helixtrans-54.1-43.9175.6-60.5-68000111.8P175 S183 E351P175-H179 VanDerWaalsContact C-CD2 3.43Å; P175-H179 PolarHBondContact O-CD2 3.15Å; P175-H179 PolarHBondContact O-N 2.84Å; H179-S183 VanDerWaalsContact O-CB 3.24Å; H179-S183 WeakPolarHBondContact O-CB 3.33Å; H179-S183 PolarHBondContact O-N 2.87Å; H179-E351 VanDerWaalsContact CE1-CD 3.48Å; H179-E351 IonicContact CE1-OE1 3.1Å; H179-E351 PolarHBondContact CE1-OE1 3.39Å; H179-E351 IonicContact CE1-OE2 3.54Å; H179-E351 IonicContact ND1-OE1 2.9Å; H179-E351 PolarHBondContact ND1-OE1 3.15Å; H179-E351 IonicContact ND1-OE2 2.81Å; H179-E351 PolarHBondContact ND1-OE2 2.92Å
180S68Low67.4Low84 Ų8472.6 Ų72.659%0.58743%0.425SS*.Hα-helixtrans-66.4-41.6178.2-1720000112.6H177 C178 G184H177-S180 PolarHBondContact O-N 3.34Å; C178-S180 VanDerWaalsContact C-N 3.27Å; C178-S180 PolarHBondContact O-N 3.31Å; S180-G184 PolarHBondContact O-N 2.88Å
181Y75.6Confident70.1Confident64 Ų6477.7 Ų77.725%0.25144%0.437SS..Hα-helixtrans-65.6-45.8177.3177.3-105.8000112.7F168 L170 H177 C178 G184 Y185 K344F168-Y181 AromaticContact CD1-CE2 3.97Å; F168-Y181 HydrophobicContact CD1-CE2 3.97Å; L170-Y181 HydrophobicContact CD2-CE1 3.96Å; H177-Y181 WeakPolarHBondContact O-CB 3.44Å; H177-Y181 PolarHBondContact O-N 3.4Å; C178-Y181 PolarHBondContact O-N 3.02Å; C178-Y181 VanDerWaalsContact O-N 3.12Å; Y181-G184 PolarHBondContact O-N 2.86Å; Y181-Y185 PolarHBondContact O-N 3.37Å; Y181-K344 HydrophobicContact CE1-CD 4.38Å
182L82.3Confident72.9Confident11 Ų1172.5 Ų72.56%0.05841%0.406CS..Hα-helixtrans-68.4-40.3-179.6-64.1175.4000111.6C178 G184 Y185 I186 C347 A348 E351C178-L182 WeakPolarHBondContact O-CG 3.47Å; C178-L182 PolarHBondContact O-N 3.25Å; L182-G184 VanDerWaalsContact C-N 3.33Å; L182-G184 PolarHBondContact O-N 3.44Å; L182-Y185 WeakPolarHBondContact O-CB 3.13Å; L182-Y185 PolarHBondContact O-N 2.98Å; L182-I186 WeakPolarHBondContact O-CG1 3.45Å; L182-I186 PolarHBondContact O-N 3.3Å; L182-C347 HydrophobicContact CD1-CB 4.46Å; L182-A348 HydrophobicContact CB-CB 4.37Å; L182-A348 HydrophobicContact CD2-CB 4.08Å; L182-E351 HydrophobicContact CD1-CB 3.93Å; L182-E351 HydrophobicContact CD1-CG 4.11Å
183S86.8Confident75Confident70 Ų7065.8 Ų65.849%0.4937%0.369SS..Hα-helixtrans-60.9-40.5171-1790000112.3H179 I186 S187H179-S183 VanDerWaalsContact O-CB 3.24Å; H179-S183 WeakPolarHBondContact O-CB 3.33Å; H179-S183 PolarHBondContact O-N 2.87Å; S183-I186 PolarHBondContact O-N 3.13Å; S183-S187 WeakPolarHBondContact O-CB 3.41Å; S183-S187 PolarHBondContact O-N 3.26Å; S183-S187 PolarHBondContact O-OG 3.09Å
184G90.7Very high77.1Confident32 Ų3265 Ų6533%0.3335%0.353SS..Hα-helixtrans-63.6-38.7172.700000113.4S180 Y181 L182 S187 L188S180-G184 PolarHBondContact O-N 2.88Å; Y181-G184 PolarHBondContact O-N 2.86Å; L182-G184 VanDerWaalsContact C-N 3.33Å; L182-G184 PolarHBondContact O-N 3.44Å; G184-S187 WeakPolarHBondContact O-CB 3.44Å; G184-S187 PolarHBondContact O-N 3.1Å; G184-L188 WeakPolarHBondContact O-CG 3.47Å; G184-L188 PolarHBondContact O-N 3.01Å; G184-L188 VanDerWaalsContact O-N 3.11Å
185Y94.3Very high78.8Confident5 Ų564 Ų642%0.0234%0.342CS..Hα-helixtrans-65.2-47.7175.6175.6-116.5000111.8Y181 L182 S187 L188 L189 P235 F236 S345 A348Y181-Y185 PolarHBondContact O-N 3.37Å; L182-Y185 WeakPolarHBondContact O-CB 3.13Å; L182-Y185 PolarHBondContact O-N 2.98Å; Y185-S187 VanDerWaalsContact C-N 3.28Å; Y185-S187 PolarHBondContact O-N 3.31Å; Y185-L188 WeakPolarHBondContact O-CA 3.17Å; Y185-L188 WeakPolarHBondContact O-CB 3.26Å; Y185-L188 PolarHBondContact O-N 2.87Å; Y185-L189 HydrophobicContact CD1-CD1 4.23Å; Y185-L189 HydrophobicContact CE1-CD1 3.71Å; Y185-L189 HydrophobicContact CE1-CG 4.23Å; Y185-L189 HydrophobicContact CE2-CD2 3.99Å; Y185-L189 HydrophobicContact CE2-CG 4.22Å; Y185-L189 PolarHBondContact O-N 3.24Å; Y185-P235 HydrophobicContact CD2-CB 4.36Å; Y185-P235 HydrophobicContact CD2-CG 4.11Å; Y185-P235 HydrophobicContact CE2-CB 4.16Å; Y185-P235 HydrophobicContact CE2-CG 4.13Å; Y185-F236 AromaticContact CD2-CE2 3.99Å; Y185-F236 HydrophobicContact CD2-CE2 3.99Å; Y185-F236 HydrophobicContact CE2-CD2 4.07Å; Y185-F236 AromaticContact CE2-CE2 3.74Å; Y185-F236 HydrophobicContact CE2-CE2 3.74Å; Y185-S345 PolarHBondContact OH-OG 3.18Å; Y185-A348 HydrophobicContact CD1-CB 3.89Å; Y185-A348 HydrophobicContact CE1-CB 4.34Å
186I94.9Very high79.7Confident9 Ų963.9 Ų63.95%0.04634%0.342CS..Hα-helixtrans-58.2-42.2173.8-67171.2000111L182 S183 L188 L189 L190 A314 A348 Y352L182-I186 WeakPolarHBondContact O-CG1 3.45Å; L182-I186 PolarHBondContact O-N 3.3Å; S183-I186 PolarHBondContact O-N 3.13Å; I186-L188 PolarHBondContact O-N 3.37Å; I186-L189 PolarHBondContact O-N 2.94Å; I186-L189 VanDerWaalsContact O-N 3.15Å; I186-L190 HydrophobicContact CG2-CD1 3.98Å; I186-L190 HydrophobicContact CG2-CG 4.4Å; I186-L190 WeakPolarHBondContact O-CG 3.37Å; I186-L190 PolarHBondContact O-N 2.91Å; I186-A314 HydrophobicContact CG2-CB 3.67Å; I186-A348 HydrophobicContact CD1-CB 4.16Å; I186-A348 HydrophobicContact CG1-CB 4.07Å; I186-Y352 HydrophobicContact CD1-CD2 3.91Å; I186-Y352 HydrophobicContact CD1-CG 4.05Å
187S93.4Very high80.4Confident58 Ų5860.7 Ų60.741%0.40633%0.328SS..Hα-helixtrans-61.7-27.3176.1-59.40000113.1S183 G184 Y185 R191S183-S187 WeakPolarHBondContact O-CB 3.41Å; S183-S187 PolarHBondContact O-N 3.26Å; S183-S187 PolarHBondContact O-OG 3.09Å; G184-S187 WeakPolarHBondContact O-CB 3.44Å; G184-S187 PolarHBondContact O-N 3.1Å; Y185-S187 VanDerWaalsContact C-N 3.28Å; Y185-S187 PolarHBondContact O-N 3.31Å; S187-R191 WeakPolarHBondContact O-CB 3.26Å; S187-R191 WeakPolarHBondContact O-CD 3.41Å; S187-R191 WeakPolarHBondContact O-CG 3.3Å; S187-R191 PolarHBondContact O-N 3.34Å
188L94.6Very high80.7Confident74 Ų7457.7 Ų57.739%0.38732%0.323SS..Hα-helixtrans-80-41.2172.5-68.4166.6000111.6G184 Y185 I186 L190 R191 A192 P235G184-L188 WeakPolarHBondContact O-CG 3.47Å; G184-L188 PolarHBondContact O-N 3.01Å; G184-L188 VanDerWaalsContact O-N 3.11Å; Y185-L188 WeakPolarHBondContact O-CA 3.17Å; Y185-L188 WeakPolarHBondContact O-CB 3.26Å; Y185-L188 PolarHBondContact O-N 2.87Å; I186-L188 PolarHBondContact O-N 3.37Å; L188-L190 VanDerWaalsContact C-N 3.32Å; L188-L190 PolarHBondContact O-N 2.86Å; L188-R191 PolarHBondContact O-N 3.45Å; L188-R191 VanDerWaalsContact O-N 3.13Å; L188-A192 PolarHBondContact O-N 3.04Å; L188-A192 VanDerWaalsContact O-N 3.15Å; L188-P235 HydrophobicContact CB-CG 3.54Å; L188-P235 HydrophobicContact CD1-CG 3.77Å; L188-P235 HydrophobicContact CG-CG 4.25Å
189L96.2Very high80.7Confident0 Ų063.2 Ų63.20%034%0.335CS..Hα-helixtrans-59.2-41.3174.9-63.5-178.5000112.4Y185 I186 R191 A192 W230 I234 A321Y185-L189 HydrophobicContact CD1-CD1 4.23Å; Y185-L189 HydrophobicContact CE1-CD1 3.71Å; Y185-L189 HydrophobicContact CE1-CG 4.23Å; Y185-L189 HydrophobicContact CE2-CD2 3.99Å; Y185-L189 HydrophobicContact CE2-CG 4.22Å; Y185-L189 PolarHBondContact O-N 3.24Å; I186-L189 PolarHBondContact O-N 2.94Å; I186-L189 VanDerWaalsContact O-N 3.15Å; L189-R191 VanDerWaalsContact C-N 3.33Å; L189-A192 PolarHBondContact O-N 2.85Å; L189-W230 HydrophobicContact CD2-CZ2 4.15Å; L189-W230 PolarHBondContact O-NE1 3.19Å; L189-I234 HydrophobicContact CD2-CB 3.78Å; L189-I234 HydrophobicContact CD2-CD1 4.48Å; L189-I234 HydrophobicContact CD2-CG2 3.53Å; L189-A321 HydrophobicContact CD1-CB 4.09Å; L189-A321 HydrophobicContact CD2-CB 4.39Å
190L93.3Very high80.5Confident62 Ų6260 Ų6033%0.32532%0.319SS..Hα-helixtrans-67.3-31175.6-74.5169.7000113.1I186 L188 A192 A314I186-L190 HydrophobicContact CG2-CD1 3.98Å; I186-L190 HydrophobicContact CG2-CG 4.4Å; I186-L190 WeakPolarHBondContact O-CG 3.37Å; I186-L190 PolarHBondContact O-N 2.91Å; L188-L190 VanDerWaalsContact C-N 3.32Å; L188-L190 PolarHBondContact O-N 2.86Å; L190-A192 VanDerWaalsContact C-N 3.33Å; L190-A314 HydrophobicContact CD1-CB 4.2Å; L190-A314 HydrophobicContact CD2-CB 4.49Å
191R92.4Very high79.6Confident212 Ų21257.1 Ų57.180%0.830%0.303SS*.Hα-helixtrans-80.8-13.1178.5-76.3175.665.883.39.2113.6S187 L188 L189S187-R191 WeakPolarHBondContact O-CB 3.26Å; S187-R191 WeakPolarHBondContact O-CD 3.41Å; S187-R191 WeakPolarHBondContact O-CG 3.3Å; S187-R191 PolarHBondContact O-N 3.34Å; L188-R191 PolarHBondContact O-N 3.45Å; L188-R191 VanDerWaalsContact O-N 3.13Å; L189-R191 VanDerWaalsContact C-N 3.33Å
192A93.9Very high78.3Confident7 Ų758.4 Ų58.46%0.05832%0.321CS..THydrogen-bonded Turntrans-83.2-11.2175.400000113.3L188 L189 L190 P194 W230 N233 I234L188-A192 PolarHBondContact O-N 3.04Å; L188-A192 VanDerWaalsContact O-N 3.15Å; L189-A192 PolarHBondContact O-N 2.85Å; L190-A192 VanDerWaalsContact C-N 3.33Å; A192-P194 VanDerWaalsContact O-CD 3.26Å; A192-P194 WeakPolarHBondContact O-CD 3.31Å; A192-W230 HydrophobicContact CB-CG 4.47Å; A192-N233 HydrophobicContact CB-CB 3.81Å; A192-I234 HydrophobicContact CB-CB 4.47Å; A192-I234 HydrophobicContact CB-CG2 3.6Å
193E89.6Confident76.9Confident38 Ų3863.1 Ų63.118%0.17834%0.343CS..  trans-68.9111.6179-59.9-78.2-17500109.8Y195 W230 S317 K320E193-Y195 VanDerWaalsContact C-N 3.26Å; E193-Y195 PolarHBondContact O-N 2.73Å; E193-W230 VanDerWaalsContact CD-CD1 3.45Å; E193-W230 PolarHBondContact OE1-NE1 3.09Å; E193-S317 PolarHBondContact OE1-OG 3.36Å; E193-K320 IonicContact OE1-NZ 3.62Å; E193-K320 PolarHBondContact OE1-NZ 3.35Å; E193-K320 IonicContact OE2-NZ 3.15Å; E193-K320 PolarHBondContact OE2-NZ 3.49Å
194P81.9Confident75.1Confident40 Ų4061.1 Ų61.126%0.2633%0.329SS..SBendtrans-73.1-17.5-169.328.7-35000113.5A192 S226 E229A192-P194 VanDerWaalsContact O-CD 3.26Å; A192-P194 WeakPolarHBondContact O-CD 3.31Å; P194-S226 WeakPolarHBondContact CG-OG 3.48Å; P194-E229 HydrophobicContact CB-CG 4.2Å; P194-E229 WeakPolarHBondContact CB-OE2 3.28Å; P194-E229 HydrophobicContact CG-CB 4.32Å; P194-E229 HydrophobicContact CG-CG 4.42Å
195Y72.8Confident72.9Confident76 Ų7665.9 Ų65.930%0.29834%0.344SS..SBendtrans-131.5125.5179.1-53-63.1000111E193 T197 Y200 F225E193-Y195 VanDerWaalsContact C-N 3.26Å; E193-Y195 PolarHBondContact O-N 2.73Å; Y195-T197 PolarHBondContact O-N 2.89Å; Y195-Y200 WeakPolarHBondContact CD2-OH 3.44Å; Y195-F225 HydrophobicContact CE2-CD1 4.41Å
196P64.2Low70.7Confident86 Ų8671.6 Ų71.656%0.55837%0.371SS*.  trans-60.1134.4174-2434000111.5S198 R199P196-S198 PolarHBondContact O-N 3.43Å; P196-R199 WeakPolarHBondContact O-CB 3.44Å; P196-R199 PolarHBondContact O-N 3.47Å
197T60.3Low68.3Low60 Ų6076.9 Ų76.937%0.36841%0.406SS..THydrogen-bonded Turntrans-53.8-29.9-176-340000113.5Y195 R199 Y200 G201 Q263Y195-T197 PolarHBondContact O-N 2.89Å; T197-R199 PolarHBondContact O-N 2.97Å; T197-Y200 PolarHBondContact O-N 2.88Å; T197-G201 PolarHBondContact O-N 3.27Å; T197-G201 VanDerWaalsContact O-N 3.15Å; T197-Q263 HydrophobicContact CG2-CG 4.16Å; T197-Q263 WeakPolarHBondContact CG2-O 3.17Å
198S55.5Low66.1Low81 Ų8181.8 Ų81.857%0.56643%0.428SS*.Hα-helixtrans-60.9-26.1174.955.80000114.3P196 Y200 S202P196-S198 PolarHBondContact O-N 3.43Å; S198-Y200 VanDerWaalsContact C-N 3.26Å; S198-Y200 PolarHBondContact O-N 3.42Å; S198-S202 WeakPolarHBondContact O-CB 3.33Å; S198-S202 PolarHBondContact O-N 3.41Å; S198-S202 PolarHBondContact O-OG 3.2Å; S198-S202 VanDerWaalsContact O-OG 3.12Å
199R54.3Low64.1Low180 Ų18084.6 Ų84.668%0.67944%0.443SS*.Hα-helixtrans-65.6-29.5173.2-78.6-71.6-171.8174.4-0.1112.7P196 T197P196-R199 WeakPolarHBondContact O-CB 3.44Å; P196-R199 PolarHBondContact O-N 3.47Å; T197-R199 PolarHBondContact O-N 2.97Å
200Y54.8Low62.3Low10 Ų1091.4 Ų91.44%0.03948%0.478CS..Hα-helixtrans-85.2-47.4177.3-62.1-70.5000111.2Y195 T197 S198 S202 Q203 C204 L219 C264Y195-Y200 WeakPolarHBondContact CD2-OH 3.44Å; T197-Y200 PolarHBondContact O-N 2.88Å; S198-Y200 VanDerWaalsContact C-N 3.26Å; S198-Y200 PolarHBondContact O-N 3.42Å; Y200-S202 VanDerWaalsContact C-N 3.33Å; Y200-S202 PolarHBondContact O-N 3.09Å; Y200-Q203 PolarHBondContact O-N 3.49Å; Y200-C204 PolarHBondContact O-N 3.32Å; Y200-L219 HydrophobicContact CD1-CD1 3.32Å; Y200-L219 HydrophobicContact CE1-CD1 3.55Å; Y200-L219 HydrophobicContact CG-CD1 4.41Å; Y200-C264 HydrophobicContact CD2-CB 4.46Å; Y200-C264 WeakPolarHBondContact CD2-SG 3.31Å; Y200-C264 HydrophobicContact CG-CB 4.14Å
201G49.4Very low61.1Low24 Ų2490 Ų9025%0.24747%0.47CS..Hα-helixtrans-54.3-45.1178.500000113.4T197 Q203 C204 M205T197-G201 PolarHBondContact O-N 3.27Å; T197-G201 VanDerWaalsContact O-N 3.15Å; G201-Q203 PolarHBondContact O-N 2.93Å; G201-Q203 VanDerWaalsContact O-N 3.12Å; G201-C204 PolarHBondContact O-N 3.07Å; G201-C204 PolarHBondContact O-SG 3.36Å; G201-M205 VanDerWaalsContact O-CB 3.31Å; G201-M205 WeakPolarHBondContact O-CB 3.47Å; G201-M205 WeakPolarHBondContact O-CG 3.3Å; G201-M205 PolarHBondContact O-N 2.91Å
202S49.5Very low60.1Low91 Ų9181.8 Ų81.864%0.63645%0.452SS*.Hα-helixtrans-66.1-13178.9-61.50000114.8S198 Y200S198-S202 WeakPolarHBondContact O-CB 3.33Å; S198-S202 PolarHBondContact O-N 3.41Å; S198-S202 PolarHBondContact O-OG 3.2Å; S198-S202 VanDerWaalsContact O-OG 3.12Å; Y200-S202 VanDerWaalsContact C-N 3.33Å; Y200-S202 PolarHBondContact O-N 3.09Å
203Q51Low59.3Low110 Ų11082.9 Ų82.951%0.51446%0.456SS..Hα-helixtrans-94.9-28174.5-61.4-167.8-76.400112.6Y200 G201Y200-Q203 PolarHBondContact O-N 3.49Å; G201-Q203 PolarHBondContact O-N 2.93Å; G201-Q203 VanDerWaalsContact O-N 3.12Å
204C49.5Very low58.7Low29 Ų2987 Ų8720%0.19648%0.476CS..Hα-helixtrans-95.2-18.317967.40000115Y200 G201 Q206Y200-C204 PolarHBondContact O-N 3.32Å; G201-C204 PolarHBondContact O-N 3.07Å; G201-C204 PolarHBondContact O-SG 3.36Å; C204-Q206 VanDerWaalsContact C-N 3.3Å; C204-Q206 PolarHBondContact O-N 3.21Å
205M44.4Very low58.8Low131 Ų13189.4 Ų89.465%0.64549%0.486SS*.  trans-85.831-175-67.3-71.5103.400115.3G201 P207G201-M205 VanDerWaalsContact O-CB 3.31Å; G201-M205 WeakPolarHBondContact O-CB 3.47Å; G201-M205 WeakPolarHBondContact O-CG 3.3Å; G201-M205 PolarHBondContact O-N 2.91Å; M205-P207 WeakPolarHBondContact O-CD 3.44Å
206Q48.7Very low59.3Low125 Ų12585.9 Ų85.958%0.58447%0.473SS*.  trans-101.2105.1175.6-72.8-63-2300110.9C204 N208 N209C204-Q206 VanDerWaalsContact C-N 3.3Å; C204-Q206 PolarHBondContact O-N 3.21Å; Q206-N208 VanDerWaalsContact C-N 3.27Å; Q206-N208 PolarHBondContact O-N 3.27Å; Q206-N209 HydrophobicContact CB-CB 4.48Å; Q206-N209 PolarHBondContact O-N 3.44Å
207P44.5Very low60.4Low121 Ų12182 Ų8279%0.78645%0.447SS*.THydrogen-bonded Turntrans-61.2-25.5-163.1-27.235.8000116.5M205M205-P207 WeakPolarHBondContact O-CD 3.44Å
208N47.8Very low61.7Low160 Ų16083.3 Ų83.386%0.85645%0.449SS*.THydrogen-bonded Turntrans-104.7-4.2-174.2-73.93.5000114.6Q206Q206-N208 VanDerWaalsContact C-N 3.27Å; Q206-N208 PolarHBondContact O-N 3.27Å
209N51.6Low63.2Low134 Ų13480.1 Ų80.172%0.71743%0.426SS*.  trans-106.7101.9178.9-95.62.8000110.6Q206 M211Q206-N209 HydrophobicContact CB-CB 4.48Å; Q206-N209 PolarHBondContact O-N 3.44Å; N209-M211 PolarHBondContact O-N 2.94Å; N209-M211 VanDerWaalsContact O-N 3.07Å
210I59Low64.9Low142 Ų14271.5 Ų71.573%0.72839%0.393SS*.  trans-58.7114.6162.4-61.5174.8000106.9G212 P272I210-G212 PolarHBondContact O-N 3.06Å; I210-G212 VanDerWaalsContact O-N 3.14Å; I210-P272 HydrophobicContact CG2-CG 4.1Å
211M67.6Low66.6Low32 Ų3272.8 Ų72.816%0.15841%0.405CS..  trans-64.2119-176-168.7158.786.200109.8N209 N215 I216 L219 P267N209-M211 PolarHBondContact O-N 2.94Å; N209-M211 VanDerWaalsContact O-N 3.07Å; M211-N215 HydrophobicContact CG-CB 3.65Å; M211-N215 HydrophobicContact SD-CB 4.15Å; M211-I216 HydrophobicContact CB-CG1 4.32Å; M211-I216 HydrophobicContact CE-CB 4.43Å; M211-I216 HydrophobicContact CE-CG1 3.72Å; M211-I216 HydrophobicContact CG-CG1 4.23Å; M211-I216 WeakPolarHBondContact O-CD1 3.25Å; M211-L219 HydrophobicContact CE-CB 4.39Å; M211-L219 HydrophobicContact CE-CD2 3.72Å; M211-P267 HydrophobicContact CB-CG 4.35Å; M211-P267 HydrophobicContact CE-CG 3.68Å
212G71.9Confident68.6Low40 Ų4074.4 Ų74.441%0.41240%0.404SS..  trans-56.7144-178.600000111.4I210 E214 N215 I216I210-G212 PolarHBondContact O-N 3.06Å; I210-G212 VanDerWaalsContact O-N 3.14Å; G212-E214 PolarHBondContact O-N 3.02Å; G212-E214 VanDerWaalsContact O-N 3.07Å; G212-N215 WeakPolarHBondContact O-CB 3.47Å; G212-N215 PolarHBondContact O-N 2.74Å; G212-I216 PolarHBondContact O-N 2.94Å
213I77Confident70.6Confident30 Ų3070.1 Ų70.115%0.15437%0.374CS..Hα-helixtrans-59.9-29.5-167.6-173.856.5000113.7N215 I216 C217 P272 L273 A276I213-N215 VanDerWaalsContact C-N 3.34Å; I213-N215 PolarHBondContact O-N 2.76Å; I213-I216 HydrophobicContact CD1-CB 4.09Å; I213-I216 HydrophobicContact CD1-CD1 4.15Å; I213-I216 HydrophobicContact CD1-CG2 4.35Å; I213-I216 WeakPolarHBondContact O-CB 3.34Å; I213-I216 PolarHBondContact O-N 2.73Å; I213-I216 VanDerWaalsContact O-N 3.13Å; I213-C217 PolarHBondContact O-N 3.04Å; I213-P272 HydrophobicContact CD1-CB 4.49Å; I213-P272 WeakPolarHBondContact CD1-O 3.48Å; I213-L273 HydrophobicContact CD1-CD2 4.3Å; I213-A276 HydrophobicContact CD1-CB 3.38Å; I213-A276 HydrophobicContact CG1-CB 3.39Å
214E77Confident72.6Confident126 Ų12665.1 Ų65.159%0.58935%0.351SS*.Hα-helixtrans-68-35.7178.4-55.4-172.6154.500111.4G212 I216 C217 E218 R389G212-E214 PolarHBondContact O-N 3.02Å; G212-E214 VanDerWaalsContact O-N 3.07Å; E214-I216 VanDerWaalsContact C-N 3.32Å; E214-I216 PolarHBondContact O-N 2.96Å; E214-C217 PolarHBondContact O-N 2.66Å; E214-E218 PolarHBondContact O-N 3.24Å; E214-R389 IonicContact OE1-CZ 3.14Å; E214-R389 IonicContact OE1-NH1 2.66Å; E214-R389 IonicContact OE1-NH2 2.7Å; E214-R389 PolarHBondContact OE1-NH2 3.44Å
215N83.1Confident74.6Confident90 Ų9067.5 Ų67.548%0.48136%0.358SS..Hα-helixtrans-69.2-29.9172.3-56.9-3.9000111.8M211 G212 I213 L219M211-N215 HydrophobicContact CG-CB 3.65Å; M211-N215 HydrophobicContact SD-CB 4.15Å; G212-N215 WeakPolarHBondContact O-CB 3.47Å; G212-N215 PolarHBondContact O-N 2.74Å; I213-N215 VanDerWaalsContact C-N 3.34Å; I213-N215 PolarHBondContact O-N 2.76Å; N215-L219 VanDerWaalsContact O-CB 3.25Å; N215-L219 WeakPolarHBondContact O-CB 3.49Å; N215-L219 PolarHBondContact O-N 2.95Å
216I84.8Confident76.9Confident2 Ų261.5 Ų61.51%0.0133%0.329CS..Hα-helixtrans-72.4-40.7174.3-59.6175.5000110.2M211 G212 I213 E214 L219 A220 M266 P267 P272 F386M211-I216 HydrophobicContact CB-CG1 4.32Å; M211-I216 HydrophobicContact CE-CB 4.43Å; M211-I216 HydrophobicContact CE-CG1 3.72Å; M211-I216 HydrophobicContact CG-CG1 4.23Å; M211-I216 WeakPolarHBondContact O-CD1 3.25Å; G212-I216 PolarHBondContact O-N 2.94Å; I213-I216 HydrophobicContact CD1-CB 4.09Å; I213-I216 HydrophobicContact CD1-CD1 4.15Å; I213-I216 HydrophobicContact CD1-CG2 4.35Å; I213-I216 WeakPolarHBondContact O-CB 3.34Å; I213-I216 PolarHBondContact O-N 2.73Å; I213-I216 VanDerWaalsContact O-N 3.13Å; E214-I216 VanDerWaalsContact C-N 3.32Å; E214-I216 PolarHBondContact O-N 2.96Å; I216-L219 PolarHBondContact O-N 3.08Å; I216-A220 WeakPolarHBondContact O-CB 3.4Å; I216-A220 PolarHBondContact O-N 3Å; I216-M266 HydrophobicContact CG2-CE 3.66Å; I216-P267 HydrophobicContact CD1-CG 4.47Å; I216-P267 HydrophobicContact CG1-CG 4.37Å; I216-P272 HydrophobicContact CD1-CB 4.29Å; I216-F386 HydrophobicContact CG2-CD1 4.13Å; I216-F386 HydrophobicContact CG2-CE1 3.76Å
217C86.4Confident79Confident3 Ų355.8 Ų55.82%0.0230%0.303CS..Hα-helixtrans-64.4-43172.2-74.50000112.2I213 E214 A220 A221 F386 L390I213-C217 PolarHBondContact O-N 3.04Å; E214-C217 PolarHBondContact O-N 2.66Å; C217-A220 WeakPolarHBondContact O-CB 3.5Å; C217-A220 PolarHBondContact O-N 3.32Å; C217-A221 PolarHBondContact O-N 3.39Å; C217-F386 PolarHBondContact SG-O 3.17Å; C217-F386 VanDerWaalsContact SG-O 3.4Å; C217-L390 HydrophobicContact CB-CD1 4.13Å; C217-L390 HydrophobicContact CB-CD2 4.44Å; C217-L390 HydrophobicContact CB-CG 4.36Å
218E87.4Confident81.4Confident89 Ų8950.2 Ų50.242%0.41627%0.267SS..Hα-helixtrans-61.5-43.6173.4-167.2-149.411700111.3E214 A220 A221 R222E214-E218 PolarHBondContact O-N 3.24Å; E218-A220 VanDerWaalsContact C-N 3.35Å; E218-A220 PolarHBondContact O-N 2.93Å; E218-A221 PolarHBondContact O-N 2.78Å; E218-R222 WeakPolarHBondContact O-CB 3.33Å; E218-R222 WeakPolarHBondContact O-CG 3.39Å; E218-R222 PolarHBondContact O-N 3.1Å; E218-R222 WeakPolarHBondContact OE1-CD 3.17Å; E218-R222 IonicContact OE1-CZ 3.17Å; E218-R222 IonicContact OE1-NE 3.74Å; E218-R222 IonicContact OE1-NH1 2.78Å; E218-R222 PolarHBondContact OE1-NH1 3.48Å
219L87.6Confident83.6Confident13 Ų1345.8 Ų45.87%0.06824%0.241CC..Hα-helixtrans-58.2-46.3174.3173.558.5000111.4Y200 M211 N215 I216 R222 M223 M266Y200-L219 HydrophobicContact CD1-CD1 3.32Å; Y200-L219 HydrophobicContact CE1-CD1 3.55Å; Y200-L219 HydrophobicContact CG-CD1 4.41Å; M211-L219 HydrophobicContact CE-CB 4.39Å; M211-L219 HydrophobicContact CE-CD2 3.72Å; N215-L219 VanDerWaalsContact O-CB 3.25Å; N215-L219 WeakPolarHBondContact O-CB 3.49Å; N215-L219 PolarHBondContact O-N 2.95Å; I216-L219 PolarHBondContact O-N 3.08Å; L219-R222 PolarHBondContact O-N 3.36Å; L219-M223 HydrophobicContact CD1-CG 4.13Å; L219-M223 HydrophobicContact CD1-SD 3.84Å; L219-M223 HydrophobicContact CD2-SD 4.48Å; L219-M223 HydrophobicContact CG-SD 3.8Å; L219-M223 WeakPolarHBondContact O-CB 3.32Å; L219-M223 WeakPolarHBondContact O-CG 3.24Å; L219-M223 PolarHBondContact O-N 3.13Å; L219-M266 HydrophobicContact CD2-CG 4.02Å
220A90.8Very high85.8Confident0 Ų039.4 Ų39.40%021%0.207CC..Hα-helixtrans-60.3-45.6176.200000112.2I216 C217 E218 R222 M223 L224 F257 M266 F386 F387I216-A220 WeakPolarHBondContact O-CB 3.4Å; I216-A220 PolarHBondContact O-N 3Å; C217-A220 WeakPolarHBondContact O-CB 3.5Å; C217-A220 PolarHBondContact O-N 3.32Å; E218-A220 VanDerWaalsContact C-N 3.35Å; E218-A220 PolarHBondContact O-N 2.93Å; A220-R222 VanDerWaalsContact C-N 3.35Å; A220-R222 PolarHBondContact O-N 3.06Å; A220-M223 PolarHBondContact O-N 2.96Å; A220-M223 VanDerWaalsContact O-N 3.16Å; A220-L224 PolarHBondContact O-N 3.3Å; A220-F257 HydrophobicContact CB-CE2 3.82Å; A220-F257 HydrophobicContact CB-CZ 3.73Å; A220-M266 HydrophobicContact CB-CE 3.95Å; A220-F386 HydrophobicContact CB-CB 3.54Å; A220-F386 HydrophobicContact CB-CD1 3.91Å; A220-F386 HydrophobicContact CB-CD2 4.42Å; A220-F386 HydrophobicContact CB-CG 3.69Å; A220-F387 HydrophobicContact CB-CE2 4.4Å; A220-F387 HydrophobicContact CB-CZ 4.12Å
221A90.7Very high87.6Confident36 Ų3632.7 Ų32.730%0.29817%0.172SC..Hα-helixtrans-60.6-43.417600000112.3C217 E218 M223 L224 F225 F387 L390C217-A221 PolarHBondContact O-N 3.39Å; E218-A221 PolarHBondContact O-N 2.78Å; A221-M223 VanDerWaalsContact C-N 3.33Å; A221-M223 PolarHBondContact O-N 3.34Å; A221-L224 PolarHBondContact O-N 3.47Å; A221-F225 WeakPolarHBondContact O-CB 3.26Å; A221-F225 PolarHBondContact O-N 3.19Å; A221-F387 HydrophobicContact CB-CE1 4.44Å; A221-L390 HydrophobicContact CB-CD1 3.86Å
222R89.9Confident88.9Confident59 Ų5936.2 Ų36.222%0.22318%0.184CC..Hα-helixtrans-65.3-33.4174.7-73.5170.756-157.3-12.6112.6E218 L219 A220 S226E218-R222 WeakPolarHBondContact O-CB 3.33Å; E218-R222 WeakPolarHBondContact O-CG 3.39Å; E218-R222 PolarHBondContact O-N 3.1Å; E218-R222 WeakPolarHBondContact OE1-CD 3.17Å; E218-R222 IonicContact OE1-CZ 3.17Å; E218-R222 IonicContact OE1-NE 3.74Å; E218-R222 IonicContact OE1-NH1 2.78Å; E218-R222 PolarHBondContact OE1-NH1 3.48Å; L219-R222 PolarHBondContact O-N 3.36Å; A220-R222 VanDerWaalsContact C-N 3.35Å; A220-R222 PolarHBondContact O-N 3.06Å; R222-S226 WeakPolarHBondContact O-CB 3.4Å; R222-S226 PolarHBondContact O-N 3.36Å
223M92.1Very high90Very high1 Ų139 Ų391%0.00519%0.189CC..Hα-helixtrans-73.2-36.1175.5-78.716733.200113.3L219 A220 A221 A227 F257 N260 A261 C264 M266L219-M223 HydrophobicContact CD1-CG 4.13Å; L219-M223 HydrophobicContact CD1-SD 3.84Å; L219-M223 HydrophobicContact CD2-SD 4.48Å; L219-M223 HydrophobicContact CG-SD 3.8Å; L219-M223 WeakPolarHBondContact O-CB 3.32Å; L219-M223 WeakPolarHBondContact O-CG 3.24Å; L219-M223 PolarHBondContact O-N 3.13Å; A220-M223 PolarHBondContact O-N 2.96Å; A220-M223 VanDerWaalsContact O-N 3.16Å; A221-M223 VanDerWaalsContact C-N 3.33Å; A221-M223 PolarHBondContact O-N 3.34Å; M223-A227 PolarHBondContact O-N 3.38Å; M223-A227 VanDerWaalsContact O-N 3.1Å; M223-F257 HydrophobicContact CB-CD2 4.45Å; M223-F257 HydrophobicContact CB-CE2 4.28Å; M223-F257 HydrophobicContact CE-CD2 4.21Å; M223-F257 HydrophobicContact CE-CE1 4.16Å; M223-F257 HydrophobicContact CE-CE2 3.83Å; M223-F257 HydrophobicContact CE-CZ 3.8Å; M223-N260 HydrophobicContact CB-CB 4.28Å; M223-N260 HydrophobicContact CE-CB 4.21Å; M223-N260 HydrophobicContact CG-CB 4.33Å; M223-N260 PolarHBondContact O-ND2 2.97Å; M223-A261 VanDerWaalsContact CE-CA 3.45Å; M223-A261 HydrophobicContact CE-CB 3.67Å; M223-C264 HydrophobicContact SD-CB 4.2Å; M223-M266 HydrophobicContact CE-SD 3.7Å; M223-M266 HydrophobicContact SD-SD 4.12Å
224L92.9Very high90.9Very high5 Ų537.8 Ų37.83%0.02618%0.183CC..Hα-helixtrans-66.9-50.6172.7173.665.7000110.6A220 A221 S226 A227 V228 W253 F387 I396A220-L224 PolarHBondContact O-N 3.3Å; A221-L224 PolarHBondContact O-N 3.47Å; L224-S226 VanDerWaalsContact C-N 3.29Å; L224-S226 PolarHBondContact O-N 2.96Å; L224-A227 WeakPolarHBondContact O-CB 3.13Å; L224-A227 PolarHBondContact O-N 3.32Å; L224-V228 PolarHBondContact O-N 2.91Å; L224-W253 HydrophobicContact CD1-CB 4.5Å; L224-W253 HydrophobicContact CD1-CE3 3.97Å; L224-F387 HydrophobicContact CB-CE1 4.04Å; L224-F387 HydrophobicContact CB-CZ 3.79Å; L224-F387 HydrophobicContact CD2-CD1 4.24Å; L224-F387 HydrophobicContact CD2-CE1 3.52Å; L224-F387 HydrophobicContact CD2-CZ 3.81Å; L224-F387 HydrophobicContact CG-CE1 4.43Å; L224-F387 HydrophobicContact CG-CZ 4.39Å; L224-I396 HydrophobicContact CD1-CG2 3.98Å; L224-I396 HydrophobicContact CD2-CD1 3.91Å; L224-I396 HydrophobicContact CD2-CG2 3.78Å
225F91.5Very high91.7Very high78 Ų7832.8 Ų32.834%0.34216%0.162SC..Hα-helixtrans-58-43.5175.5-178.8-99.9000111.3Y195 A221 A227 V228 E229 M403Y195-F225 HydrophobicContact CE2-CD1 4.41Å; A221-F225 WeakPolarHBondContact O-CB 3.26Å; A221-F225 PolarHBondContact O-N 3.19Å; F225-A227 VanDerWaalsContact C-N 3.26Å; F225-A227 PolarHBondContact O-N 2.89Å; F225-V228 PolarHBondContact O-N 3.37Å; F225-E229 HydrophobicContact CE1-CB 4.3Å; F225-E229 VanDerWaalsContact CE1-OE2 3.25Å; F225-E229 WeakPolarHBondContact CE1-OE2 3.37Å; F225-E229 HydrophobicContact CZ-CB 4.43Å; F225-E229 WeakPolarHBondContact O-CB 3.47Å; F225-E229 PolarHBondContact O-N 3.02Å; F225-M403 HydrophobicContact CD2-SD 4.22Å
226S91.9Very high92.2Very high6 Ų629.3 Ų29.34%0.04214%0.142CC..Hα-helixtrans-61.7-28175.1-173.10000113.8P194 R222 L224 W230P194-S226 WeakPolarHBondContact CG-OG 3.48Å; R222-S226 WeakPolarHBondContact O-CB 3.4Å; R222-S226 PolarHBondContact O-N 3.36Å; L224-S226 VanDerWaalsContact C-N 3.29Å; L224-S226 PolarHBondContact O-N 2.96Å; S226-W230 WeakPolarHBondContact O-CB 3.26Å; S226-W230 PolarHBondContact O-N 2.84Å
227A94.6Very high92.8Very high4 Ų429.2 Ų29.23%0.03314%0.142CC..Hα-helixtrans-73.7-42.9175.100000111.7M223 L224 F225 A231 L256M223-A227 PolarHBondContact O-N 3.38Å; M223-A227 VanDerWaalsContact O-N 3.1Å; L224-A227 WeakPolarHBondContact O-CB 3.13Å; L224-A227 PolarHBondContact O-N 3.32Å; F225-A227 VanDerWaalsContact C-N 3.26Å; F225-A227 PolarHBondContact O-N 2.89Å; A227-A231 WeakPolarHBondContact O-CB 3.44Å; A227-A231 PolarHBondContact O-N 3.46Å; A227-L256 HydrophobicContact CB-CB 4.22Å
228V94.7Very high93.2Very high4 Ų432 Ų322%0.02416%0.16CC..Hα-helixtrans-69.2-44.8178.1-178.80000111L224 F225 A231 R232 L249 I400 M403 L404L224-V228 PolarHBondContact O-N 2.91Å; F225-V228 PolarHBondContact O-N 3.37Å; V228-A231 PolarHBondContact O-N 2.94Å; V228-R232 WeakPolarHBondContact O-CG 3.38Å; V228-R232 PolarHBondContact O-N 2.78Å; V228-L249 HydrophobicContact CG1-CD1 4.4Å; V228-I400 HydrophobicContact CG2-CG1 4.18Å; V228-M403 HydrophobicContact CG1-CB 3.9Å; V228-M403 HydrophobicContact CG2-SD 4.37Å; V228-L404 HydrophobicContact CG1-CD2 4.06Å; V228-L404 HydrophobicContact CG1-CG 4.1Å
229E93.8Very high93.6Very high67 Ų6734 Ų3431%0.31317%0.173SC..Hα-helixtrans-69.1-34.4177.6-174.4164.4-129.400112.3P194 F225 R232 N233P194-E229 HydrophobicContact CB-CG 4.2Å; P194-E229 WeakPolarHBondContact CB-OE2 3.28Å; P194-E229 HydrophobicContact CG-CB 4.32Å; P194-E229 HydrophobicContact CG-CG 4.42Å; F225-E229 HydrophobicContact CE1-CB 4.3Å; F225-E229 VanDerWaalsContact CE1-OE2 3.25Å; F225-E229 WeakPolarHBondContact CE1-OE2 3.37Å; F225-E229 HydrophobicContact CZ-CB 4.43Å; F225-E229 WeakPolarHBondContact O-CB 3.47Å; F225-E229 PolarHBondContact O-N 3.02Å; E229-R232 PolarHBondContact O-N 2.75Å; E229-N233 PolarHBondContact O-N 3.27Å; E229-N233 PolarHBondContact O-ND2 3.08Å
230W96.3Very high94Very high1 Ų134.1 Ų34.10%0.00417%0.174CC..Hα-helixtrans-59.7-49.2169.4176.585.3000111.2L189 A192 E193 S226 R232 N233 I234 S317 K320 A321 L324L189-W230 HydrophobicContact CD2-CZ2 4.15Å; L189-W230 PolarHBondContact O-NE1 3.19Å; A192-W230 HydrophobicContact CB-CG 4.47Å; E193-W230 VanDerWaalsContact CD-CD1 3.45Å; E193-W230 PolarHBondContact OE1-NE1 3.09Å; S226-W230 WeakPolarHBondContact O-CB 3.26Å; S226-W230 PolarHBondContact O-N 2.84Å; W230-R232 VanDerWaalsContact C-N 3.31Å; W230-R232 PolarHBondContact O-N 3.16Å; W230-N233 PolarHBondContact O-N 3.1Å; W230-I234 HydrophobicContact CD2-CG2 3.78Å; W230-I234 HydrophobicContact CE3-CG2 4.22Å; W230-I234 HydrophobicContact CG-CG2 4.32Å; W230-I234 HydrophobicContact CH2-CD1 4Å; W230-I234 HydrophobicContact CH2-CG2 3.95Å; W230-I234 HydrophobicContact CZ2-CG2 3.52Å; W230-I234 HydrophobicContact CZ3-CD1 4Å; W230-I234 HydrophobicContact CZ3-CG2 4.29Å; W230-I234 PolarHBondContact O-N 3.19Å; W230-S317 WeakPolarHBondContact CZ2-O 3.37Å; W230-K320 HydrophobicContact CD2-CD 4.27Å; W230-K320 HydrophobicContact CE3-CB 4.32Å; W230-K320 HydrophobicContact CE3-CD 4.4Å; W230-K320 HydrophobicContact CH2-CB 3.35Å; W230-K320 HydrophobicContact CH2-CD 4.42Å; W230-K320 HydrophobicContact CZ2-CB 3.83Å; W230-K320 HydrophobicContact CZ2-CD 4.23Å; W230-K320 HydrophobicContact CZ3-CB 3.62Å; W230-K320 HydrophobicContact CZ3-CD 4.49Å; W230-A321 HydrophobicContact CH2-CB 4.08Å; W230-L324 HydrophobicContact CE3-CD2 4.49Å; W230-L324 HydrophobicContact CZ3-CD2 3.85Å
231A97.4Very high94.2Very high0 Ų039.8 Ų39.80%020%0.201CC..Hα-helixtrans-58.3-40.7177.100000112.4A227 V228 N233 I234 F237 L249 L324A227-A231 WeakPolarHBondContact O-CB 3.44Å; A227-A231 PolarHBondContact O-N 3.46Å; V228-A231 PolarHBondContact O-N 2.94Å; A231-N233 PolarHBondContact O-N 3.38Å; A231-I234 WeakPolarHBondContact O-CG1 3.49Å; A231-F237 HydrophobicContact CB-CD1 4.21Å; A231-F237 HydrophobicContact CB-CE1 4.06Å; A231-F237 HydrophobicContact CB-CZ 4.31Å; A231-F237 WeakPolarHBondContact O-CD1 3.42Å; A231-F237 WeakPolarHBondContact O-CG 3.49Å; A231-L249 HydrophobicContact CB-CD1 3.96Å; A231-L249 HydrophobicContact CB-CD2 3.95Å; A231-L249 HydrophobicContact CB-CG 4.38Å; A231-L324 HydrophobicContact CB-CD2 3.69Å
232R95.1Very high94.4Very high106 Ų10641.7 Ų41.740%0.421%0.205SC..THydrogen-bonded Turntrans-64.2-13.2174-71.717967143.48.2114.6V228 E229 W230 P238 M403 L404V228-R232 WeakPolarHBondContact O-CG 3.38Å; V228-R232 PolarHBondContact O-N 2.78Å; E229-R232 PolarHBondContact O-N 2.75Å; W230-R232 VanDerWaalsContact C-N 3.31Å; W230-R232 PolarHBondContact O-N 3.16Å; R232-P238 WeakPolarHBondContact O-CG 3.33Å; R232-M403 PolarHBondContact NH1-O 2.88Å; R232-L404 HydrophobicContact CG-CD2 3.81Å; R232-L404 PolarHBondContact NH1-O 3.29Å
233N94.9Very high94.6Very high99 Ų9942.7 Ų42.753%0.52922%0.218SC..THydrogen-bonded Turntrans-119.2-8.6-175.3-75.8-77.1000115A192 E229 W230 A231A192-N233 HydrophobicContact CB-CB 3.81Å; E229-N233 PolarHBondContact O-N 3.27Å; E229-N233 PolarHBondContact O-ND2 3.08Å; W230-N233 PolarHBondContact O-N 3.1Å; A231-N233 PolarHBondContact O-N 3.38Å
234I96.3Very high94.9Very high4 Ų442.8 Ų42.82%0.02122%0.218CC..SBendtrans-73.8159.1173.359.4166.8000112.3L189 A192 W230 A231 F237 P238 L324 F325L189-I234 HydrophobicContact CD2-CB 3.78Å; L189-I234 HydrophobicContact CD2-CD1 4.48Å; L189-I234 HydrophobicContact CD2-CG2 3.53Å; A192-I234 HydrophobicContact CB-CB 4.47Å; A192-I234 HydrophobicContact CB-CG2 3.6Å; W230-I234 HydrophobicContact CD2-CG2 3.78Å; W230-I234 HydrophobicContact CE3-CG2 4.22Å; W230-I234 HydrophobicContact CG-CG2 4.32Å; W230-I234 HydrophobicContact CH2-CD1 4Å; W230-I234 HydrophobicContact CH2-CG2 3.95Å; W230-I234 HydrophobicContact CZ2-CG2 3.52Å; W230-I234 HydrophobicContact CZ3-CD1 4Å; W230-I234 HydrophobicContact CZ3-CG2 4.29Å; W230-I234 PolarHBondContact O-N 3.19Å; A231-I234 WeakPolarHBondContact O-CG1 3.49Å; I234-F237 HydrophobicContact CD1-CB 3.98Å; I234-F237 HydrophobicContact CG1-CB 3.76Å; I234-P238 WeakPolarHBondContact O-CD 3.43Å; I234-L324 HydrophobicContact CD1-CD2 3.77Å; I234-F325 HydrophobicContact CD1-CE2 3.9Å; I234-F325 HydrophobicContact CD1-CZ 3.68Å
235P92.8Very high95.1Very high21 Ų2143.5 Ų43.514%0.13622%0.221CC..SBendtrans-61.6150.1173.4-22.535.2000112.7Y185 L188 F237Y185-P235 HydrophobicContact CD2-CB 4.36Å; Y185-P235 HydrophobicContact CD2-CG 4.11Å; Y185-P235 HydrophobicContact CE2-CB 4.16Å; Y185-P235 HydrophobicContact CE2-CG 4.13Å; L188-P235 HydrophobicContact CB-CG 3.54Å; L188-P235 HydrophobicContact CD1-CG 3.77Å; L188-P235 HydrophobicContact CG-CG 4.25Å; P235-F237 PolarHBondContact O-N 2.88Å
236F93.9Very high95.3Very high18 Ų1840.6 Ų40.68%0.07921%0.21CC..SBendtrans69.8-36.1175.5-41.3-67.5000116.2F168 Y185 D239 L240 L341 K344F168-F236 HydrophobicContact CB-CE1 3.86Å; F168-F236 HydrophobicContact CB-CZ 4.11Å; F168-F236 AromaticContact CD2-CE1 3.68Å; F168-F236 HydrophobicContact CD2-CE1 3.68Å; F168-F236 AromaticContact CD2-CZ 4Å; F168-F236 HydrophobicContact CD2-CZ 4Å; F168-F236 HydrophobicContact CG-CE1 4.08Å; F168-F236 HydrophobicContact CG-CZ 4.17Å; Y185-F236 AromaticContact CD2-CE2 3.99Å; Y185-F236 HydrophobicContact CD2-CE2 3.99Å; Y185-F236 HydrophobicContact CE2-CD2 4.07Å; Y185-F236 AromaticContact CE2-CE2 3.74Å; Y185-F236 HydrophobicContact CE2-CE2 3.74Å; F236-D239 WeakPolarHBondContact CA-OD2 3.21Å; F236-D239 WeakPolarHBondContact O-CB 3.34Å; F236-D239 PolarHBondContact O-N 3.48Å; F236-L240 PolarHBondContact O-N 3.42Å; F236-L341 HydrophobicContact CB-CD1 3.69Å; F236-L341 HydrophobicContact CB-CD2 3.66Å; F236-L341 HydrophobicContact CB-CG 4.33Å; F236-L341 HydrophobicContact CD1-CD2 4.24Å; F236-L341 HydrophobicContact CD2-CD2 3.66Å; F236-L341 HydrophobicContact CE2-CD2 4.43Å; F236-L341 HydrophobicContact CG-CD2 3.56Å; F236-K344 HydrophobicContact CD2-CD 4.49Å; F236-K344 HydrophobicContact CE2-CD 3.77Å; F236-K344 HydrophobicContact CZ-CD 4.29Å
237F97.4Very high95.6Very high0 Ų041.4 Ų41.40%022%0.217CC..G310 helixtrans-59.7-43.4-178.4-174.4-87.7000113.7A231 I234 P235 D239 L240 Q245 L248 L249 L324 F325 L404A231-F237 HydrophobicContact CB-CD1 4.21Å; A231-F237 HydrophobicContact CB-CE1 4.06Å; A231-F237 HydrophobicContact CB-CZ 4.31Å; A231-F237 WeakPolarHBondContact O-CD1 3.42Å; A231-F237 WeakPolarHBondContact O-CG 3.49Å; I234-F237 HydrophobicContact CD1-CB 3.98Å; I234-F237 HydrophobicContact CG1-CB 3.76Å; P235-F237 PolarHBondContact O-N 2.88Å; F237-D239 PolarHBondContact O-N 3.08Å; F237-L240 HydrophobicContact CD2-CD1 4.1Å; F237-L240 WeakPolarHBondContact O-CB 3.36Å; F237-L240 PolarHBondContact O-N 3.37Å; F237-Q245 HydrophobicContact CD1-CG 4.09Å; F237-Q245 HydrophobicContact CE1-CB 3.73Å; F237-Q245 HydrophobicContact CE1-CG 3.64Å; F237-Q245 HydrophobicContact CE2-CB 4.29Å; F237-Q245 HydrophobicContact CE2-CG 4.3Å; F237-Q245 HydrophobicContact CZ-CB 3.52Å; F237-Q245 HydrophobicContact CZ-CG 3.76Å; F237-Q245 WeakPolarHBondContact O-CG 3.35Å; F237-Q245 PolarHBondContact O-NE2 3.21Å; F237-L248 HydrophobicContact CD2-CD1 4.43Å; F237-L248 HydrophobicContact CE2-CB 4.32Å; F237-L248 HydrophobicContact CE2-CD1 4.04Å; F237-L249 HydrophobicContact CE1-CD1 3.99Å; F237-L249 HydrophobicContact CE2-CG 4.43Å; F237-L249 HydrophobicContact CZ-CD1 3.54Å; F237-L249 HydrophobicContact CZ-CG 3.88Å; F237-L324 HydrophobicContact CD2-CD1 4.3Å; F237-L324 HydrophobicContact CD2-CD2 3.79Å; F237-L324 HydrophobicContact CD2-CG 4.07Å; F237-L324 HydrophobicContact CE2-CD1 3.77Å; F237-L324 HydrophobicContact CE2-CD2 4.03Å; F237-L324 HydrophobicContact CE2-CG 4.05Å; F237-L324 HydrophobicContact CG-CD2 4.38Å; F237-L324 HydrophobicContact CZ-CD1 4.47Å; F237-F325 HydrophobicContact CB-CE1 4.03Å; F237-F325 HydrophobicContact CB-CZ 4.06Å; F237-F325 HydrophobicContact CD2-CE1 4.02Å; F237-L404 HydrophobicContact CE1-CD2 4.36Å
238P96Very high95.7Very high62 Ų6241.2 Ų41.240%0.40322%0.216SC..G310 helixtrans-68.1-17.3175.6-21.635.6000114.3R232 I234 Q245R232-P238 WeakPolarHBondContact O-CG 3.33Å; I234-P238 WeakPolarHBondContact O-CD 3.43Å; P238-Q245 PolarHBondContact O-NE2 3.2Å
239D94.8Very high95.9Very high130 Ų13041.1 Ų41.170%0.69522%0.215SC*.G310 helixtrans-83.3-12.8176.9-55.3-58.4000112.1F236 F237F236-D239 WeakPolarHBondContact CA-OD2 3.21Å; F236-D239 WeakPolarHBondContact O-CB 3.34Å; F236-D239 PolarHBondContact O-N 3.48Å; F237-D239 PolarHBondContact O-N 3.08Å
240L95.9Very high96Very high16 Ų1642.2 Ų42.28%0.08422%0.216CC..SBendtrans-72.9157.7174.9-59.7179000111.4F236 F237 Q245 L248 F325 L341F236-L240 PolarHBondContact O-N 3.42Å; F237-L240 HydrophobicContact CD2-CD1 4.1Å; F237-L240 WeakPolarHBondContact O-CB 3.36Å; F237-L240 PolarHBondContact O-N 3.37Å; L240-Q245 HydrophobicContact CB-CG 3.95Å; L240-Q245 PolarHBondContact O-NE2 2.91Å; L240-L248 HydrophobicContact CD1-CD1 3.75Å; L240-F325 HydrophobicContact CD1-CE1 4.23Å; L240-L341 HydrophobicContact CD2-CD1 4.25Å
241Q95.4Very high96Very high119 Ų11945.7 Ų45.756%0.55623%0.234SC*.  trans-61.6143.9172.8-59.2-162.543.800110.9T243 D244 Q245 S333Q241-T243 WeakPolarHBondContact CB-OG1 3.46Å; Q241-T243 PolarHBondContact O-N 3.05Å; Q241-D244 HydrophobicContact CB-CB 4.48Å; Q241-D244 WeakPolarHBondContact O-CA 3.31Å; Q241-D244 WeakPolarHBondContact O-CB 3.29Å; Q241-D244 PolarHBondContact O-N 3.37Å; Q241-Q245 PolarHBondContact O-N 3.07Å; Q241-S333 PolarHBondContact NE2-OG 2.95Å
242I94.8Very high96Very high75 Ų7545.7 Ų45.739%0.38523%0.234SC..Hα-helixtrans-61.1-28.6-178-168.360.7000112.7Q245 V246 L404 L405I242-Q245 HydrophobicContact CD1-CB 4.46Å; I242-V246 WeakPolarHBondContact O-CB 3.5Å; I242-V246 VanDerWaalsContact O-CG2 3.22Å; I242-V246 WeakPolarHBondContact O-CG2 3.26Å; I242-V246 PolarHBondContact O-N 3.14Å; I242-L404 HydrophobicContact CD1-CB 4.31Å; I242-L405 HydrophobicContact CD1-CD2 4.4Å; I242-L405 HydrophobicContact CG1-CD2 3.9Å
243T95.1Very high96.1Very high80 Ų8040.9 Ų40.949%0.49122%0.216SC..Hα-helixtrans-59.2-47.6169.843.90000111.9Q241 V246 A247Q241-T243 WeakPolarHBondContact CB-OG1 3.46Å; Q241-T243 PolarHBondContact O-N 3.05Å; T243-V246 PolarHBondContact O-N 2.8Å; T243-A247 VanDerWaalsContact O-CB 3.31Å; T243-A247 WeakPolarHBondContact O-CB 3.43Å; T243-A247 PolarHBondContact O-N 2.99Å
244D97.1Very high96.2Very high4 Ų436.9 Ų36.92%0.02120%0.196CC..Hα-helixtrans-70.8-44-178.2-61.531000109.8Q241 V246 A247 L248 L332 S333Q241-D244 HydrophobicContact CB-CB 4.48Å; Q241-D244 WeakPolarHBondContact O-CA 3.31Å; Q241-D244 WeakPolarHBondContact O-CB 3.29Å; Q241-D244 PolarHBondContact O-N 3.37Å; D244-V246 VanDerWaalsContact C-N 3.33Å; D244-V246 PolarHBondContact O-N 3Å; D244-A247 PolarHBondContact O-N 3.49Å; D244-L248 WeakPolarHBondContact O-CB 3.47Å; D244-L248 VanDerWaalsContact O-CG 3.24Å; D244-L248 WeakPolarHBondContact O-CG 3.39Å; D244-L248 PolarHBondContact O-N 3.44Å; D244-L332 HydrophobicContact CB-CD2 3.88Å; D244-S333 WeakPolarHBondContact OD1-CB 3.13Å; D244-S333 PolarHBondContact OD1-N 3.05Å; D244-S333 PolarHBondContact OD1-OG 2.98Å; D244-S333 VanDerWaalsContact OD2-CB 3.29Å; D244-S333 WeakPolarHBondContact OD2-CB 3.19Å; D244-S333 PolarHBondContact OD2-N 3Å; D244-S333 PolarHBondContact OD2-OG 3.36Å
245Q97.4Very high96.2Very high19 Ų1937.2 Ų37.29%0.08920%0.198CC..Hα-helixtrans-55.4-46.5173.7-67.2-175.640.500111.9F237 P238 L240 Q241 I242 L249F237-Q245 HydrophobicContact CD1-CG 4.09Å; F237-Q245 HydrophobicContact CE1-CB 3.73Å; F237-Q245 HydrophobicContact CE1-CG 3.64Å; F237-Q245 HydrophobicContact CE2-CB 4.29Å; F237-Q245 HydrophobicContact CE2-CG 4.3Å; F237-Q245 HydrophobicContact CZ-CB 3.52Å; F237-Q245 HydrophobicContact CZ-CG 3.76Å; F237-Q245 WeakPolarHBondContact O-CG 3.35Å; F237-Q245 PolarHBondContact O-NE2 3.21Å; P238-Q245 PolarHBondContact O-NE2 3.2Å; L240-Q245 HydrophobicContact CB-CG 3.95Å; L240-Q245 PolarHBondContact O-NE2 2.91Å; Q241-Q245 PolarHBondContact O-N 3.07Å; I242-Q245 HydrophobicContact CD1-CB 4.46Å; Q245-L249 PolarHBondContact O-N 3.13Å; Q245-L249 VanDerWaalsContact O-N 3.15Å
246V96.3Very high96.4Very high18 Ų1836.3 Ų36.311%0.10919%0.191CC..Hα-helixtrans-67.8-40.3176.9169.20000111.4I242 T243 D244 R250 R401 L404I242-V246 WeakPolarHBondContact O-CB 3.5Å; I242-V246 VanDerWaalsContact O-CG2 3.22Å; I242-V246 WeakPolarHBondContact O-CG2 3.26Å; I242-V246 PolarHBondContact O-N 3.14Å; T243-V246 PolarHBondContact O-N 2.8Å; D244-V246 VanDerWaalsContact C-N 3.33Å; D244-V246 PolarHBondContact O-N 3Å; V246-R250 HydrophobicContact CG1-CG 4.26Å; V246-R250 WeakPolarHBondContact O-CB 3.49Å; V246-R250 WeakPolarHBondContact O-CG 3.48Å; V246-R250 PolarHBondContact O-N 2.93Å; V246-R401 HydrophobicContact CG1-CB 4.31Å; V246-R401 HydrophobicContact CG1-CG 4.45Å; V246-R401 HydrophobicContact CG2-CG 4.36Å; V246-L404 HydrophobicContact CB-CD1 4.43Å; V246-L404 HydrophobicContact CG2-CB 4.43Å; V246-L404 HydrophobicContact CG2-CD1 3.69Å
247A97.1Very high96.6Very high23 Ų2335.4 Ų35.419%0.1919%0.188CC..Hα-helixtrans-65.3-45.7179.200000112.4T243 D244 L251 A329T243-A247 VanDerWaalsContact O-CB 3.31Å; T243-A247 WeakPolarHBondContact O-CB 3.43Å; T243-A247 PolarHBondContact O-N 2.99Å; D244-A247 PolarHBondContact O-N 3.49Å; A247-L251 PolarHBondContact O-N 3.11Å; A247-A329 HydrophobicContact CB-CB 4.46Å
248L98.3Very high96.6Very high0 Ų035.4 Ų35.40%019%0.188CC..Hα-helixtrans-60-57.4176.5-67.2171.1000110.7F237 L240 D244 R250 L251 T252 L324 T326 A329 L332 V338F237-L248 HydrophobicContact CD2-CD1 4.43Å; F237-L248 HydrophobicContact CE2-CB 4.32Å; F237-L248 HydrophobicContact CE2-CD1 4.04Å; L240-L248 HydrophobicContact CD1-CD1 3.75Å; D244-L248 WeakPolarHBondContact O-CB 3.47Å; D244-L248 VanDerWaalsContact O-CG 3.24Å; D244-L248 WeakPolarHBondContact O-CG 3.39Å; D244-L248 PolarHBondContact O-N 3.44Å; L248-R250 VanDerWaalsContact C-N 3.31Å; L248-R250 PolarHBondContact O-N 3.41Å; L248-L251 PolarHBondContact O-N 3.39Å; L248-T252 WeakPolarHBondContact O-CG2 3.32Å; L248-T252 PolarHBondContact O-N 2.89Å; L248-T252 PolarHBondContact O-OG1 2.67Å; L248-L324 HydrophobicContact CB-CD1 4.2Å; L248-L324 WeakPolarHBondContact CD2-O 3.42Å; L248-T326 HydrophobicContact CD2-CG2 4.29Å; L248-T326 WeakPolarHBondContact CD2-O 3.5Å; L248-A329 HydrophobicContact CD2-CB 3.84Å; L248-L332 HydrophobicContact CD1-CD2 4.47Å; L248-L332 HydrophobicContact CD2-CD1 4.34Å; L248-L332 HydrophobicContact CD2-CD2 3.87Å; L248-L332 HydrophobicContact CG-CD2 3.93Å; L248-V338 HydrophobicContact CD2-CG1 4.19Å
249L97.6Very high96.6Very high1 Ų132.5 Ų32.51%0.00517%0.169CC..Hα-helixtrans-63.5-34.2-177.2-80.3167.6000113.1V228 A231 F237 Q245 L251 T252 W253 L256 L324 I400 L404V228-L249 HydrophobicContact CG1-CD1 4.4Å; A231-L249 HydrophobicContact CB-CD1 3.96Å; A231-L249 HydrophobicContact CB-CD2 3.95Å; A231-L249 HydrophobicContact CB-CG 4.38Å; F237-L249 HydrophobicContact CE1-CD1 3.99Å; F237-L249 HydrophobicContact CE2-CG 4.43Å; F237-L249 HydrophobicContact CZ-CD1 3.54Å; F237-L249 HydrophobicContact CZ-CG 3.88Å; Q245-L249 PolarHBondContact O-N 3.13Å; Q245-L249 VanDerWaalsContact O-N 3.15Å; L249-L251 VanDerWaalsContact C-N 3.31Å; L249-L251 PolarHBondContact O-N 2.99Å; L249-T252 PolarHBondContact O-N 2.66Å; L249-W253 WeakPolarHBondContact O-CB 3.49Å; L249-W253 PolarHBondContact O-N 3.01Å; L249-L256 HydrophobicContact CD2-CD1 3.86Å; L249-L324 HydrophobicContact CD2-CD1 3.66Å; L249-L324 HydrophobicContact CG-CD1 3.84Å; L249-I400 HydrophobicContact CB-CG2 3.71Å; L249-L404 HydrophobicContact CB-CD1 4.48Å; L249-L404 HydrophobicContact CD1-CD1 3.73Å; L249-L404 HydrophobicContact CD1-CD2 3.68Å; L249-L404 HydrophobicContact CD1-CG 4.16Å
250R95.8Very high96.6Very high90 Ų9026.5 Ų26.534%0.3414%0.136SC..Hα-helixtrans-63.9-33.5173.9-78.7178.2164.9-168.7-12.6113.5V246 L248 E397V246-R250 HydrophobicContact CG1-CG 4.26Å; V246-R250 WeakPolarHBondContact O-CB 3.49Å; V246-R250 WeakPolarHBondContact O-CG 3.48Å; V246-R250 PolarHBondContact O-N 2.93Å; L248-R250 VanDerWaalsContact C-N 3.31Å; L248-R250 PolarHBondContact O-N 3.41Å; R250-E397 HydrophobicContact CB-CB 4.48Å; R250-E397 HydrophobicContact CB-CG 4.19Å; R250-E397 HydrophobicContact CG-CB 3.84Å; R250-E397 HydrophobicContact CG-CG 4.08Å; R250-E397 VanDerWaalsContact CZ-O 3.25Å; R250-E397 PolarHBondContact NE-O 3.15Å; R250-E397 PolarHBondContact NH2-O 3.25Å
251L96.4Very high96.5Very high74 Ų7425.7 Ų25.739%0.38713%0.132SC..Hα-helixtrans-78-38.6175.6179.759000111.9A247 L248 L249 T326 D328 A329A247-L251 PolarHBondContact O-N 3.11Å; L248-L251 PolarHBondContact O-N 3.39Å; L249-L251 VanDerWaalsContact C-N 3.31Å; L249-L251 PolarHBondContact O-N 2.99Å; L251-T326 HydrophobicContact CD2-CG2 3.83Å; L251-D328 HydrophobicContact CD2-CB 3.69Å; L251-A329 HydrophobicContact CD2-CB 4.08Å
252T97.4Very high96.5Very high0 Ų020.1 Ų20.10%011%0.107CC..Hα-helixtrans-103.8-3.8-16470.60000115.2L248 L249 S254 E255 L256 V323 T326L248-T252 WeakPolarHBondContact O-CG2 3.32Å; L248-T252 PolarHBondContact O-N 2.89Å; L248-T252 PolarHBondContact O-OG1 2.67Å; L249-T252 PolarHBondContact O-N 2.66Å; T252-S254 VanDerWaalsContact C-N 3.28Å; T252-S254 PolarHBondContact O-N 2.81Å; T252-E255 PolarHBondContact O-N 3.48Å; T252-L256 WeakPolarHBondContact O-CG 3.42Å; T252-L256 PolarHBondContact O-N 2.99Å; T252-V323 HydrophobicContact CG2-CG1 4.33Å; T252-V323 VanDerWaalsContact CG2-O 3.22Å; T252-V323 WeakPolarHBondContact CG2-O 3.33Å; T252-T326 HydrophobicContact CG2-CG2 3.61Å
253W96.9Very high96.4Very high5 Ų517.7 Ų17.72%0.0199%0.094CC..Hα-helixtrans-59.7-35-172.774.9-95.5000114.1L224 L249 F257 I382 E383 F387 I396 E397 I400L224-W253 HydrophobicContact CD1-CB 4.5Å; L224-W253 HydrophobicContact CD1-CE3 3.97Å; L249-W253 WeakPolarHBondContact O-CB 3.49Å; L249-W253 PolarHBondContact O-N 3.01Å; W253-F257 HydrophobicContact CE3-CB 4.49Å; W253-F257 VanDerWaalsContact O-CB 3.27Å; W253-F257 WeakPolarHBondContact O-CB 3.37Å; W253-F257 PolarHBondContact O-N 3.29Å; W253-I382 HydrophobicContact CH2-CB 4.17Å; W253-I382 HydrophobicContact CH2-CG2 3.98Å; W253-I382 HydrophobicContact CZ3-CB 4.24Å; W253-I382 HydrophobicContact CZ3-CG2 3.65Å; W253-E383 HydrophobicContact CH2-CG 3.79Å; W253-E383 HydrophobicContact CZ2-CG 3.93Å; W253-F387 HydrophobicContact CZ3-CE2 4.46Å; W253-I396 HydrophobicContact CD2-CB 4.47Å; W253-I396 HydrophobicContact CD2-CG2 3.66Å; W253-I396 HydrophobicContact CE3-CG2 3.88Å; W253-I396 HydrophobicContact CG-CG2 4.23Å; W253-I396 HydrophobicContact CH2-CB 3.98Å; W253-I396 HydrophobicContact CH2-CG1 3.91Å; W253-I396 HydrophobicContact CH2-CG2 3.97Å; W253-I396 HydrophobicContact CZ2-CB 3.64Å; W253-I396 HydrophobicContact CZ2-CG1 4.04Å; W253-I396 HydrophobicContact CZ2-CG2 3.75Å; W253-I396 HydrophobicContact CZ3-CG1 4.47Å; W253-I396 HydrophobicContact CZ3-CG2 4.03Å; W253-E397 PolarHBondContact NE1-OE1 3.18Å; W253-I400 HydrophobicContact CB-CD1 3.42Å; W253-I400 VanDerWaalsContact CB-CD1 3.42Å; W253-I400 HydrophobicContact CD2-CD1 4.24Å; W253-I400 HydrophobicContact CG-CD1 3.45Å; W253-I400 VanDerWaalsContact CG-CD1 3.45Å
254S96.9Very high96.1Very high16 Ų1614.4 Ų14.411%0.1127%0.074CC..Hα-helixtrans-67.3-46.1177.850.90000111.5T252 L256 F257 V258T252-S254 VanDerWaalsContact C-N 3.28Å; T252-S254 PolarHBondContact O-N 2.81Å; S254-L256 PolarHBondContact O-N 3.18Å; S254-F257 WeakPolarHBondContact O-CB 3.42Å; S254-F257 PolarHBondContact O-N 3.43Å; S254-V258 WeakPolarHBondContact O-CG2 3.44Å; S254-V258 PolarHBondContact O-N 3.07Å
255E97.8Very high95.6Very high11 Ų1116.6 Ų16.65%0.0519%0.089CC..Hα-helixtrans-61.6-43.2175-64-165.1-129.700111.4T252 F257 V258 L259 V323 L374 R375T252-E255 PolarHBondContact O-N 3.48Å; E255-F257 VanDerWaalsContact C-N 3.35Å; E255-F257 PolarHBondContact O-N 2.9Å; E255-V258 PolarHBondContact O-N 2.93Å; E255-L259 WeakPolarHBondContact O-CG 3.43Å; E255-L259 PolarHBondContact O-N 3.38Å; E255-V323 HydrophobicContact CB-CG1 3.59Å; E255-L374 HydrophobicContact CB-CB 4.15Å; E255-L374 HydrophobicContact CB-CD1 4.08Å; E255-L374 HydrophobicContact CG-CB 3.88Å; E255-R375 HydrophobicContact CG-CG 4.27Å; E255-R375 WeakPolarHBondContact OE1-CG 3.21Å; E255-R375 IonicContact OE1-CZ 3.94Å; E255-R375 IonicContact OE1-NE 3.14Å; E255-R375 PolarHBondContact OE1-NE 2.87Å; E255-R375 IonicContact OE1-NH2 3.95Å; E255-R375 PolarHBondContact OE1-NH2 2.91Å
256L97.4Very high95.2Very high1 Ų115.8 Ų15.81%0.0059%0.086CC..Hα-helixtrans-63.7-37.6174.2-67.2172.7000112.4A227 L249 T252 S254 L259 N260 K320 V323 L324A227-L256 HydrophobicContact CB-CB 4.22Å; L249-L256 HydrophobicContact CD2-CD1 3.86Å; T252-L256 WeakPolarHBondContact O-CG 3.42Å; T252-L256 PolarHBondContact O-N 2.99Å; S254-L256 PolarHBondContact O-N 3.18Å; L256-L259 PolarHBondContact O-N 3.09Å; L256-N260 WeakPolarHBondContact O-CB 3.5Å; L256-N260 PolarHBondContact O-N 3.36Å; L256-K320 HydrophobicContact CD2-CB 3.73Å; L256-K320 HydrophobicContact CD2-CG 3.98Å; L256-V323 HydrophobicContact CD2-CB 4.41Å; L256-V323 HydrophobicContact CD2-CG1 3.99Å; L256-V323 HydrophobicContact CG-CG1 4.05Å; L256-L324 HydrophobicContact CD1-CD1 4.29Å
257F96.7Very high94.6Very high0 Ų016 Ų160%09%0.087CC..Hα-helixtrans-65.2-41.6175.3-177.2-85.6000111.8A220 M223 W253 S254 E255 N260 A261 M266 F299 I382 F386 F387A220-F257 HydrophobicContact CB-CE2 3.82Å; A220-F257 HydrophobicContact CB-CZ 3.73Å; M223-F257 HydrophobicContact CB-CD2 4.45Å; M223-F257 HydrophobicContact CB-CE2 4.28Å; M223-F257 HydrophobicContact CE-CD2 4.21Å; M223-F257 HydrophobicContact CE-CE1 4.16Å; M223-F257 HydrophobicContact CE-CE2 3.83Å; M223-F257 HydrophobicContact CE-CZ 3.8Å; W253-F257 HydrophobicContact CE3-CB 4.49Å; W253-F257 VanDerWaalsContact O-CB 3.27Å; W253-F257 WeakPolarHBondContact O-CB 3.37Å; W253-F257 PolarHBondContact O-N 3.29Å; S254-F257 WeakPolarHBondContact O-CB 3.42Å; S254-F257 PolarHBondContact O-N 3.43Å; E255-F257 VanDerWaalsContact C-N 3.35Å; E255-F257 PolarHBondContact O-N 2.9Å; F257-N260 PolarHBondContact O-N 3.34Å; F257-A261 WeakPolarHBondContact O-CB 3.33Å; F257-A261 PolarHBondContact O-N 3.42Å; F257-M266 HydrophobicContact CE1-SD 4.48Å; F257-M266 HydrophobicContact CZ-CE 4.33Å; F257-M266 HydrophobicContact CZ-SD 4.32Å; F257-F299 HydrophobicContact CD1-CZ 4.23Å; F257-F299 HydrophobicContact CE1-CE1 4.26Å; F257-F299 AromaticContact CE1-CZ 3.83Å; F257-F299 HydrophobicContact CE1-CZ 3.83Å; F257-I382 HydrophobicContact CD1-CD1 3.98Å; F257-I382 HydrophobicContact CD1-CG1 4.3Å; F257-I382 HydrophobicContact CD1-CG2 3.62Å; F257-I382 HydrophobicContact CD2-CG2 4.36Å; F257-I382 HydrophobicContact CE1-CG2 3.63Å; F257-I382 HydrophobicContact CE2-CG2 4.37Å; F257-I382 HydrophobicContact CG-CG2 4.01Å; F257-I382 HydrophobicContact CZ-CG2 4.03Å; F257-F386 HydrophobicContact CE1-CD2 4.01Å; F257-F386 AromaticContact CE1-CE2 3.95Å; F257-F386 HydrophobicContact CE1-CE2 3.95Å; F257-F386 AromaticContact CZ-CD2 3.8Å; F257-F386 HydrophobicContact CZ-CD2 3.8Å; F257-F386 HydrophobicContact CZ-CE2 4.09Å; F257-F386 HydrophobicContact CZ-CG 4.35Å; F257-F387 HydrophobicContact CD2-CE2 4.38Å; F257-F387 HydrophobicContact CD2-CZ 4.34Å; F257-F387 AromaticContact CE2-CE2 3.86Å; F257-F387 HydrophobicContact CE2-CE2 3.86Å; F257-F387 AromaticContact CE2-CZ 3.82Å; F257-F387 HydrophobicContact CE2-CZ 3.82Å; F257-F387 HydrophobicContact CZ-CE2 4.28Å
258V96.9Very high94Very high0 Ų015.7 Ų15.70%08%0.083CC..Hα-helixtrans-64-41.2175.4177.90000111.2S254 E255 A261 A262 F299 Q302 V303 L306 L374 V377 I382S254-V258 WeakPolarHBondContact O-CG2 3.44Å; S254-V258 PolarHBondContact O-N 3.07Å; E255-V258 PolarHBondContact O-N 2.93Å; V258-A261 PolarHBondContact O-N 3.48Å; V258-A262 PolarHBondContact O-N 3.14Å; V258-A262 VanDerWaalsContact O-N 3.07Å; V258-F299 HydrophobicContact CB-CE2 4.28Å; V258-F299 HydrophobicContact CG1-CD2 4.46Å; V258-F299 HydrophobicContact CG1-CE2 4.18Å; V258-F299 HydrophobicContact CG2-CD2 4.08Å; V258-F299 HydrophobicContact CG2-CE2 3.81Å; V258-Q302 HydrophobicContact CG1-CB 4.36Å; V258-V303 HydrophobicContact CG1-CG2 4.29Å; V258-L306 HydrophobicContact CG1-CD1 4.4Å; V258-L374 HydrophobicContact CB-CD2 4.29Å; V258-L374 HydrophobicContact CG1-CD2 3.76Å; V258-V377 HydrophobicContact CG2-CB 3.94Å; V258-V377 HydrophobicContact CG2-CG1 4.04Å; V258-V377 HydrophobicContact CG2-CG2 4.09Å; V258-I382 HydrophobicContact CG2-CD1 4.24Å
259L97.1Very high93.2Very high0 Ų021 Ų210%011%0.107CC..Hα-helixtrans-61.5-46.8174-70.8172.6000111.7E255 L256 A261 A262 Q263 L306 Y316 L319 K320 V323 L374E255-L259 WeakPolarHBondContact O-CG 3.43Å; E255-L259 PolarHBondContact O-N 3.38Å; L256-L259 PolarHBondContact O-N 3.09Å; L259-A261 VanDerWaalsContact C-N 3.33Å; L259-A261 PolarHBondContact O-N 3.49Å; L259-A262 PolarHBondContact O-N 3.37Å; L259-Q263 WeakPolarHBondContact O-CB 3.47Å; L259-Q263 PolarHBondContact O-N 3.17Å; L259-L306 HydrophobicContact CD2-CD1 4.14Å; L259-L306 HydrophobicContact CD2-CD2 4.29Å; L259-Y316 HydrophobicContact CD2-CD1 4.28Å; L259-Y316 HydrophobicContact CD2-CE1 4.36Å; L259-L319 HydrophobicContact CD1-CB 4.25Å; L259-L319 HydrophobicContact CD2-CB 4.32Å; L259-K320 HydrophobicContact CB-CG 4.37Å; L259-K320 HydrophobicContact CD1-CG 4Å; L259-V323 HydrophobicContact CD1-CG2 4.14Å; L259-L374 HydrophobicContact CD1-CD1 4.21Å; L259-L374 HydrophobicContact CD2-CD1 4.14Å; L259-L374 HydrophobicContact CD2-CD2 4.5Å; L259-L374 HydrophobicContact CG-CD1 3.97Å
260N95Very high92.4Very high4 Ų423.2 Ų23.22%0.02112%0.121CC..Hα-helixtrans-61.7-39.1174.6-77.8-5.3000111.8M223 L256 F257 A262 Q263 C264 K320M223-N260 HydrophobicContact CB-CB 4.28Å; M223-N260 HydrophobicContact CE-CB 4.21Å; M223-N260 HydrophobicContact CG-CB 4.33Å; M223-N260 PolarHBondContact O-ND2 2.97Å; L256-N260 WeakPolarHBondContact O-CB 3.5Å; L256-N260 PolarHBondContact O-N 3.36Å; F257-N260 PolarHBondContact O-N 3.34Å; N260-A262 VanDerWaalsContact C-N 3.34Å; N260-A262 PolarHBondContact O-N 2.87Å; N260-Q263 PolarHBondContact O-N 3.01Å; N260-C264 VanDerWaalsContact O-CB 3.24Å; N260-C264 WeakPolarHBondContact O-CB 3.48Å; N260-C264 PolarHBondContact O-N 3.14Å; N260-C264 PolarHBondContact O-SG 3.48Å; N260-K320 WeakPolarHBondContact OD1-CE 3.27Å; N260-K320 PolarHBondContact OD1-NZ 2.84Å
261A93.7Very high91.5Very high0 Ų022.5 Ų22.50%013%0.134CC..Hα-helixtrans-63.3-39.2178.900000112.4M223 F257 V258 L259 S265 M266 F299 V303M223-A261 VanDerWaalsContact CE-CA 3.45Å; M223-A261 HydrophobicContact CE-CB 3.67Å; F257-A261 WeakPolarHBondContact O-CB 3.33Å; F257-A261 PolarHBondContact O-N 3.42Å; V258-A261 PolarHBondContact O-N 3.48Å; L259-A261 VanDerWaalsContact C-N 3.33Å; L259-A261 PolarHBondContact O-N 3.49Å; A261-S265 PolarHBondContact O-N 3.43Å; A261-M266 HydrophobicContact CB-CB 4.11Å; A261-M266 HydrophobicContact CB-SD 4.02Å; A261-M266 WeakPolarHBondContact O-CB 3.15Å; A261-M266 PolarHBondContact O-N 3.4Å; A261-F299 HydrophobicContact CB-CE2 4.03Å; A261-F299 HydrophobicContact CB-CZ 3.74Å; A261-V303 HydrophobicContact CB-CG2 4.01Å
262A94.4Very high90.7Very high2 Ų220.1 Ų20.12%0.01712%0.123CC..Hα-helixtrans-70.2-47.3173.900000112V258 L259 N260 C264 S265 V303 L306 Y316V258-A262 PolarHBondContact O-N 3.14Å; V258-A262 VanDerWaalsContact O-N 3.07Å; L259-A262 PolarHBondContact O-N 3.37Å; N260-A262 VanDerWaalsContact C-N 3.34Å; N260-A262 PolarHBondContact O-N 2.87Å; A262-C264 PolarHBondContact O-N 3.01Å; A262-S265 PolarHBondContact O-N 3.01Å; A262-S265 VanDerWaalsContact O-N 3.08Å; A262-V303 HydrophobicContact CB-CG1 4.28Å; A262-V303 HydrophobicContact CB-CG2 4.42Å; A262-L306 HydrophobicContact CB-CB 3.72Å; A262-L306 HydrophobicContact CB-CD1 3.64Å; A262-L306 HydrophobicContact CB-CG 4.33Å; A262-Y316 HydrophobicContact CB-CE1 4.13Å; A262-Y316 VanDerWaalsContact CB-OH 3.29Å; A262-Y316 WeakPolarHBondContact CB-OH 3.4Å
263Q92.8Very high89.9Confident24 Ų2420.1 Ų20.111%0.11212%0.123CC..Hα-helixtrans-62.1-39.3179.6-169.4178.818.700112.9T197 L259 N260 S265 Y316T197-Q263 HydrophobicContact CG2-CG 4.16Å; T197-Q263 WeakPolarHBondContact CG2-O 3.17Å; L259-Q263 WeakPolarHBondContact O-CB 3.47Å; L259-Q263 PolarHBondContact O-N 3.17Å; N260-Q263 PolarHBondContact O-N 3.01Å; Q263-S265 VanDerWaalsContact C-N 3.3Å; Q263-Y316 HydrophobicContact CB-CD1 4.04Å; Q263-Y316 HydrophobicContact CB-CD2 3.83Å; Q263-Y316 HydrophobicContact CB-CE1 4.03Å; Q263-Y316 HydrophobicContact CB-CE2 3.81Å; Q263-Y316 HydrophobicContact CB-CG 3.97Å; Q263-Y316 HydrophobicContact CG-CD2 3.6Å; Q263-Y316 HydrophobicContact CG-CE2 3.94Å; Q263-Y316 HydrophobicContact CG-CG 3.93Å
264C89.3Confident89Confident10 Ų1021.4 Ų21.47%0.06813%0.13CC..THydrogen-bonded Turntrans-81.2-4.9176.5-64.50000113.7Y200 M223 N260 A262 M266Y200-C264 HydrophobicContact CD2-CB 4.46Å; Y200-C264 WeakPolarHBondContact CD2-SG 3.31Å; Y200-C264 HydrophobicContact CG-CB 4.14Å; M223-C264 HydrophobicContact SD-CB 4.2Å; N260-C264 VanDerWaalsContact O-CB 3.24Å; N260-C264 WeakPolarHBondContact O-CB 3.48Å; N260-C264 PolarHBondContact O-N 3.14Å; N260-C264 PolarHBondContact O-SG 3.48Å; A262-C264 PolarHBondContact O-N 3.01Å; C264-M266 PolarHBondContact O-N 2.65Å
265S87.4Confident87.9Confident50 Ų5022.9 Ų22.935%0.3514%0.143SC..THydrogen-bonded Turntrans49.553.7-171.5-69.60000113.1A261 A262 Q263A261-S265 PolarHBondContact O-N 3.43Å; A262-S265 PolarHBondContact O-N 3.01Å; A262-S265 VanDerWaalsContact O-N 3.08Å; Q263-S265 VanDerWaalsContact C-N 3.3Å
266M87.2Confident86.5Confident2 Ų222.5 Ų22.51%0.0114%0.142CC..  trans-58.5132-179.5-170.2178.4-172.400111.6I216 L219 A220 M223 F257 A261 C264 L268 F386I216-M266 HydrophobicContact CG2-CE 3.66Å; L219-M266 HydrophobicContact CD2-CG 4.02Å; A220-M266 HydrophobicContact CB-CE 3.95Å; M223-M266 HydrophobicContact CE-SD 3.7Å; M223-M266 HydrophobicContact SD-SD 4.12Å; F257-M266 HydrophobicContact CE1-SD 4.48Å; F257-M266 HydrophobicContact CZ-CE 4.33Å; F257-M266 HydrophobicContact CZ-SD 4.32Å; A261-M266 HydrophobicContact CB-CB 4.11Å; A261-M266 HydrophobicContact CB-SD 4.02Å; A261-M266 WeakPolarHBondContact O-CB 3.15Å; A261-M266 PolarHBondContact O-N 3.4Å; C264-M266 PolarHBondContact O-N 2.65Å; M266-L268 HydrophobicContact CE-CD2 4.42Å; M266-L268 HydrophobicContact CG-CD2 4.04Å; M266-L268 PolarHBondContact O-N 3.4Å; M266-L268 HydrophobicContact SD-CD2 3.91Å; M266-F386 HydrophobicContact CE-CD1 3.75Å; M266-F386 HydrophobicContact CE-CE1 3.3Å; M266-F386 HydrophobicContact CE-CE2 4.32Å; M266-F386 HydrophobicContact CE-CG 4.42Å; M266-F386 HydrophobicContact CE-CZ 3.65Å; M266-F386 HydrophobicContact SD-CZ 4.41Å
267P84.3Confident85.1Confident23 Ų2323.9 Ų23.915%0.14915%0.153CC..  trans-79.487.7-17830.7-34000111.5M211 I216 H269M211-P267 HydrophobicContact CB-CG 4.35Å; M211-P267 HydrophobicContact CE-CG 3.68Å; I216-P267 HydrophobicContact CD1-CG 4.47Å; I216-P267 HydrophobicContact CG1-CG 4.37Å; P267-H269 PolarHBondContact O-N 3.14Å; P267-H269 VanDerWaalsContact O-N 3.15Å
268L83.9Confident83.4Confident17 Ų1725.6 Ų25.69%0.08917%0.171CC..  trans-8573.3179.3-60.1179.4000111.6M266 L273 F299 Q300 V303 F386M266-L268 HydrophobicContact CE-CD2 4.42Å; M266-L268 HydrophobicContact CG-CD2 4.04Å; M266-L268 PolarHBondContact O-N 3.4Å; M266-L268 HydrophobicContact SD-CD2 3.91Å; L268-L273 HydrophobicContact CB-CD1 4.31Å; L268-L273 HydrophobicContact CD2-CD1 4.26Å; L268-F299 HydrophobicContact CD1-CD1 3.72Å; L268-F299 HydrophobicContact CD1-CD2 4.15Å; L268-F299 HydrophobicContact CD1-CE1 3.61Å; L268-F299 HydrophobicContact CD1-CE2 4.04Å; L268-F299 HydrophobicContact CD1-CG 3.99Å; L268-F299 HydrophobicContact CD1-CZ 3.78Å; L268-F299 HydrophobicContact CD2-CD1 3.96Å; L268-F299 HydrophobicContact CD2-CE1 3.43Å; L268-F299 VanDerWaalsContact CD2-CE1 3.43Å; L268-F299 HydrophobicContact CD2-CZ 4.08Å; L268-F299 HydrophobicContact CG-CD1 4.49Å; L268-F299 HydrophobicContact CG-CE1 4.18Å; L268-Q300 HydrophobicContact CB-CG 3.79Å; L268-Q300 HydrophobicContact CD1-CG 4.48Å; L268-Q300 WeakPolarHBondContact O-CG 3.46Å; L268-Q300 PolarHBondContact O-NE2 3.26Å; L268-V303 HydrophobicContact CD1-CB 4.14Å; L268-V303 HydrophobicContact CD1-CG1 4.32Å; L268-V303 HydrophobicContact CD1-CG2 3.89Å; L268-F386 HydrophobicContact CD2-CZ 3.9Å
269H82.3Confident81.5Confident112 Ų11227.4 Ų27.452%0.51918%0.18SC..  trans-93.6134.9175.5-65.3-71.9000112.1P267 A271 P272 L273P267-H269 PolarHBondContact O-N 3.14Å; P267-H269 VanDerWaalsContact O-N 3.15Å; H269-A271 PolarHBondContact O-N 2.74Å; H269-P272 HydrophobicContact CB-CG 4.04Å; H269-P272 WeakPolarHBondContact O-CD 3.4Å; H269-L273 WeakPolarHBondContact O-CB 3.5Å; H269-L273 VanDerWaalsContact O-CG 3.25Å; H269-L273 WeakPolarHBondContact O-CG 3.44Å; H269-L273 PolarHBondContact O-N 3.1Å
270V80.5Confident79.3Confident47 Ų4735.6 Ų35.629%0.28522%0.218SC..Hα-helixtrans-59.5-46.8-172.8-172.40000112.6L273 L274 M293 I296 Q300V270-L273 PolarHBondContact O-N 3.29Å; V270-L274 HydrophobicContact CG1-CD1 3.73Å; V270-L274 HydrophobicContact CG1-CG 4.11Å; V270-L274 WeakPolarHBondContact O-CG 3.4Å; V270-L274 PolarHBondContact O-N 2.89Å; V270-M293 HydrophobicContact CG1-CE 4.45Å; V270-M293 HydrophobicContact CG1-CG 4.37Å; V270-I296 HydrophobicContact CG1-CD1 4.38Å; V270-I296 HydrophobicContact CG2-CG2 4.07Å; V270-Q300 VanDerWaalsContact CG2-NE2 3.3Å
271A77.9Confident77.3Confident74 Ų7439.9 Ų39.961%0.61225%0.254SS*.Hα-helixtrans-65.7-48-175.300000113.9H269 L273 L274 A275H269-A271 PolarHBondContact O-N 2.74Å; A271-L273 VanDerWaalsContact C-N 3.29Å; A271-L273 PolarHBondContact O-N 3.41Å; A271-L274 PolarHBondContact O-N 3.07Å; A271-A275 PolarHBondContact O-N 3.07Å; A271-A275 VanDerWaalsContact O-N 3.08Å
272P78.9Confident75.3Confident24 Ų2443.9 Ų43.916%0.15628%0.282CS..Hα-helixtrans-56.3-39.3170.2-28.936.3000113.9I210 I213 I216 H269 A275 A276I210-P272 HydrophobicContact CG2-CG 4.1Å; I213-P272 HydrophobicContact CD1-CB 4.49Å; I213-P272 WeakPolarHBondContact CD1-O 3.48Å; I216-P272 HydrophobicContact CD1-CB 4.29Å; H269-P272 HydrophobicContact CB-CG 4.04Å; H269-P272 WeakPolarHBondContact O-CD 3.4Å; P272-A275 PolarHBondContact O-N 3.37Å; P272-A276 PolarHBondContact O-N 3.26Å
273L80.3Confident73.7Confident0 Ų049.8 Ų49.80%032%0.321CS..Hα-helixtrans-72.5-34.9-179.1-67.5176.4000113.3I213 L268 H269 V270 A271 A276 A277 I296 L385 F386I213-L273 HydrophobicContact CD1-CD2 4.3Å; L268-L273 HydrophobicContact CB-CD1 4.31Å; L268-L273 HydrophobicContact CD2-CD1 4.26Å; H269-L273 WeakPolarHBondContact O-CB 3.5Å; H269-L273 VanDerWaalsContact O-CG 3.25Å; H269-L273 WeakPolarHBondContact O-CG 3.44Å; H269-L273 PolarHBondContact O-N 3.1Å; V270-L273 PolarHBondContact O-N 3.29Å; A271-L273 VanDerWaalsContact C-N 3.29Å; A271-L273 PolarHBondContact O-N 3.41Å; L273-A276 WeakPolarHBondContact O-CB 3.38Å; L273-A276 PolarHBondContact O-N 3.42Å; L273-A277 PolarHBondContact O-N 3.15Å; L273-I296 HydrophobicContact CB-CD1 3.8Å; L273-I296 HydrophobicContact CB-CG1 4.29Å; L273-I296 HydrophobicContact CD1-CG1 4.36Å; L273-I296 HydrophobicContact CD1-CG2 3.87Å; L273-L385 HydrophobicContact CB-CD2 3.94Å; L273-L385 HydrophobicContact CD1-CD2 4.45Å; L273-L385 HydrophobicContact CD2-CD2 4.27Å; L273-L385 HydrophobicContact CG-CD2 4.44Å; L273-F386 HydrophobicContact CD2-CD1 4.45Å; L273-F386 HydrophobicContact CD2-CE1 3.49Å; L273-F386 VanDerWaalsContact CD2-CE1 3.49Å; L273-F386 HydrophobicContact CD2-CZ 3.89Å
274L77.5Confident72.3Confident33 Ų3352.9 Ų52.917%0.17334%0.336CS..Hα-helixtrans-65.1-40.1170.2-72169.7000111.4V270 A271 A276 L279 F292 M293 I296V270-L274 HydrophobicContact CG1-CD1 3.73Å; V270-L274 HydrophobicContact CG1-CG 4.11Å; V270-L274 WeakPolarHBondContact O-CG 3.4Å; V270-L274 PolarHBondContact O-N 2.89Å; A271-L274 PolarHBondContact O-N 3.07Å; L274-A276 VanDerWaalsContact C-N 3.29Å; L274-A276 PolarHBondContact O-N 3.01Å; L274-L279 HydrophobicContact CB-CD2 4.46Å; L274-L279 HydrophobicContact CD2-CD2 3.63Å; L274-F292 HydrophobicContact CD2-CD1 3.93Å; L274-M293 HydrophobicContact CD1-CG 4.09Å; L274-M293 HydrophobicContact CD1-SD 4.32Å; L274-M293 HydrophobicContact CD2-CG 3.86Å; L274-M293 HydrophobicContact CG-CG 4.47Å; L274-I296 HydrophobicContact CD2-CD1 4.22Å; L274-I296 HydrophobicContact CG-CD1 4.23Å
275A74.3Confident71.8Confident46 Ų4655.1 Ų55.138%0.3835%0.352SS..Hα-helixtrans-66.5-31173.200000112.4A271 P272A271-A275 PolarHBondContact O-N 3.07Å; A271-A275 VanDerWaalsContact O-N 3.08Å; P272-A275 PolarHBondContact O-N 3.37Å
276A69.6Low71.5Confident4 Ų456.1 Ų56.13%0.03336%0.363CS..Hα-helixtrans-60.5-49177.600000113.1I213 P272 L273 L274 G278 R389I213-A276 HydrophobicContact CD1-CB 3.38Å; I213-A276 HydrophobicContact CG1-CB 3.39Å; P272-A276 PolarHBondContact O-N 3.26Å; L273-A276 WeakPolarHBondContact O-CB 3.38Å; L273-A276 PolarHBondContact O-N 3.42Å; L274-A276 VanDerWaalsContact C-N 3.29Å; L274-A276 PolarHBondContact O-N 3.01Å; A276-G278 PolarHBondContact O-N 2.92Å; A276-R389 VanDerWaalsContact O-CD 3.28Å; A276-R389 WeakPolarHBondContact O-CD 3.31Å
277A66.8Low71.3Confident29 Ų2961.8 Ų61.824%0.2439%0.394CS..THydrogen-bonded Turntrans-77.414-172.100000113.9L273 L279 F292L273-A277 PolarHBondContact O-N 3.15Å; A277-L279 HydrophobicContact CB-CD1 3.7Å; A277-L279 PolarHBondContact O-N 3.48Å; A277-F292 HydrophobicContact CB-CD1 4.5Å; A277-F292 HydrophobicContact CB-CE1 3.54Å; A277-F292 HydrophobicContact CB-CE2 4.15Å; A277-F292 HydrophobicContact CB-CZ 3.34Å
278G60.9Low71.1Confident37 Ų3768.4 Ų68.438%0.38142%0.416SS..THydrogen-bonded Turntrans73.121171.400000115A276 H280 A281A276-G278 PolarHBondContact O-N 2.92Å; G278-H280 PolarHBondContact O-N 3.25Å; G278-A281 WeakPolarHBondContact O-CB 3.45Å; G278-A281 PolarHBondContact O-N 2.85Å
279L56.7Low71Confident37 Ų3769.7 Ų69.719%0.19442%0.424CS..THydrogen-bonded Turntrans-60.7-9.1-177.5-87.769000114.8L274 A277 V289L274-L279 HydrophobicContact CB-CD2 4.46Å; L274-L279 HydrophobicContact CD2-CD2 3.63Å; A277-L279 HydrophobicContact CB-CD1 3.7Å; A277-L279 PolarHBondContact O-N 3.48Å; L279-V289 HydrophobicContact CD2-CG1 4.09Å; L279-V289 HydrophobicContact CD2-CG2 4.1Å
280H52Low71.2Confident172 Ų17269 Ų6980%0.79643%0.428SS*.THydrogen-bonded Turntrans-90.7-10.5172.1-63.3-68.3000114.4G278G278-H280 PolarHBondContact O-N 3.25Å
281A53.3Low71.4Confident94 Ų9469 Ų6978%0.77743%0.432SS*.SBendtrans-88.4-18.6-174.100000114.3G278G278-A281 WeakPolarHBondContact O-CB 3.45Å; G278-A281 PolarHBondContact O-N 2.85Å
282S51.6Low71.6Confident84 Ų8466.1 Ų66.159%0.58741%0.406SS*.SBendtrans-160.4137.2172-176.90000109.6M284S282-M284 PolarHBondContact O-N 3.35Å
283P59.8Low72Confident127 Ų12769.1 Ų69.183%0.82542%0.419SS*.  trans-68.4103-178.627.8-34.2000111.2
284M64.9Low72.5Confident89 Ų8971.8 Ų71.844%0.43843%0.433SS..  trans-66.9153.3166-74.8-158177.300111.2S282 R288 V289S282-M284 PolarHBondContact O-N 3.35Å; M284-R288 HydrophobicContact CB-CB 4.13Å; M284-R288 HydrophobicContact CG-CB 4.43Å; M284-R288 HydrophobicContact SD-CB 3.68Å; M284-R288 HydrophobicContact SD-CG 4.46Å; M284-V289 HydrophobicContact CB-CG2 4.16Å
285S78Confident73Confident57 Ų5774 Ų7440%0.39944%0.442SS..  trans-63.7151.8166.676.60000110.4D287 R288 V289S285-D287 WeakPolarHBondContact CB-OD2 3.5Å; S285-D287 PolarHBondContact O-N 3.3Å; S285-D287 VanDerWaalsContact O-N 3.16Å; S285-D287 PolarHBondContact OG-OD2 2.77Å; S285-R288 PolarHBondContact O-N 3.5Å; S285-V289 PolarHBondContact O-N 2.97Å
286A80.3Confident73.7Confident71 Ų7171.9 Ų71.959%0.58742%0.424SS*.Hα-helixtrans-54.2-36.9-18000000112.1R288 V289 V290A286-R288 VanDerWaalsContact C-N 3.32Å; A286-R288 PolarHBondContact O-N 3.44Å; A286-V289 PolarHBondContact O-N 3.35Å; A286-V289 VanDerWaalsContact O-N 3.13Å; A286-V290 WeakPolarHBondContact O-CG2 3.36Å; A286-V290 PolarHBondContact O-N 3.45Å
287D83.3Confident74.8Confident121 Ų12179 Ų7965%0.64745%0.451SS*.Hα-helixtrans-60.5-39.2179.6-27.3-77.3000112.2S285 V290 A291S285-D287 WeakPolarHBondContact CB-OD2 3.5Å; S285-D287 PolarHBondContact O-N 3.3Å; S285-D287 VanDerWaalsContact O-N 3.16Å; S285-D287 PolarHBondContact OG-OD2 2.77Å; D287-V290 PolarHBondContact O-N 2.97Å; D287-A291 WeakPolarHBondContact O-CB 3.43Å; D287-A291 PolarHBondContact O-N 2.9Å
288R80.3Confident76.1Confident162 Ų16279.6 Ų79.661%0.61145%0.449SS*.Hα-helixtrans-69.2-38176.4-69.3-173.7178.4-162.5-0.7111.7M284 S285 A286 F292M284-R288 HydrophobicContact CB-CB 4.13Å; M284-R288 HydrophobicContact CG-CB 4.43Å; M284-R288 HydrophobicContact SD-CB 3.68Å; M284-R288 HydrophobicContact SD-CG 4.46Å; S285-R288 PolarHBondContact O-N 3.5Å; A286-R288 VanDerWaalsContact C-N 3.32Å; A286-R288 PolarHBondContact O-N 3.44Å; R288-F292 WeakPolarHBondContact O-CB 3.2Å; R288-F292 PolarHBondContact O-N 3.05Å
289V81.8Confident77.6Confident44 Ų4477.9 Ų77.927%0.26743%0.431SS..Hα-helixtrans-65.3-44.3175.7-176.80000110.2L279 M284 S285 A286 F292 M293L279-V289 HydrophobicContact CD2-CG1 4.09Å; L279-V289 HydrophobicContact CD2-CG2 4.1Å; M284-V289 HydrophobicContact CB-CG2 4.16Å; S285-V289 PolarHBondContact O-N 2.97Å; A286-V289 PolarHBondContact O-N 3.35Å; A286-V289 VanDerWaalsContact O-N 3.13Å; V289-F292 PolarHBondContact O-N 2.96Å; V289-M293 HydrophobicContact CG1-SD 4.22Å; V289-M293 VanDerWaalsContact O-CG 3.32Å; V289-M293 WeakPolarHBondContact O-CG 3.44Å; V289-M293 PolarHBondContact O-N 3.2Å
290V85.9Confident79.4Confident98 Ų9878.5 Ų78.559%0.59443%0.433SS*.Hα-helixtrans-62-46.7176.1171.50000111.4A286 D287 F292 M293 D294A286-V290 WeakPolarHBondContact O-CG2 3.36Å; A286-V290 PolarHBondContact O-N 3.45Å; D287-V290 PolarHBondContact O-N 2.97Å; V290-F292 VanDerWaalsContact C-N 3.34Å; V290-F292 PolarHBondContact O-N 3.47Å; V290-M293 PolarHBondContact O-N 3.38Å; V290-D294 PolarHBondContact O-N 3.05Å
291A84.8Confident81.4Confident45 Ų4574.8 Ų74.837%0.37242%0.416SS..Hα-helixtrans-60-42.8176.100000112.1D287 D294 H295D287-A291 WeakPolarHBondContact O-CB 3.43Å; D287-A291 PolarHBondContact O-N 2.9Å; A291-D294 PolarHBondContact O-N 3.01Å; A291-H295 PolarHBondContact O-CD2 3.18Å; A291-H295 VanDerWaalsContact O-CG 3.28Å; A291-H295 PolarHBondContact O-N 3.12Å
292F83.3Confident83.4Confident15 Ų1570.9 Ų70.97%0.06638%0.382CS..Hα-helixtrans-67.5-37177.9-159.4-97.7000112.7L274 A277 R288 V289 V290 D294 H295 I296 Q384 L385L274-F292 HydrophobicContact CD2-CD1 3.93Å; A277-F292 HydrophobicContact CB-CD1 4.5Å; A277-F292 HydrophobicContact CB-CE1 3.54Å; A277-F292 HydrophobicContact CB-CE2 4.15Å; A277-F292 HydrophobicContact CB-CZ 3.34Å; R288-F292 WeakPolarHBondContact O-CB 3.2Å; R288-F292 PolarHBondContact O-N 3.05Å; V289-F292 PolarHBondContact O-N 2.96Å; V290-F292 VanDerWaalsContact C-N 3.34Å; V290-F292 PolarHBondContact O-N 3.47Å; F292-D294 VanDerWaalsContact C-N 3.35Å; F292-H295 PolarHBondContact O-N 2.99Å; F292-I296 HydrophobicContact CD1-CD1 3.76Å; F292-I296 HydrophobicContact CD1-CG1 4.35Å; F292-I296 HydrophobicContact CE1-CD1 3.81Å; F292-I296 HydrophobicContact CE1-CG1 4.28Å; F292-I296 WeakPolarHBondContact O-CG1 3.24Å; F292-I296 PolarHBondContact O-N 3.15Å; F292-Q384 HydrophobicContact CE2-CB 3.99Å; F292-Q384 HydrophobicContact CZ-CB 4.44Å; F292-L385 HydrophobicContact CE1-CD2 3.54Å; F292-L385 HydrophobicContact CE1-CG 4.46Å; F292-L385 HydrophobicContact CZ-CD2 3.44Å; F292-L385 VanDerWaalsContact CZ-CD2 3.44Å; F292-L385 HydrophobicContact CZ-CG 3.89Å
293M86.9Confident85.5Confident86 Ų8667 Ų6742%0.42436%0.355SS..Hα-helixtrans-63.8-38.2172.2-74.1177.866.300112.3V270 L274 V289 V290 I296 R297V270-M293 HydrophobicContact CG1-CE 4.45Å; V270-M293 HydrophobicContact CG1-CG 4.37Å; L274-M293 HydrophobicContact CD1-CG 4.09Å; L274-M293 HydrophobicContact CD1-SD 4.32Å; L274-M293 HydrophobicContact CD2-CG 3.86Å; L274-M293 HydrophobicContact CG-CG 4.47Å; V289-M293 HydrophobicContact CG1-SD 4.22Å; V289-M293 VanDerWaalsContact O-CG 3.32Å; V289-M293 WeakPolarHBondContact O-CG 3.44Å; V289-M293 PolarHBondContact O-N 3.2Å; V290-M293 PolarHBondContact O-N 3.38Å; M293-I296 PolarHBondContact O-N 3.15Å; M293-R297 WeakPolarHBondContact O-CB 3.4Å; M293-R297 PolarHBondContact O-N 3.27Å
294D89.9Confident87.1Confident57 Ų5766 Ų6631%0.30534%0.339SS..Hα-helixtrans-70.2-38.3175.7-164.446.1000112.3V290 A291 F292 I296 R297 I298V290-D294 PolarHBondContact O-N 3.05Å; A291-D294 PolarHBondContact O-N 3.01Å; F292-D294 VanDerWaalsContact C-N 3.35Å; D294-I296 VanDerWaalsContact C-N 3.34Å; D294-I296 PolarHBondContact O-N 3.2Å; D294-R297 WeakPolarHBondContact O-CB 3.48Å; D294-R297 PolarHBondContact O-N 3.29Å; D294-R297 VanDerWaalsContact O-N 3.1Å; D294-R297 IonicContact OD1-CZ 3.5Å; D294-R297 IonicContact OD1-NE 3.97Å; D294-R297 PolarHBondContact OD1-NE 3.07Å; D294-R297 IonicContact OD1-NH2 2.81Å; D294-R297 PolarHBondContact OD1-NH2 3.28Å; D294-I298 VanDerWaalsContact O-CG1 3.31Å; D294-I298 WeakPolarHBondContact O-CG1 3.49Å; D294-I298 PolarHBondContact O-N 2.86Å
295H88.6Confident88.6Confident78 Ų7865.3 Ų65.336%0.36133%0.333SS..Hα-helixtrans-58.9-42.3171.1-69.1-29.2000112.8A291 F292 F299 V381A291-H295 PolarHBondContact O-CD2 3.18Å; A291-H295 VanDerWaalsContact O-CG 3.28Å; A291-H295 PolarHBondContact O-N 3.12Å; F292-H295 PolarHBondContact O-N 2.99Å; H295-F299 PolarHBondContact O-N 3.3Å; H295-V381 HydrophobicContact CB-CG1 3.84Å; H295-V381 HydrophobicContact CB-CG2 3.84Å
296I89Confident89.4Confident2 Ų262.7 Ų62.71%0.0132%0.315CS..Hα-helixtrans-61.2-45.3171.7-68.8163.7000110.6V270 L273 L274 F292 M293 D294 F299 Q300 L385V270-I296 HydrophobicContact CG1-CD1 4.38Å; V270-I296 HydrophobicContact CG2-CG2 4.07Å; L273-I296 HydrophobicContact CB-CD1 3.8Å; L273-I296 HydrophobicContact CB-CG1 4.29Å; L273-I296 HydrophobicContact CD1-CG1 4.36Å; L273-I296 HydrophobicContact CD1-CG2 3.87Å; L274-I296 HydrophobicContact CD2-CD1 4.22Å; L274-I296 HydrophobicContact CG-CD1 4.23Å; F292-I296 HydrophobicContact CD1-CD1 3.76Å; F292-I296 HydrophobicContact CD1-CG1 4.35Å; F292-I296 HydrophobicContact CE1-CD1 3.81Å; F292-I296 HydrophobicContact CE1-CG1 4.28Å; F292-I296 WeakPolarHBondContact O-CG1 3.24Å; F292-I296 PolarHBondContact O-N 3.15Å; M293-I296 PolarHBondContact O-N 3.15Å; D294-I296 VanDerWaalsContact C-N 3.34Å; D294-I296 PolarHBondContact O-N 3.2Å; I296-F299 PolarHBondContact O-N 3.12Å; I296-Q300 HydrophobicContact CG2-CG 4.25Å; I296-Q300 VanDerWaalsContact O-CG 3.3Å; I296-Q300 WeakPolarHBondContact O-CG 3.45Å; I296-Q300 PolarHBondContact O-N 3.43Å; I296-L385 HydrophobicContact CD1-CD2 4.09Å; I296-L385 HydrophobicContact CG1-CD2 3.67Å
297R92.1Very high90Very high155 Ų15562 Ų6259%0.58530%0.298SS*.Hα-helixtrans-60.6-45180-174.3177.369.9133.10.5112.3M293 D294 F299 Q300 E301M293-R297 WeakPolarHBondContact O-CB 3.4Å; M293-R297 PolarHBondContact O-N 3.27Å; D294-R297 WeakPolarHBondContact O-CB 3.48Å; D294-R297 PolarHBondContact O-N 3.29Å; D294-R297 VanDerWaalsContact O-N 3.1Å; D294-R297 IonicContact OD1-CZ 3.5Å; D294-R297 IonicContact OD1-NE 3.97Å; D294-R297 PolarHBondContact OD1-NE 3.07Å; D294-R297 IonicContact OD1-NH2 2.81Å; D294-R297 PolarHBondContact OD1-NH2 3.28Å; R297-F299 VanDerWaalsContact C-N 3.35Å; R297-F299 PolarHBondContact O-N 3.43Å; R297-Q300 WeakPolarHBondContact O-CB 3.41Å; R297-Q300 PolarHBondContact O-N 3.26Å; R297-E301 VanDerWaalsContact O-CB 3.31Å; R297-E301 WeakPolarHBondContact O-CB 3.5Å; R297-E301 PolarHBondContact O-N 2.96Å
298I93.7Very high90.6Very high41 Ų4159.6 Ų59.621%0.2130%0.296CS..Hα-helixtrans-61.1-44.2177.5-68162.7000110.3D294 E301 Q302 V377D294-I298 VanDerWaalsContact O-CG1 3.31Å; D294-I298 WeakPolarHBondContact O-CG1 3.49Å; D294-I298 PolarHBondContact O-N 2.86Å; I298-E301 PolarHBondContact O-N 3.42Å; I298-Q302 WeakPolarHBondContact O-CG 3.21Å; I298-Q302 PolarHBondContact O-N 3.4Å; I298-Q302 VanDerWaalsContact O-N 3.09Å; I298-V377 HydrophobicContact CG2-CG2 4.42Å
299F93.9Very high91.4Very high1 Ų153.8 Ų53.80%0.00428%0.276CS..Hα-helixtrans-65.9-45.5178.2-179.3-150.3000112.6F257 V258 A261 L268 H295 I296 R297 E301 Q302 V303 V377 L385 F386F257-F299 HydrophobicContact CD1-CZ 4.23Å; F257-F299 HydrophobicContact CE1-CE1 4.26Å; F257-F299 AromaticContact CE1-CZ 3.83Å; F257-F299 HydrophobicContact CE1-CZ 3.83Å; V258-F299 HydrophobicContact CB-CE2 4.28Å; V258-F299 HydrophobicContact CG1-CD2 4.46Å; V258-F299 HydrophobicContact CG1-CE2 4.18Å; V258-F299 HydrophobicContact CG2-CD2 4.08Å; V258-F299 HydrophobicContact CG2-CE2 3.81Å; A261-F299 HydrophobicContact CB-CE2 4.03Å; A261-F299 HydrophobicContact CB-CZ 3.74Å; L268-F299 HydrophobicContact CD1-CD1 3.72Å; L268-F299 HydrophobicContact CD1-CD2 4.15Å; L268-F299 HydrophobicContact CD1-CE1 3.61Å; L268-F299 HydrophobicContact CD1-CE2 4.04Å; L268-F299 HydrophobicContact CD1-CG 3.99Å; L268-F299 HydrophobicContact CD1-CZ 3.78Å; L268-F299 HydrophobicContact CD2-CD1 3.96Å; L268-F299 HydrophobicContact CD2-CE1 3.43Å; L268-F299 VanDerWaalsContact CD2-CE1 3.43Å; L268-F299 HydrophobicContact CD2-CZ 4.08Å; L268-F299 HydrophobicContact CG-CD1 4.49Å; L268-F299 HydrophobicContact CG-CE1 4.18Å; H295-F299 PolarHBondContact O-N 3.3Å; I296-F299 PolarHBondContact O-N 3.12Å; R297-F299 VanDerWaalsContact C-N 3.35Å; R297-F299 PolarHBondContact O-N 3.43Å; F299-E301 VanDerWaalsContact C-N 3.27Å; F299-E301 PolarHBondContact O-N 2.84Å; F299-Q302 PolarHBondContact O-N 3.1Å; F299-V303 HydrophobicContact CD2-CG2 3.97Å; F299-V303 HydrophobicContact CE2-CG2 3.54Å; F299-V303 HydrophobicContact CZ-CG2 4.3Å; F299-V303 PolarHBondContact O-N 3.43Å; F299-V303 VanDerWaalsContact O-N 3.14Å; F299-V377 HydrophobicContact CB-CG1 3.96Å; F299-V377 HydrophobicContact CB-CG2 4.25Å; F299-V377 HydrophobicContact CD2-CG1 3.9Å; F299-V377 HydrophobicContact CD2-CG2 4.11Å; F299-V377 HydrophobicContact CG-CG1 3.97Å; F299-L385 HydrophobicContact CD1-CD1 4.24Å; F299-F386 HydrophobicContact CD1-CE2 4.33Å; F299-F386 HydrophobicContact CD1-CZ 4.48Å; F299-F386 AromaticContact CE1-CE2 3.63Å; F299-F386 HydrophobicContact CE1-CE2 3.63Å; F299-F386 AromaticContact CE1-CZ 3.79Å; F299-F386 HydrophobicContact CE1-CZ 3.79Å
300Q93.4Very high92Very high50 Ų5059 Ų5923%0.23430%0.297CS..Hα-helixtrans-52.7-46.7171.1-73.4166.8-17.300111.4L268 V270 I296 R297 V303 E304L268-Q300 HydrophobicContact CB-CG 3.79Å; L268-Q300 HydrophobicContact CD1-CG 4.48Å; L268-Q300 WeakPolarHBondContact O-CG 3.46Å; L268-Q300 PolarHBondContact O-NE2 3.26Å; V270-Q300 VanDerWaalsContact CG2-NE2 3.3Å; I296-Q300 HydrophobicContact CG2-CG 4.25Å; I296-Q300 VanDerWaalsContact O-CG 3.3Å; I296-Q300 WeakPolarHBondContact O-CG 3.45Å; I296-Q300 PolarHBondContact O-N 3.43Å; R297-Q300 WeakPolarHBondContact O-CB 3.41Å; R297-Q300 PolarHBondContact O-N 3.26Å; Q300-V303 PolarHBondContact O-N 3.36Å; Q300-E304 WeakPolarHBondContact O-CB 3.45Å; Q300-E304 PolarHBondContact O-N 2.98Å
301E94.7Very high92.5Very high94 Ų9455 Ų5544%0.43927%0.274SS..Hα-helixtrans-65.5-40.5-175.6-160.5-164.4-178.500112.5R297 I298 F299 K305R297-E301 VanDerWaalsContact O-CB 3.31Å; R297-E301 WeakPolarHBondContact O-CB 3.5Å; R297-E301 PolarHBondContact O-N 2.96Å; I298-E301 PolarHBondContact O-N 3.42Å; F299-E301 VanDerWaalsContact C-N 3.27Å; F299-E301 PolarHBondContact O-N 2.84Å; E301-K305 HydrophobicContact CG-CD 4.24Å; E301-K305 WeakPolarHBondContact O-CB 3.45Å; E301-K305 WeakPolarHBondContact O-CD 3.24Å; E301-K305 WeakPolarHBondContact O-CG 3.41Å; E301-K305 PolarHBondContact O-N 3.01Å; E301-K305 WeakPolarHBondContact OE1-CE 3.29Å; E301-K305 IonicContact OE1-NZ 3.92Å; E301-K305 PolarHBondContact OE1-NZ 2.95Å; E301-K305 IonicContact OE2-NZ 3.94Å; E301-K305 PolarHBondContact OE2-NZ 3.49Å
302Q95.5Very high93Very high12 Ų1254.1 Ų54.16%0.05626%0.263CS..Hα-helixtrans-68.9-39.2175.9-53.5-41.8-26.100112.3V258 I298 F299 K305 L306 T376 V377V258-Q302 HydrophobicContact CG1-CB 4.36Å; I298-Q302 WeakPolarHBondContact O-CG 3.21Å; I298-Q302 PolarHBondContact O-N 3.4Å; I298-Q302 VanDerWaalsContact O-N 3.09Å; F299-Q302 PolarHBondContact O-N 3.1Å; Q302-K305 PolarHBondContact O-N 2.78Å; Q302-L306 WeakPolarHBondContact O-CG 3.47Å; Q302-L306 PolarHBondContact O-N 2.74Å; Q302-L306 VanDerWaalsContact O-N 3.13Å; Q302-T376 PolarHBondContact NE2-OG1 2.93Å; Q302-V377 HydrophobicContact CB-CG2 4.37Å; Q302-V377 HydrophobicContact CG-CG2 3.87Å
303V94.6Very high93.5Very high2 Ų256.3 Ų56.31%0.01228%0.28CS..Hα-helixtrans-62.5-43.5175.3161.40000111.3V258 A261 A262 L268 F299 Q300 L306 K307V258-V303 HydrophobicContact CG1-CG2 4.29Å; A261-V303 HydrophobicContact CB-CG2 4.01Å; A262-V303 HydrophobicContact CB-CG1 4.28Å; A262-V303 HydrophobicContact CB-CG2 4.42Å; L268-V303 HydrophobicContact CD1-CB 4.14Å; L268-V303 HydrophobicContact CD1-CG1 4.32Å; L268-V303 HydrophobicContact CD1-CG2 3.89Å; F299-V303 HydrophobicContact CD2-CG2 3.97Å; F299-V303 HydrophobicContact CE2-CG2 3.54Å; F299-V303 HydrophobicContact CZ-CG2 4.3Å; F299-V303 PolarHBondContact O-N 3.43Å; F299-V303 VanDerWaalsContact O-N 3.14Å; Q300-V303 PolarHBondContact O-N 3.36Å; V303-L306 PolarHBondContact O-N 2.82Å; V303-K307 WeakPolarHBondContact O-CG 3.39Å; V303-K307 PolarHBondContact O-N 3.16Å; V303-K307 VanDerWaalsContact O-N 3.08Å
304E94.4Very high94Very high105 Ų10552.3 Ų52.349%0.49126%0.261SS..Hα-helixtrans-73.3-34.6-179.5-152.158.1-14000112.1Q300 L306 K307 A308Q300-E304 WeakPolarHBondContact O-CB 3.45Å; Q300-E304 PolarHBondContact O-N 2.98Å; E304-L306 VanDerWaalsContact C-N 3.25Å; E304-L306 PolarHBondContact O-N 3.3Å; E304-K307 PolarHBondContact O-N 3.21Å; E304-K307 WeakPolarHBondContact OE2-CD 3.21Å; E304-K307 IonicContact OE2-NZ 3.07Å; E304-K307 PolarHBondContact OE2-NZ 2.96Å; E304-A308 VanDerWaalsContact O-CB 3.3Å; E304-A308 WeakPolarHBondContact O-CB 3.47Å; E304-A308 PolarHBondContact O-N 3.26Å
305K95.9Very high94.4Very high75 Ų7549.6 Ų49.633%0.32625%0.246SC..Hα-helixtrans-61.9-29.5170.5-77167.1-178.7164.80113.2E301 Q302E301-K305 HydrophobicContact CG-CD 4.24Å; E301-K305 WeakPolarHBondContact O-CB 3.45Å; E301-K305 WeakPolarHBondContact O-CD 3.24Å; E301-K305 WeakPolarHBondContact O-CG 3.41Å; E301-K305 PolarHBondContact O-N 3.01Å; E301-K305 WeakPolarHBondContact OE1-CE 3.29Å; E301-K305 IonicContact OE1-NZ 3.92Å; E301-K305 PolarHBondContact OE1-NZ 2.95Å; E301-K305 IonicContact OE2-NZ 3.94Å; E301-K305 PolarHBondContact OE2-NZ 3.49Å; Q302-K305 PolarHBondContact O-N 2.78Å
306L95.8Very high94.8Very high2 Ų246.4 Ų46.41%0.0123%0.231CC..Hα-helixtrans-73.8-49.8171.6-74.5164.2000111V258 L259 A262 Q302 V303 E304 A308 L309 V311 R370 L374V258-L306 HydrophobicContact CG1-CD1 4.4Å; L259-L306 HydrophobicContact CD2-CD1 4.14Å; L259-L306 HydrophobicContact CD2-CD2 4.29Å; A262-L306 HydrophobicContact CB-CB 3.72Å; A262-L306 HydrophobicContact CB-CD1 3.64Å; A262-L306 HydrophobicContact CB-CG 4.33Å; Q302-L306 WeakPolarHBondContact O-CG 3.47Å; Q302-L306 PolarHBondContact O-N 2.74Å; Q302-L306 VanDerWaalsContact O-N 3.13Å; V303-L306 PolarHBondContact O-N 2.82Å; E304-L306 VanDerWaalsContact C-N 3.25Å; E304-L306 PolarHBondContact O-N 3.3Å; L306-A308 VanDerWaalsContact C-N 3.3Å; L306-A308 PolarHBondContact O-N 3.5Å; L306-L309 PolarHBondContact O-N 2.89Å; L306-L309 VanDerWaalsContact O-N 3.13Å; L306-V311 HydrophobicContact CD2-CG2 4.46Å; L306-V311 WeakPolarHBondContact O-CG2 3.35Å; L306-R370 HydrophobicContact CD2-CB 4.03Å; L306-R370 HydrophobicContact CD2-CG 4.04Å; L306-L374 HydrophobicContact CD1-CD2 4.1Å
307K92.9Very high95.2Very high56 Ų5646.3 Ų46.324%0.24323%0.23CC..Hα-helixtrans-57.5-40.3177.4-68175.5-165.9160.40113V303 E304 L309 H310V303-K307 WeakPolarHBondContact O-CG 3.39Å; V303-K307 PolarHBondContact O-N 3.16Å; V303-K307 VanDerWaalsContact O-N 3.08Å; E304-K307 PolarHBondContact O-N 3.21Å; E304-K307 WeakPolarHBondContact OE2-CD 3.21Å; E304-K307 IonicContact OE2-NZ 3.07Å; E304-K307 PolarHBondContact OE2-NZ 2.96Å; K307-L309 PolarHBondContact O-N 3.27Å; K307-H310 WeakPolarHBondContact O-CA 3.07Å; K307-H310 PolarHBondContact O-N 3.38Å
308A95.8Very high95.5Very high71 Ų7139 Ų3959%0.58720%0.203SC*.THydrogen-bonded Turntrans-66.7-15.918000000114.5E304 L306 H310E304-A308 VanDerWaalsContact O-CB 3.3Å; E304-A308 WeakPolarHBondContact O-CB 3.47Å; E304-A308 PolarHBondContact O-N 3.26Å; L306-A308 VanDerWaalsContact C-N 3.3Å; L306-A308 PolarHBondContact O-N 3.5Å; A308-H310 VanDerWaalsContact C-N 3.31Å
309L96.1Very high95.7Very high40 Ų4037 Ų3721%0.20919%0.193CC..THydrogen-bonded Turntrans-83.6-8.5168.8-70.4175.5000112.8L306 K307 V311 R363 K366 L367 R370L306-L309 PolarHBondContact O-N 2.89Å; L306-L309 VanDerWaalsContact O-N 3.13Å; K307-L309 PolarHBondContact O-N 3.27Å; L309-V311 VanDerWaalsContact C-N 3.35Å; L309-V311 HydrophobicContact CB-CG2 3.93Å; L309-R363 PolarHBondContact O-NH1 2.96Å; L309-R363 PolarHBondContact O-NH2 2.88Å; L309-K366 HydrophobicContact CD2-CB 4.22Å; L309-K366 HydrophobicContact CD2-CD 4.32Å; L309-L367 HydrophobicContact CD1-CD2 4.29Å; L309-R370 HydrophobicContact CD1-CG 3.65Å
310H95Very high96Very high153 Ų15337.1 Ų37.171%0.70819%0.193SC*.THydrogen-bonded Turntrans48.554.8-168.8-60.5-71.2000111.5K307 A308 D312 R363K307-H310 WeakPolarHBondContact O-CA 3.07Å; K307-H310 PolarHBondContact O-N 3.38Å; A308-H310 VanDerWaalsContact C-N 3.31Å; H310-D312 PolarHBondContact O-N 3.29Å; H310-R363 PolarHBondContact O-NH2 3.48Å
311V96.7Very high96.2Very high16 Ų1634.7 Ų34.710%0.09718%0.182CC..  trans-62.9127.5176.6-174.80000109.4L306 L309 E315 Y316 L319 L367L306-V311 HydrophobicContact CD2-CG2 4.46Å; L306-V311 WeakPolarHBondContact O-CG2 3.35Å; L309-V311 VanDerWaalsContact C-N 3.35Å; L309-V311 HydrophobicContact CB-CG2 3.93Å; V311-E315 WeakPolarHBondContact CA-OE2 3.38Å; V311-E315 HydrophobicContact CG1-CB 3.62Å; V311-Y316 HydrophobicContact CB-CD2 4.08Å; V311-Y316 HydrophobicContact CB-CE1 4.32Å; V311-Y316 HydrophobicContact CB-CE2 3.65Å; V311-Y316 HydrophobicContact CG1-CD1 4.02Å; V311-Y316 HydrophobicContact CG1-CD2 3.66Å; V311-Y316 HydrophobicContact CG1-CE1 4.09Å; V311-Y316 HydrophobicContact CG1-CE2 3.75Å; V311-Y316 HydrophobicContact CG1-CG 3.78Å; V311-Y316 VanDerWaalsContact O-CE2 3.25Å; V311-Y316 WeakPolarHBondContact O-CE2 3.49Å; V311-L319 HydrophobicContact CG1-CD1 4.15Å; V311-L367 HydrophobicContact CG1-CD2 4.3Å; V311-L367 HydrophobicContact CG2-CD2 3.65Å
312D95.2Very high96.4Very high26 Ų2630.4 Ų30.414%0.13916%0.162CC..  trans-88.8175.8178.773.465.5000112.9H310 A314 E315 Y316 Y352 Y357H310-D312 PolarHBondContact O-N 3.29Å; D312-A314 PolarHBondContact O-N 3.01Å; D312-A314 WeakPolarHBondContact OD1-CA 3.37Å; D312-A314 WeakPolarHBondContact OD1-CB 3.15Å; D312-A314 PolarHBondContact OD1-N 3.21Å; D312-E315 PolarHBondContact N-OE2 3.23Å; D312-E315 VanDerWaalsContact N-OE2 3.1Å; D312-E315 PolarHBondContact O-N 3.19Å; D312-E315 PolarHBondContact OD1-N 3.49Å; D312-E315 VanDerWaalsContact OD2-CG 3.28Å; D312-E315 WeakPolarHBondContact OD2-CG 3.3Å; D312-Y316 WeakPolarHBondContact O-CB 3.31Å; D312-Y316 WeakPolarHBondContact O-CD2 3.21Å; D312-Y316 PolarHBondContact O-N 2.97Å; D312-Y352 WeakPolarHBondContact OD2-CE1 3.38Å; D312-Y357 WeakPolarHBondContact OD2-CE2 3.21Å; D312-Y357 PolarHBondContact OD2-OH 2.96Å; D312-Y357 VanDerWaalsContact OD2-OH 3.12Å
313S94.1Very high96.5Very high61 Ų6130.2 Ų30.243%0.42716%0.162SC..Hα-helixtrans-60.9-39-178.447.60000114.4S317S313-S317 PolarHBondContact O-N 2.99Å; S313-S317 PolarHBondContact O-OG 3.15Å; S313-S317 VanDerWaalsContact O-OG 3.05Å
314A96.1Very high96.7Very high2 Ų230.1 Ų30.12%0.01716%0.161CC..Hα-helixtrans-72.4-41.6-179.500000110.6I186 L190 D312 S317 C318 Y352I186-A314 HydrophobicContact CG2-CB 3.67Å; L190-A314 HydrophobicContact CD1-CB 4.2Å; L190-A314 HydrophobicContact CD2-CB 4.49Å; D312-A314 PolarHBondContact O-N 3.01Å; D312-A314 WeakPolarHBondContact OD1-CA 3.37Å; D312-A314 WeakPolarHBondContact OD1-CB 3.15Å; D312-A314 PolarHBondContact OD1-N 3.21Å; A314-S317 PolarHBondContact O-N 2.88Å; A314-C318 WeakPolarHBondContact O-CB 3.43Å; A314-C318 PolarHBondContact O-N 3.02Å; A314-Y352 HydrophobicContact CB-CD1 4.4Å; A314-Y352 HydrophobicContact CB-CD2 4.22Å; A314-Y352 HydrophobicContact CB-CE1 3.9Å; A314-Y352 HydrophobicContact CB-CE2 3.69Å
315E98.1Very high96.9Very high0 Ų025.1 Ų25.10%014%0.138CC..Hα-helixtrans-61.5-43.6172.8-66.6176.9148.700111.7V311 D312 C318 L319 L349 Y352 V353 Y357 R363 L367V311-E315 WeakPolarHBondContact CA-OE2 3.38Å; V311-E315 HydrophobicContact CG1-CB 3.62Å; D312-E315 PolarHBondContact N-OE2 3.23Å; D312-E315 VanDerWaalsContact N-OE2 3.1Å; D312-E315 PolarHBondContact O-N 3.19Å; D312-E315 PolarHBondContact OD1-N 3.49Å; D312-E315 VanDerWaalsContact OD2-CG 3.28Å; D312-E315 WeakPolarHBondContact OD2-CG 3.3Å; E315-C318 PolarHBondContact O-N 3.21Å; E315-L319 WeakPolarHBondContact O-CB 3.41Å; E315-L319 VanDerWaalsContact O-CG 3.26Å; E315-L319 WeakPolarHBondContact O-CG 3.25Å; E315-L319 PolarHBondContact O-N 3.23Å; E315-L349 HydrophobicContact CB-CD1 4.1Å; E315-L349 HydrophobicContact CG-CD1 3.93Å; E315-Y352 HydrophobicContact CG-CD1 4.05Å; E315-Y352 HydrophobicContact CG-CE1 3.99Å; E315-V353 HydrophobicContact CG-CG2 4.49Å; E315-Y357 WeakPolarHBondContact OE1-CE2 3.41Å; E315-R363 IonicContact OE1-CZ 3.45Å; E315-R363 IonicContact OE1-NE 2.7Å; E315-R363 PolarHBondContact OE1-NE 3.48Å; E315-R363 IonicContact OE1-NH2 3.33Å; E315-R363 PolarHBondContact OE1-NH2 2.95Å; E315-R363 IonicContact OE2-CZ 3.56Å; E315-R363 IonicContact OE2-NE 3.61Å; E315-R363 IonicContact OE2-NH2 2.69Å; E315-R363 PolarHBondContact OE2-NH2 3.07Å; E315-L367 HydrophobicContact CB-CD1 4.45Å; E315-L367 HydrophobicContact CG-CD1 4.14Å; E315-L367 WeakPolarHBondContact OE1-CD1 3.47Å
316Y97.8Very high97Very high11 Ų1121.8 Ų21.84%0.04312%0.123CC..Hα-helixtrans-59.1-50.7173.3-87.4-63.1000111.9L259 A262 Q263 V311 D312 C318 L319 K320L259-Y316 HydrophobicContact CD2-CD1 4.28Å; L259-Y316 HydrophobicContact CD2-CE1 4.36Å; A262-Y316 HydrophobicContact CB-CE1 4.13Å; A262-Y316 VanDerWaalsContact CB-OH 3.29Å; A262-Y316 WeakPolarHBondContact CB-OH 3.4Å; Q263-Y316 HydrophobicContact CB-CD1 4.04Å; Q263-Y316 HydrophobicContact CB-CD2 3.83Å; Q263-Y316 HydrophobicContact CB-CE1 4.03Å; Q263-Y316 HydrophobicContact CB-CE2 3.81Å; Q263-Y316 HydrophobicContact CB-CG 3.97Å; Q263-Y316 HydrophobicContact CG-CD2 3.6Å; Q263-Y316 HydrophobicContact CG-CE2 3.94Å; Q263-Y316 HydrophobicContact CG-CG 3.93Å; V311-Y316 HydrophobicContact CB-CD2 4.08Å; V311-Y316 HydrophobicContact CB-CE1 4.32Å; V311-Y316 HydrophobicContact CB-CE2 3.65Å; V311-Y316 HydrophobicContact CG1-CD1 4.02Å; V311-Y316 HydrophobicContact CG1-CD2 3.66Å; V311-Y316 HydrophobicContact CG1-CE1 4.09Å; V311-Y316 HydrophobicContact CG1-CE2 3.75Å; V311-Y316 HydrophobicContact CG1-CG 3.78Å; V311-Y316 VanDerWaalsContact O-CE2 3.25Å; V311-Y316 WeakPolarHBondContact O-CE2 3.49Å; D312-Y316 WeakPolarHBondContact O-CB 3.31Å; D312-Y316 WeakPolarHBondContact O-CD2 3.21Å; D312-Y316 PolarHBondContact O-N 2.97Å; Y316-C318 VanDerWaalsContact C-N 3.29Å; Y316-C318 PolarHBondContact O-N 2.97Å; Y316-L319 PolarHBondContact O-N 3.15Å; Y316-K320 VanDerWaalsContact O-CG 3.32Å; Y316-K320 WeakPolarHBondContact O-CG 3.22Å; Y316-K320 PolarHBondContact O-N 2.82Å
317S97.6Very high97.1Very high0 Ų024 Ų240%014%0.137CC..Hα-helixtrans-64.7-32.9-179.6-52.60000112.3E193 W230 S313 A314 A321E193-S317 PolarHBondContact OE1-OG 3.36Å; W230-S317 WeakPolarHBondContact CZ2-O 3.37Å; S313-S317 PolarHBondContact O-N 2.99Å; S313-S317 PolarHBondContact O-OG 3.15Å; S313-S317 VanDerWaalsContact O-OG 3.05Å; A314-S317 PolarHBondContact O-N 2.88Å; S317-A321 PolarHBondContact O-N 2.94Å; S317-A321 VanDerWaalsContact O-N 3.15Å
318C98.4Very high97.2Very high0 Ų025.5 Ų25.50%015%0.148CC..Hα-helixtrans-66.4-45.9169.7-90.30000113A314 E315 Y316 K320 A321 I322 L349A314-C318 WeakPolarHBondContact O-CB 3.43Å; A314-C318 PolarHBondContact O-N 3.02Å; E315-C318 PolarHBondContact O-N 3.21Å; Y316-C318 VanDerWaalsContact C-N 3.29Å; Y316-C318 PolarHBondContact O-N 2.97Å; C318-K320 VanDerWaalsContact C-N 3.33Å; C318-K320 PolarHBondContact O-N 3.14Å; C318-A321 WeakPolarHBondContact O-CB 3.49Å; C318-A321 PolarHBondContact O-N 3.25Å; C318-A321 VanDerWaalsContact O-N 3.09Å; C318-I322 VanDerWaalsContact O-CG1 3.31Å; C318-I322 WeakPolarHBondContact O-CG1 3.5Å; C318-I322 PolarHBondContact O-N 3.39Å; C318-L349 HydrophobicContact CB-CB 3.95Å; C318-L349 HydrophobicContact CB-CD1 3.82Å; C318-L349 HydrophobicContact CB-CG 4.32Å
319L98.6Very high97.2Very high0 Ų022.5 Ų22.50%012%0.123CC..Hα-helixtrans-62.8-39.8177.8-71.8167.9000111.4L259 V311 E315 Y316 A321 I322 V323 L349 L367 L371L259-L319 HydrophobicContact CD1-CB 4.25Å; L259-L319 HydrophobicContact CD2-CB 4.32Å; V311-L319 HydrophobicContact CG1-CD1 4.15Å; E315-L319 WeakPolarHBondContact O-CB 3.41Å; E315-L319 VanDerWaalsContact O-CG 3.26Å; E315-L319 WeakPolarHBondContact O-CG 3.25Å; E315-L319 PolarHBondContact O-N 3.23Å; Y316-L319 PolarHBondContact O-N 3.15Å; L319-A321 VanDerWaalsContact C-N 3.3Å; L319-A321 PolarHBondContact O-N 2.97Å; L319-I322 PolarHBondContact O-N 3.33Å; L319-V323 WeakPolarHBondContact O-CB 3.38Å; L319-V323 WeakPolarHBondContact O-CG2 3.43Å; L319-V323 PolarHBondContact O-N 3.1Å; L319-L349 HydrophobicContact CD2-CD2 3.91Å; L319-L349 HydrophobicContact CG-CD2 4.3Å; L319-L367 HydrophobicContact CD1-CD2 4.29Å; L319-L367 HydrophobicContact CD2-CB 4.3Å; L319-L371 HydrophobicContact CB-CD2 4.39Å; L319-L371 HydrophobicContact CD2-CD1 4.27Å; L319-L371 HydrophobicContact CD2-CD2 3.77Å; L319-L371 HydrophobicContact CD2-CG 4.15Å
320K98.5Very high97.1Very high3 Ų326.5 Ų26.51%0.01315%0.153CC..Hα-helixtrans-57.3-42.4170.7-68.6175-162-177.80111.5E193 W230 L256 L259 N260 Y316 C318 V323 L324E193-K320 IonicContact OE1-NZ 3.62Å; E193-K320 PolarHBondContact OE1-NZ 3.35Å; E193-K320 IonicContact OE2-NZ 3.15Å; E193-K320 PolarHBondContact OE2-NZ 3.49Å; W230-K320 HydrophobicContact CD2-CD 4.27Å; W230-K320 HydrophobicContact CE3-CB 4.32Å; W230-K320 HydrophobicContact CE3-CD 4.4Å; W230-K320 HydrophobicContact CH2-CB 3.35Å; W230-K320 HydrophobicContact CH2-CD 4.42Å; W230-K320 HydrophobicContact CZ2-CB 3.83Å; W230-K320 HydrophobicContact CZ2-CD 4.23Å; W230-K320 HydrophobicContact CZ3-CB 3.62Å; W230-K320 HydrophobicContact CZ3-CD 4.49Å; L256-K320 HydrophobicContact CD2-CB 3.73Å; L256-K320 HydrophobicContact CD2-CG 3.98Å; L259-K320 HydrophobicContact CB-CG 4.37Å; L259-K320 HydrophobicContact CD1-CG 4Å; N260-K320 WeakPolarHBondContact OD1-CE 3.27Å; N260-K320 PolarHBondContact OD1-NZ 2.84Å; Y316-K320 VanDerWaalsContact O-CG 3.32Å; Y316-K320 WeakPolarHBondContact O-CG 3.22Å; Y316-K320 PolarHBondContact O-N 2.82Å; C318-K320 VanDerWaalsContact C-N 3.33Å; C318-K320 PolarHBondContact O-N 3.14Å; K320-V323 PolarHBondContact O-N 3.03Å; K320-L324 WeakPolarHBondContact O-CB 3.34Å; K320-L324 PolarHBondContact O-N 3.04Å
321A98.6Very high97Very high0 Ų022.5 Ų22.50%015%0.153CC..Hα-helixtrans-69.2-41.1179.900000112.4L189 W230 S317 C318 L319 V323 L324 F325L189-A321 HydrophobicContact CD1-CB 4.09Å; L189-A321 HydrophobicContact CD2-CB 4.39Å; W230-A321 HydrophobicContact CH2-CB 4.08Å; S317-A321 PolarHBondContact O-N 2.94Å; S317-A321 VanDerWaalsContact O-N 3.15Å; C318-A321 WeakPolarHBondContact O-CB 3.49Å; C318-A321 PolarHBondContact O-N 3.25Å; C318-A321 VanDerWaalsContact O-N 3.09Å; L319-A321 VanDerWaalsContact C-N 3.3Å; L319-A321 PolarHBondContact O-N 2.97Å; A321-V323 VanDerWaalsContact C-N 3.33Å; A321-V323 PolarHBondContact O-N 3.28Å; A321-L324 PolarHBondContact O-N 3.3Å; A321-F325 HydrophobicContact CB-CD2 4.32Å; A321-F325 HydrophobicContact CB-CE2 4.32Å; A321-F325 WeakPolarHBondContact O-CD2 3.47Å; A321-F325 PolarHBondContact O-N 3.17Å
322I98.8Very high97Very high4 Ų422.8 Ų22.82%0.02115%0.154CC..Hα-helixtrans-63.5-40.2175.8-62.3163.5000110.9C318 L319 Q342 Q346 L349 L368 L371C318-I322 VanDerWaalsContact O-CG1 3.31Å; C318-I322 WeakPolarHBondContact O-CG1 3.5Å; C318-I322 PolarHBondContact O-N 3.39Å; L319-I322 PolarHBondContact O-N 3.33Å; I322-Q342 HydrophobicContact CG2-CG 4.16Å; I322-Q342 WeakPolarHBondContact O-CG 3.39Å; I322-Q342 PolarHBondContact O-NE2 3.05Å; I322-Q346 HydrophobicContact CD1-CG 3.94Å; I322-Q346 HydrophobicContact CG1-CG 3.92Å; I322-Q346 HydrophobicContact CG2-CG 4.08Å; I322-L349 HydrophobicContact CD1-CB 4.34Å; I322-L349 HydrophobicContact CD1-CD2 3.77Å; I322-L368 HydrophobicContact CD1-CD2 3.92Å; I322-L371 HydrophobicContact CB-CD1 4.24Å; I322-L371 HydrophobicContact CG2-CD1 3.58Å
323V98.4Very high97.1Very high8 Ų824.4 Ų24.45%0.04817%0.167CC..Hα-helixtrans-65-49.5174162.50000111.3T252 E255 L256 L259 L319 K320 A321 L371 L374T252-V323 HydrophobicContact CG2-CG1 4.33Å; T252-V323 VanDerWaalsContact CG2-O 3.22Å; T252-V323 WeakPolarHBondContact CG2-O 3.33Å; E255-V323 HydrophobicContact CB-CG1 3.59Å; L256-V323 HydrophobicContact CD2-CB 4.41Å; L256-V323 HydrophobicContact CD2-CG1 3.99Å; L256-V323 HydrophobicContact CG-CG1 4.05Å; L259-V323 HydrophobicContact CD1-CG2 4.14Å; L319-V323 WeakPolarHBondContact O-CB 3.38Å; L319-V323 WeakPolarHBondContact O-CG2 3.43Å; L319-V323 PolarHBondContact O-N 3.1Å; K320-V323 PolarHBondContact O-N 3.03Å; A321-V323 VanDerWaalsContact C-N 3.33Å; A321-V323 PolarHBondContact O-N 3.28Å; V323-L371 HydrophobicContact CG2-CD2 3.64Å; V323-L374 HydrophobicContact CG2-CD1 4.12Å
324L98.6Very high97.2Very high0 Ų025.6 Ų25.60%017%0.169CC..Hα-helixtrans-67-42.5-174.4177.860.2000113W230 A231 I234 F237 L248 L249 L256 K320 A321 T326W230-L324 HydrophobicContact CE3-CD2 4.49Å; W230-L324 HydrophobicContact CZ3-CD2 3.85Å; A231-L324 HydrophobicContact CB-CD2 3.69Å; I234-L324 HydrophobicContact CD1-CD2 3.77Å; F237-L324 HydrophobicContact CD2-CD1 4.3Å; F237-L324 HydrophobicContact CD2-CD2 3.79Å; F237-L324 HydrophobicContact CD2-CG 4.07Å; F237-L324 HydrophobicContact CE2-CD1 3.77Å; F237-L324 HydrophobicContact CE2-CD2 4.03Å; F237-L324 HydrophobicContact CE2-CG 4.05Å; F237-L324 HydrophobicContact CG-CD2 4.38Å; F237-L324 HydrophobicContact CZ-CD1 4.47Å; L248-L324 HydrophobicContact CB-CD1 4.2Å; L248-L324 WeakPolarHBondContact CD2-O 3.42Å; L249-L324 HydrophobicContact CD2-CD1 3.66Å; L249-L324 HydrophobicContact CG-CD1 3.84Å; L256-L324 HydrophobicContact CD1-CD1 4.29Å; K320-L324 WeakPolarHBondContact O-CB 3.34Å; K320-L324 PolarHBondContact O-N 3.04Å; A321-L324 PolarHBondContact O-N 3.3Å; L324-T326 PolarHBondContact O-N 3.06Å
325F98.5Very high97.3Very high0 Ų028.8 Ų28.80%019%0.188CC..SBendtrans-83.554.2178.4-62.6-59.1000111.8I234 F237 L240 A321 V338 L341 Q342I234-F325 HydrophobicContact CD1-CE2 3.9Å; I234-F325 HydrophobicContact CD1-CZ 3.68Å; F237-F325 HydrophobicContact CB-CE1 4.03Å; F237-F325 HydrophobicContact CB-CZ 4.06Å; F237-F325 HydrophobicContact CD2-CE1 4.02Å; L240-F325 HydrophobicContact CD1-CE1 4.23Å; A321-F325 HydrophobicContact CB-CD2 4.32Å; A321-F325 HydrophobicContact CB-CE2 4.32Å; A321-F325 WeakPolarHBondContact O-CD2 3.47Å; A321-F325 PolarHBondContact O-N 3.17Å; F325-V338 HydrophobicContact CB-CG1 4.28Å; F325-L341 HydrophobicContact CB-CB 4.05Å; F325-L341 HydrophobicContact CD1-CB 3.82Å; F325-L341 HydrophobicContact CD1-CD1 3.75Å; F325-L341 HydrophobicContact CD1-CG 4.45Å; F325-L341 HydrophobicContact CD2-CB 3.85Å; F325-L341 HydrophobicContact CE1-CB 4.21Å; F325-L341 HydrophobicContact CE1-CD1 3.56Å; F325-L341 HydrophobicContact CE2-CB 4.24Å; F325-L341 HydrophobicContact CG-CB 3.64Å; F325-L341 HydrophobicContact CG-CD1 4.44Å; F325-L341 HydrophobicContact CZ-CB 4.4Å; F325-L341 HydrophobicContact CZ-CD1 4.1Å; F325-Q342 HydrophobicContact CB-CB 4.25Å; F325-Q342 HydrophobicContact CB-CG 4.48Å; F325-Q342 VanDerWaalsContact O-CB 3.24Å; F325-Q342 WeakPolarHBondContact O-CB 3.11Å; F325-Q342 VanDerWaalsContact O-CD 3.31Å; F325-Q342 WeakPolarHBondContact O-CG 3.35Å; F325-Q342 PolarHBondContact O-NE2 3.44Å
326T97.3Very high97.2Very high4 Ų431.8 Ų31.83%0.02521%0.213CC..  trans-87.1137.9178.4-1730000113L248 L251 T252 L324 D328L248-T326 HydrophobicContact CD2-CG2 4.29Å; L248-T326 WeakPolarHBondContact CD2-O 3.5Å; L251-T326 HydrophobicContact CD2-CG2 3.83Å; T252-T326 HydrophobicContact CG2-CG2 3.61Å; L324-T326 PolarHBondContact O-N 3.06Å; T326-D328 VanDerWaalsContact C-N 3.26Å; T326-D328 HydrophobicContact CG2-CB 4.28Å; T326-D328 WeakPolarHBondContact OG1-CB 3.38Å; T326-D328 PolarHBondContact OG1-N 3.14Å; T326-D328 VanDerWaalsContact OG1-N 3.16Å; T326-D328 PolarHBondContact OG1-OD2 3.06Å
327T97.6Very high97.2Very high50 Ų5034.5 Ų34.531%0.30723%0.226SC..THydrogen-bonded Turntrans-78.8-8.2170.250.40000113.2A329 V335 E339T327-A329 PolarHBondContact O-N 3.07Å; T327-V335 HydrophobicContact CG2-CG1 3.75Å; T327-E339 HydrophobicContact CG2-CB 3.8Å; T327-E339 HydrophobicContact CG2-CG 4.38Å
328D96.4Very high97.2Very high87 Ų8734.5 Ų34.547%0.46523%0.226SC..THydrogen-bonded Turntrans-65.3-14.9175.6-69.1-32.5000113.4L251 T326 C330 R375L251-D328 HydrophobicContact CD2-CB 3.69Å; T326-D328 VanDerWaalsContact C-N 3.26Å; T326-D328 HydrophobicContact CG2-CB 4.28Å; T326-D328 WeakPolarHBondContact OG1-CB 3.38Å; T326-D328 PolarHBondContact OG1-N 3.14Å; T326-D328 VanDerWaalsContact OG1-N 3.16Å; T326-D328 PolarHBondContact OG1-OD2 3.06Å; D328-C330 PolarHBondContact O-N 3.28Å; D328-R375 IonicContact OD2-CZ 2.65Å; D328-R375 VanDerWaalsContact OD2-CZ 3.24Å; D328-R375 IonicContact OD2-NH1 2.66Å; D328-R375 PolarHBondContact OD2-NH1 2.78Å; D328-R375 IonicContact OD2-NH2 2.81Å; D328-R375 PolarHBondContact OD2-NH2 2.88Å
329A95.6Very high97.2Very high8 Ų839.2 Ų39.27%0.06625%0.248CC..SBendtrans-72.8127.2-174.800000112.5A247 L248 L251 T327 G331 L332A247-A329 HydrophobicContact CB-CB 4.46Å; L248-A329 HydrophobicContact CD2-CB 3.84Å; L251-A329 HydrophobicContact CD2-CB 4.08Å; T327-A329 PolarHBondContact O-N 3.07Å; A329-G331 PolarHBondContact O-N 2.79Å; A329-L332 HydrophobicContact CB-CD1 4.1Å; A329-L332 HydrophobicContact CB-CD2 4.11Å; A329-L332 HydrophobicContact CB-CG 4Å; A329-L332 WeakPolarHBondContact O-CG 3.07Å
330C93.9Very high97.2Very high124 Ų12440.8 Ų40.884%0.83826%0.259SS*.THydrogen-bonded Turntrans-71.1129.4-179.6-61.10000111.8D328D328-C330 PolarHBondContact O-N 3.28Å
331G93.3Very high97.1Very high69 Ų6940.7 Ų40.771%0.71126%0.258SS*.THydrogen-bonded Turntrans86.117.9171.900000115.9A329A329-G331 PolarHBondContact O-N 2.79Å
332L96.6Very high97.1Very high21 Ų2142.5 Ų42.511%0.1127%0.267CS..  trans-57.4139.7170.7-66.4174.5000111.9D244 L248 A329 V335 V338D244-L332 HydrophobicContact CB-CD2 3.88Å; L248-L332 HydrophobicContact CD1-CD2 4.47Å; L248-L332 HydrophobicContact CD2-CD1 4.34Å; L248-L332 HydrophobicContact CD2-CD2 3.87Å; L248-L332 HydrophobicContact CG-CD2 3.93Å; A329-L332 HydrophobicContact CB-CD1 4.1Å; A329-L332 HydrophobicContact CB-CD2 4.11Å; A329-L332 HydrophobicContact CB-CG 4Å; A329-L332 WeakPolarHBondContact O-CG 3.07Å; L332-V335 HydrophobicContact CB-CG2 4Å; L332-V338 HydrophobicContact CD1-CB 4.34Å; L332-V338 HydrophobicContact CD1-CG1 4.29Å; L332-V338 HydrophobicContact CD1-CG2 4.2Å; L332-V338 HydrophobicContact CD2-CG2 4.37Å
333S96.9Very high97.1Very high60 Ų6047.7 Ų47.742%0.4229%0.291SS..SBendtrans-81.6-33-177.8-55.50000112.9Q241 D244Q241-S333 PolarHBondContact NE2-OG 2.95Å; D244-S333 WeakPolarHBondContact OD1-CB 3.13Å; D244-S333 PolarHBondContact OD1-N 3.05Å; D244-S333 PolarHBondContact OD1-OG 2.98Å; D244-S333 VanDerWaalsContact OD2-CB 3.29Å; D244-S333 WeakPolarHBondContact OD2-CB 3.19Å; D244-S333 PolarHBondContact OD2-N 3Å; D244-S333 PolarHBondContact OD2-OG 3.36Å
334D95.6Very high97Very high86 Ų8648.1 Ų48.146%0.4629%0.292SS..  trans-139.185.4174.5-168.9-17.8000110.8A336 H337 V338D334-A336 VanDerWaalsContact C-N 3.28Å; D334-A336 PolarHBondContact O-N 2.96Å; D334-A336 PolarHBondContact OD1-N 3.33Å; D334-H337 HydrophobicContact CB-CB 3.96Å; D334-H337 VanDerWaalsContact CG-CB 3.44Å; D334-H337 PolarHBondContact O-N 3.35Å; D334-H337 PolarHBondContact OD1-N 3.28Å; D334-V338 PolarHBondContact O-N 2.85Å; D334-V338 VanDerWaalsContact O-N 3.14Å
335V97.8Very high96.9Very high70 Ų7048.1 Ų48.142%0.42429%0.292SS..Hα-helixtrans-58.3-39.8179-178.10000111.5T327 L332 H337 V338 E339T327-V335 HydrophobicContact CG2-CG1 3.75Å; L332-V335 HydrophobicContact CB-CG2 4Å; V335-H337 VanDerWaalsContact C-N 3.35Å; V335-H337 PolarHBondContact O-N 2.9Å; V335-V338 PolarHBondContact O-N 3.44Å; V335-E339 WeakPolarHBondContact O-CB 3.44Å; V335-E339 PolarHBondContact O-N 3.33Å
336A97.4Very high96.9Very high63 Ų6351.2 Ų51.252%0.52131%0.307SS..Hα-helixtrans-70.1-32.7-178.400000111.8D334 S340D334-A336 VanDerWaalsContact C-N 3.28Å; D334-A336 PolarHBondContact O-N 2.96Å; D334-A336 PolarHBondContact OD1-N 3.33Å; A336-S340 PolarHBondContact O-N 3Å; A336-S340 VanDerWaalsContact O-N 3.1Å
337H96.8Very high96.9Very high67 Ų6754.1 Ų54.131%0.3133%0.326SS..Hα-helixtrans-65.9-47.3170.1-173.232.6000111.4D334 V335 E339 S340 L341D334-H337 HydrophobicContact CB-CB 3.96Å; D334-H337 VanDerWaalsContact CG-CB 3.44Å; D334-H337 PolarHBondContact O-N 3.35Å; D334-H337 PolarHBondContact OD1-N 3.28Å; V335-H337 VanDerWaalsContact C-N 3.35Å; V335-H337 PolarHBondContact O-N 2.9Å; H337-E339 VanDerWaalsContact C-N 3.34Å; H337-E339 PolarHBondContact O-N 3.47Å; H337-S340 PolarHBondContact ND1-OG 2.95Å; H337-S340 PolarHBondContact O-N 3.21Å; H337-S340 VanDerWaalsContact O-N 3.14Å; H337-S340 PolarHBondContact O-OG 3.34Å; H337-L341 WeakPolarHBondContact O-CG 3.33Å; H337-L341 PolarHBondContact O-N 3.48Å; H337-L341 VanDerWaalsContact O-N 3.14Å
338V98.3Very high96.9Very high0 Ų051.7 Ų51.70%031%0.312CS..Hα-helixtrans-59.4-44.3178175.80000111.4L248 F325 L332 D334 V335 S340 L341 Q342L248-V338 HydrophobicContact CD2-CG1 4.19Å; F325-V338 HydrophobicContact CB-CG1 4.28Å; L332-V338 HydrophobicContact CD1-CB 4.34Å; L332-V338 HydrophobicContact CD1-CG1 4.29Å; L332-V338 HydrophobicContact CD1-CG2 4.2Å; L332-V338 HydrophobicContact CD2-CG2 4.37Å; D334-V338 PolarHBondContact O-N 2.85Å; D334-V338 VanDerWaalsContact O-N 3.14Å; V335-V338 PolarHBondContact O-N 3.44Å; V338-S340 VanDerWaalsContact C-N 3.35Å; V338-S340 PolarHBondContact O-N 3.47Å; V338-L341 WeakPolarHBondContact O-CA 3.14Å; V338-L341 WeakPolarHBondContact O-CB 3.41Å; V338-L341 PolarHBondContact O-N 3.16Å; V338-Q342 PolarHBondContact O-N 3.38Å
339E98Very high97Very high100 Ų10047.6 Ų47.647%0.46729%0.29SS..Hα-helixtrans-53.7-48.6173-169.6169.5-134.100111.6T327 V335 H337 L341 Q342 E343T327-E339 HydrophobicContact CG2-CB 3.8Å; T327-E339 HydrophobicContact CG2-CG 4.38Å; V335-E339 WeakPolarHBondContact O-CB 3.44Å; V335-E339 PolarHBondContact O-N 3.33Å; H337-E339 VanDerWaalsContact C-N 3.34Å; H337-E339 PolarHBondContact O-N 3.47Å; E339-L341 PolarHBondContact O-N 3.11Å; E339-Q342 WeakPolarHBondContact O-CA 3.33Å; E339-Q342 WeakPolarHBondContact O-CB 3.07Å; E339-Q342 PolarHBondContact O-N 3.04Å; E339-E343 PolarHBondContact O-N 3.21Å
340S97.9Very high97.1Very high33 Ų3350.8 Ų50.823%0.23130%0.303CS..Hα-helixtrans-64.2-20177.279.80000114.5A336 H337 V338 K344A336-S340 PolarHBondContact O-N 3Å; A336-S340 VanDerWaalsContact O-N 3.1Å; H337-S340 PolarHBondContact ND1-OG 2.95Å; H337-S340 PolarHBondContact O-N 3.21Å; H337-S340 VanDerWaalsContact O-N 3.14Å; H337-S340 PolarHBondContact O-OG 3.34Å; V338-S340 VanDerWaalsContact C-N 3.35Å; V338-S340 PolarHBondContact O-N 3.47Å; S340-K344 VanDerWaalsContact O-CB 3.29Å; S340-K344 WeakPolarHBondContact O-CB 3.25Å; S340-K344 PolarHBondContact O-N 3.01Å
341L97.7Very high97.1Very high0 Ų046.4 Ų46.40%027%0.27CS..Hα-helixtrans-83.1-35171.8-60.8-178.7000111.3F236 L240 F325 H337 V338 E339 K344 S345F236-L341 HydrophobicContact CB-CD1 3.69Å; F236-L341 HydrophobicContact CB-CD2 3.66Å; F236-L341 HydrophobicContact CB-CG 4.33Å; F236-L341 HydrophobicContact CD1-CD2 4.24Å; F236-L341 HydrophobicContact CD2-CD2 3.66Å; F236-L341 HydrophobicContact CE2-CD2 4.43Å; F236-L341 HydrophobicContact CG-CD2 3.56Å; L240-L341 HydrophobicContact CD2-CD1 4.25Å; F325-L341 HydrophobicContact CB-CB 4.05Å; F325-L341 HydrophobicContact CD1-CB 3.82Å; F325-L341 HydrophobicContact CD1-CD1 3.75Å; F325-L341 HydrophobicContact CD1-CG 4.45Å; F325-L341 HydrophobicContact CD2-CB 3.85Å; F325-L341 HydrophobicContact CE1-CB 4.21Å; F325-L341 HydrophobicContact CE1-CD1 3.56Å; F325-L341 HydrophobicContact CE2-CB 4.24Å; F325-L341 HydrophobicContact CG-CB 3.64Å; F325-L341 HydrophobicContact CG-CD1 4.44Å; F325-L341 HydrophobicContact CZ-CB 4.4Å; F325-L341 HydrophobicContact CZ-CD1 4.1Å; H337-L341 WeakPolarHBondContact O-CG 3.33Å; H337-L341 PolarHBondContact O-N 3.48Å; H337-L341 VanDerWaalsContact O-N 3.14Å; V338-L341 WeakPolarHBondContact O-CA 3.14Å; V338-L341 WeakPolarHBondContact O-CB 3.41Å; V338-L341 PolarHBondContact O-N 3.16Å; E339-L341 PolarHBondContact O-N 3.11Å; L341-K344 VanDerWaalsContact CD2-NZ 3.3Å; L341-S345 WeakPolarHBondContact O-CB 3.35Å; L341-S345 PolarHBondContact O-N 2.87Å; L341-S345 VanDerWaalsContact O-N 3.1Å; L341-S345 PolarHBondContact O-OG 3.38Å
342Q98.4Very high97.2Very high39 Ų3945.7 Ų45.718%0.18225%0.247CC..Hα-helixtrans-65.6-50.5172.5-146.3-174.244.600111.5I322 F325 V338 E339 K344 S345 Q346I322-Q342 HydrophobicContact CG2-CG 4.16Å; I322-Q342 WeakPolarHBondContact O-CG 3.39Å; I322-Q342 PolarHBondContact O-NE2 3.05Å; F325-Q342 HydrophobicContact CB-CB 4.25Å; F325-Q342 HydrophobicContact CB-CG 4.48Å; F325-Q342 VanDerWaalsContact O-CB 3.24Å; F325-Q342 WeakPolarHBondContact O-CB 3.11Å; F325-Q342 VanDerWaalsContact O-CD 3.31Å; F325-Q342 WeakPolarHBondContact O-CG 3.35Å; F325-Q342 PolarHBondContact O-NE2 3.44Å; V338-Q342 PolarHBondContact O-N 3.38Å; E339-Q342 WeakPolarHBondContact O-CA 3.33Å; E339-Q342 WeakPolarHBondContact O-CB 3.07Å; E339-Q342 PolarHBondContact O-N 3.04Å; Q342-K344 VanDerWaalsContact C-N 3.31Å; Q342-K344 PolarHBondContact O-N 2.97Å; Q342-S345 WeakPolarHBondContact O-CA 3.26Å; Q342-S345 WeakPolarHBondContact O-CB 3.42Å; Q342-S345 PolarHBondContact O-N 3.4Å; Q342-Q346 WeakPolarHBondContact O-CG 3.32Å; Q342-Q346 PolarHBondContact O-N 3.48Å
343E97.6Very high97.2Very high113 Ų11345 Ų4553%0.52824%0.243SC..Hα-helixtrans-54.5-47175.9-71.3-172141.100111.4E339 S345 Q346 C347E339-E343 PolarHBondContact O-N 3.21Å; E343-S345 VanDerWaalsContact C-N 3.26Å; E343-S345 PolarHBondContact O-N 3.3Å; E343-Q346 PolarHBondContact O-N 2.8Å; E343-C347 WeakPolarHBondContact O-CB 3.45Å; E343-C347 PolarHBondContact O-N 3.36Å; E343-C347 PolarHBondContact O-SG 2.88Å; E343-C347 VanDerWaalsContact O-SG 3.34Å
344K96Very high97.1Very high17 Ų1747.8 Ų47.87%0.07425%0.245CC..Hα-helixtrans-58.9-37.7176.8-174.3-169.5-57.3166.70112.2Y181 F236 S340 L341 Q342 A348Y181-K344 HydrophobicContact CE1-CD 4.38Å; F236-K344 HydrophobicContact CD2-CD 4.49Å; F236-K344 HydrophobicContact CE2-CD 3.77Å; F236-K344 HydrophobicContact CZ-CD 4.29Å; S340-K344 VanDerWaalsContact O-CB 3.29Å; S340-K344 WeakPolarHBondContact O-CB 3.25Å; S340-K344 PolarHBondContact O-N 3.01Å; L341-K344 VanDerWaalsContact CD2-NZ 3.3Å; Q342-K344 VanDerWaalsContact C-N 3.31Å; Q342-K344 PolarHBondContact O-N 2.97Å; K344-A348 WeakPolarHBondContact O-CB 3.36Å; K344-A348 PolarHBondContact O-N 3.33Å
345S98.3Very high96.9Very high0 Ų047.1 Ų47.10%025%0.247CC..Hα-helixtrans-71.1-38.6177.4-54.80000112.2Y185 L341 Q342 E343 L349Y185-S345 PolarHBondContact OH-OG 3.18Å; L341-S345 WeakPolarHBondContact O-CB 3.35Å; L341-S345 PolarHBondContact O-N 2.87Å; L341-S345 VanDerWaalsContact O-N 3.1Å; L341-S345 PolarHBondContact O-OG 3.38Å; Q342-S345 WeakPolarHBondContact O-CA 3.26Å; Q342-S345 WeakPolarHBondContact O-CB 3.42Å; Q342-S345 PolarHBondContact O-N 3.4Å; E343-S345 VanDerWaalsContact C-N 3.26Å; E343-S345 PolarHBondContact O-N 3.3Å; S345-L349 PolarHBondContact O-N 3.26Å; S345-L349 VanDerWaalsContact O-N 3.09Å
346Q98.2Very high96.8Very high64 Ų6448.8 Ų48.830%0.29925%0.25SC..Hα-helixtrans-66.1-48.2173.7-65.8174.718.200111.5I322 Q342 E343 A348 L349 E350 F364I322-Q346 HydrophobicContact CD1-CG 3.94Å; I322-Q346 HydrophobicContact CG1-CG 3.92Å; I322-Q346 HydrophobicContact CG2-CG 4.08Å; Q342-Q346 WeakPolarHBondContact O-CG 3.32Å; Q342-Q346 PolarHBondContact O-N 3.48Å; E343-Q346 PolarHBondContact O-N 2.8Å; Q346-A348 VanDerWaalsContact C-N 3.31Å; Q346-A348 PolarHBondContact O-N 3.3Å; Q346-L349 PolarHBondContact O-N 3.08Å; Q346-L349 VanDerWaalsContact O-N 3.15Å; Q346-E350 PolarHBondContact O-N 3.39Å; Q346-F364 WeakPolarHBondContact O-CE2 3.42Å
347C97.5Very high96.6Very high65 Ų6548.6 Ų48.644%0.43924%0.236SC..Hα-helixtrans-58.8-40.7175.7-72.70000112.2L182 E343 E351L182-C347 HydrophobicContact CD1-CB 4.46Å; E343-C347 WeakPolarHBondContact O-CB 3.45Å; E343-C347 PolarHBondContact O-N 3.36Å; E343-C347 PolarHBondContact O-SG 2.88Å; E343-C347 VanDerWaalsContact O-SG 3.34Å; C347-E351 VanDerWaalsContact O-CB 3.26Å; C347-E351 WeakPolarHBondContact O-CB 3.48Å; C347-E351 PolarHBondContact O-N 3.26Å
348A96.9Very high96.4Very high0 Ų049.5 Ų49.50%025%0.248CC..Hα-helixtrans-62-45.2174.700000111.9L182 Y185 I186 K344 Q346 E351 Y352L182-A348 HydrophobicContact CB-CB 4.37Å; L182-A348 HydrophobicContact CD2-CB 4.08Å; Y185-A348 HydrophobicContact CD1-CB 3.89Å; Y185-A348 HydrophobicContact CE1-CB 4.34Å; I186-A348 HydrophobicContact CD1-CB 4.16Å; I186-A348 HydrophobicContact CG1-CB 4.07Å; K344-A348 WeakPolarHBondContact O-CB 3.36Å; K344-A348 PolarHBondContact O-N 3.33Å; Q346-A348 VanDerWaalsContact C-N 3.31Å; Q346-A348 PolarHBondContact O-N 3.3Å; A348-E351 PolarHBondContact O-N 3.15Å; A348-Y352 VanDerWaalsContact O-CB 3.31Å; A348-Y352 WeakPolarHBondContact O-CB 3.38Å; A348-Y352 PolarHBondContact O-N 2.85Å
349L98.3Very high96.3Very high0 Ų056.9 Ų56.90%029%0.287CS..Hα-helixtrans-64.8-44.4177.6-176.762.7000112.1E315 C318 L319 I322 S345 Q346 E351 Y352 V353 F364 L367 L368E315-L349 HydrophobicContact CB-CD1 4.1Å; E315-L349 HydrophobicContact CG-CD1 3.93Å; C318-L349 HydrophobicContact CB-CB 3.95Å; C318-L349 HydrophobicContact CB-CD1 3.82Å; C318-L349 HydrophobicContact CB-CG 4.32Å; L319-L349 HydrophobicContact CD2-CD2 3.91Å; L319-L349 HydrophobicContact CG-CD2 4.3Å; I322-L349 HydrophobicContact CD1-CB 4.34Å; I322-L349 HydrophobicContact CD1-CD2 3.77Å; S345-L349 PolarHBondContact O-N 3.26Å; S345-L349 VanDerWaalsContact O-N 3.09Å; Q346-L349 PolarHBondContact O-N 3.08Å; Q346-L349 VanDerWaalsContact O-N 3.15Å; L349-E351 VanDerWaalsContact C-N 3.34Å; L349-E351 PolarHBondContact O-N 3.46Å; L349-Y352 PolarHBondContact O-N 3.18Å; L349-V353 HydrophobicContact CD1-CG2 4.09Å; L349-V353 HydrophobicContact CG-CG2 4.4Å; L349-V353 WeakPolarHBondContact O-CB 3.43Å; L349-V353 VanDerWaalsContact O-CG2 3.23Å; L349-V353 WeakPolarHBondContact O-CG2 3.24Å; L349-V353 PolarHBondContact O-N 3.4Å; L349-F364 HydrophobicContact CB-CD2 4.4Å; L349-F364 HydrophobicContact CB-CE2 4.14Å; L349-F364 HydrophobicContact CD2-CD2 4.2Å; L349-F364 HydrophobicContact CD2-CE2 4.2Å; L349-F364 HydrophobicContact CG-CD2 3.99Å; L349-F364 HydrophobicContact CG-CE2 4.15Å; L349-L367 HydrophobicContact CD1-CD1 4.16Å; L349-L368 HydrophobicContact CD2-CD2 4.18Å
350E97.6Very high96.2Very high75 Ų7555.9 Ų55.935%0.3528%0.283SS..Hα-helixtrans-60.6-46178-159.8-152.7140.700110.8Q346 V353 R354 F364Q346-E350 PolarHBondContact O-N 3.39Å; E350-V353 PolarHBondContact O-N 2.91Å; E350-R354 VanDerWaalsContact O-CB 3.29Å; E350-R354 WeakPolarHBondContact O-CB 3.44Å; E350-R354 PolarHBondContact O-N 3.41Å; E350-R354 IonicContact OE1-CZ 3.46Å; E350-R354 IonicContact OE1-NE 3.41Å; E350-R354 PolarHBondContact OE1-NE 3.29Å; E350-R354 IonicContact OE1-NH2 2.71Å; E350-R354 PolarHBondContact OE1-NH2 3.45Å; E350-R354 IonicContact OE2-NH2 3.68Å; E350-F364 VanDerWaalsContact CA-CD2 3.5Å; E350-F364 HydrophobicContact CB-CD1 4.3Å; E350-F364 HydrophobicContact CB-CD2 3.8Å; E350-F364 HydrophobicContact CB-CE1 4.11Å; E350-F364 HydrophobicContact CB-CE2 3.59Å; E350-F364 HydrophobicContact CB-CG 4.14Å; E350-F364 HydrophobicContact CB-CZ 3.74Å; E350-F364 HydrophobicContact CG-CD1 3.77Å; E350-F364 HydrophobicContact CG-CD2 4.07Å; E350-F364 HydrophobicContact CG-CE1 3.84Å; E350-F364 HydrophobicContact CG-CE2 4.15Å; E350-F364 HydrophobicContact CG-CG 3.86Å; E350-F364 HydrophobicContact CG-CZ 4.02Å
351E94.1Very high95.9Very high32 Ų3259.9 Ų59.915%0.1531%0.308CS..Hα-helixtrans-62.5-47.1179.2-170.656.3-121.300112.1H179 L182 C347 A348 L349 R354 S355H179-E351 VanDerWaalsContact CE1-CD 3.48Å; H179-E351 IonicContact CE1-OE1 3.1Å; H179-E351 PolarHBondContact CE1-OE1 3.39Å; H179-E351 IonicContact CE1-OE2 3.54Å; H179-E351 IonicContact ND1-OE1 2.9Å; H179-E351 PolarHBondContact ND1-OE1 3.15Å; H179-E351 IonicContact ND1-OE2 2.81Å; H179-E351 PolarHBondContact ND1-OE2 2.92Å; L182-E351 HydrophobicContact CD1-CB 3.93Å; L182-E351 HydrophobicContact CD1-CG 4.11Å; C347-E351 VanDerWaalsContact O-CB 3.26Å; C347-E351 WeakPolarHBondContact O-CB 3.48Å; C347-E351 PolarHBondContact O-N 3.26Å; A348-E351 PolarHBondContact O-N 3.15Å; L349-E351 VanDerWaalsContact C-N 3.34Å; L349-E351 PolarHBondContact O-N 3.46Å; E351-R354 PolarHBondContact O-N 2.91Å; E351-R354 IonicContact OE1-NH1 3.07Å; E351-R354 PolarHBondContact OE1-NH1 2.93Å; E351-R354 VanDerWaalsContact OE1-NH1 3.07Å; E351-R354 IonicContact OE2-CZ 3.67Å; E351-R354 IonicContact OE2-NH1 2.7Å; E351-R354 PolarHBondContact OE2-NH1 3.16Å; E351-R354 IonicContact OE2-NH2 3.73Å; E351-S355 VanDerWaalsContact O-CB 3.31Å; E351-S355 WeakPolarHBondContact O-CB 3.23Å; E351-S355 PolarHBondContact O-N 2.97Å
352Y96.1Very high95.9Very high55 Ų5563.9 Ų63.922%0.21633%0.332CS..Hα-helixtrans-59.5-49.5176.7-177.5-92.4000111.7I186 D312 A314 E315 A348 L349 R354 S355 Q356 Y357I186-Y352 HydrophobicContact CD1-CD2 3.91Å; I186-Y352 HydrophobicContact CD1-CG 4.05Å; D312-Y352 WeakPolarHBondContact OD2-CE1 3.38Å; A314-Y352 HydrophobicContact CB-CD1 4.4Å; A314-Y352 HydrophobicContact CB-CD2 4.22Å; A314-Y352 HydrophobicContact CB-CE1 3.9Å; A314-Y352 HydrophobicContact CB-CE2 3.69Å; E315-Y352 HydrophobicContact CG-CD1 4.05Å; E315-Y352 HydrophobicContact CG-CE1 3.99Å; A348-Y352 VanDerWaalsContact O-CB 3.31Å; A348-Y352 WeakPolarHBondContact O-CB 3.38Å; A348-Y352 PolarHBondContact O-N 2.85Å; L349-Y352 PolarHBondContact O-N 3.18Å; Y352-R354 PolarHBondContact O-N 3.39Å; Y352-S355 PolarHBondContact O-N 3.38Å; Y352-Q356 HydrophobicContact CD1-CG 4.31Å; Y352-Q356 HydrophobicContact CD2-CG 4.04Å; Y352-Q356 HydrophobicContact CE1-CB 4.28Å; Y352-Q356 HydrophobicContact CE1-CG 3.95Å; Y352-Q356 HydrophobicContact CE2-CG 3.67Å; Y352-Q356 HydrophobicContact CG-CG 4.34Å; Y352-Q356 WeakPolarHBondContact O-CB 3.29Å; Y352-Q356 WeakPolarHBondContact O-CG 3.41Å; Y352-Q356 PolarHBondContact O-N 3.18Å; Y352-Y357 HydrophobicContact CE1-CE2 4.36Å
353V96.6Very high95.9Very high6 Ų662.5 Ų62.54%0.03633%0.326CS..Hα-helixtrans-61.3-43.6178.9168.60000111.4E315 L349 E350 S355 Y357 R363 F364 L367E315-V353 HydrophobicContact CG-CG2 4.49Å; L349-V353 HydrophobicContact CD1-CG2 4.09Å; L349-V353 HydrophobicContact CG-CG2 4.4Å; L349-V353 WeakPolarHBondContact O-CB 3.43Å; L349-V353 VanDerWaalsContact O-CG2 3.23Å; L349-V353 WeakPolarHBondContact O-CG2 3.24Å; L349-V353 PolarHBondContact O-N 3.4Å; E350-V353 PolarHBondContact O-N 2.91Å; V353-S355 VanDerWaalsContact C-N 3.27Å; V353-S355 PolarHBondContact O-N 3.47Å; V353-Y357 CarbonylContact O-C 3.58Å; V353-Y357 WeakPolarHBondContact O-CA 3.47Å; V353-Y357 WeakPolarHBondContact O-CB 3.42Å; V353-Y357 PolarHBondContact O-N 3.28Å; V353-R363 HydrophobicContact CG1-CB 3.71Å; V353-R363 HydrophobicContact CG1-CG 4Å; V353-F364 HydrophobicContact CB-CB 4.46Å; V353-F364 HydrophobicContact CG1-CB 4.14Å; V353-L367 HydrophobicContact CG2-CD1 3.83Å
354R94.4Very high95.9Very high119 Ų11959.3 Ų59.345%0.44931%0.31SS..Hα-helixtrans-65-32.9178.9-152.4-173.2-42.8105.1-7.2112.2E350 E351 Y352E350-R354 VanDerWaalsContact O-CB 3.29Å; E350-R354 WeakPolarHBondContact O-CB 3.44Å; E350-R354 PolarHBondContact O-N 3.41Å; E350-R354 IonicContact OE1-CZ 3.46Å; E350-R354 IonicContact OE1-NE 3.41Å; E350-R354 PolarHBondContact OE1-NE 3.29Å; E350-R354 IonicContact OE1-NH2 2.71Å; E350-R354 PolarHBondContact OE1-NH2 3.45Å; E350-R354 IonicContact OE2-NH2 3.68Å; E351-R354 PolarHBondContact O-N 2.91Å; E351-R354 IonicContact OE1-NH1 3.07Å; E351-R354 PolarHBondContact OE1-NH1 2.93Å; E351-R354 VanDerWaalsContact OE1-NH1 3.07Å; E351-R354 IonicContact OE2-CZ 3.67Å; E351-R354 IonicContact OE2-NH1 2.7Å; E351-R354 PolarHBondContact OE2-NH1 3.16Å; E351-R354 IonicContact OE2-NH2 3.73Å; Y352-R354 PolarHBondContact O-N 3.39Å
355S92.1Very high96Very high72 Ų7260.1 Ų60.150%0.50332%0.323SS..Hα-helixtrans-78.1-48178.2176.50000113.4E351 Y352 V353E351-S355 VanDerWaalsContact O-CB 3.31Å; E351-S355 WeakPolarHBondContact O-CB 3.23Å; E351-S355 PolarHBondContact O-N 2.97Å; Y352-S355 PolarHBondContact O-N 3.38Å; V353-S355 VanDerWaalsContact C-N 3.27Å; V353-S355 PolarHBondContact O-N 3.47Å
356Q94.5Very high96Very high105 Ų10565.1 Ų65.149%0.49135%0.345SS..Hα-helixtrans-89.9-27.7-172.3-58.4-55-76.400113.2Y352 P358Y352-Q356 HydrophobicContact CD1-CG 4.31Å; Y352-Q356 HydrophobicContact CD2-CG 4.04Å; Y352-Q356 HydrophobicContact CE1-CB 4.28Å; Y352-Q356 HydrophobicContact CE1-CG 3.95Å; Y352-Q356 HydrophobicContact CE2-CG 3.67Å; Y352-Q356 HydrophobicContact CG-CG 4.34Å; Y352-Q356 WeakPolarHBondContact O-CB 3.29Å; Y352-Q356 WeakPolarHBondContact O-CG 3.41Å; Y352-Q356 PolarHBondContact O-N 3.18Å; Q356-P358 WeakPolarHBondContact O-CD 3.33Å
357Y94Very high96Very high58 Ų5862.1 Ų62.123%0.22733%0.331CS..  trans-123.253.4-178.1-58.7-73.5000112.9D312 E315 Y352 V353 N359 Q360D312-Y357 WeakPolarHBondContact OD2-CE2 3.21Å; D312-Y357 PolarHBondContact OD2-OH 2.96Å; D312-Y357 VanDerWaalsContact OD2-OH 3.12Å; E315-Y357 WeakPolarHBondContact OE1-CE2 3.41Å; Y352-Y357 HydrophobicContact CE1-CE2 4.36Å; V353-Y357 CarbonylContact O-C 3.58Å; V353-Y357 WeakPolarHBondContact O-CA 3.47Å; V353-Y357 WeakPolarHBondContact O-CB 3.42Å; V353-Y357 PolarHBondContact O-N 3.28Å; Y357-N359 PolarHBondContact O-N 3.34Å; Y357-N359 VanDerWaalsContact O-N 3.08Å; Y357-Q360 PolarHBondContact O-N 3.35Å
358P92.9Very high96.1Very high87 Ų8761.1 Ų61.157%0.56532%0.321SS*.THydrogen-bonded Turntrans-59.6-26.3-177.826-35.6000113.2Q356 Q360Q356-P358 WeakPolarHBondContact O-CD 3.33Å; P358-Q360 VanDerWaalsContact C-N 3.27Å; P358-Q360 PolarHBondContact O-N 3.22Å
359N94.9Very high96.1Very high155 Ų15566.7 Ų66.783%0.82935%0.35SS*.THydrogen-bonded Turntrans-79.6-1.7175.6-63-24.7000113.9Y357 P361Y357-N359 PolarHBondContact O-N 3.34Å; Y357-N359 VanDerWaalsContact O-N 3.08Å; N359-P361 VanDerWaalsContact C-CD 3.46Å
360Q95.4Very high96.1Very high78 Ų7869.1 Ų69.136%0.36436%0.359SS..  trans-124.762.8179.5-54.1-176.238.900111.7Y357 P358 T362 R363Y357-Q360 PolarHBondContact O-N 3.35Å; P358-Q360 VanDerWaalsContact C-N 3.27Å; P358-Q360 PolarHBondContact O-N 3.22Å; Q360-T362 PolarHBondContact O-N 3.45Å; Q360-R363 HydrophobicContact CB-CB 3.86Å; Q360-R363 WeakPolarHBondContact O-CB 3.32Å; Q360-R363 PolarHBondContact O-N 3.32Å; Q360-R363 VanDerWaalsContact OE1-NH1 3.1Å
361P93.3Very high96Very high118 Ų11866.7 Ų66.777%0.76635%0.348SS*.THydrogen-bonded Turntrans-59.8-18.4-174.424.1-35.4000114.8N359N359-P361 VanDerWaalsContact C-CD 3.46Å
362T97.2Very high96.1Very high83 Ų8369.4 Ų69.451%0.50937%0.369SS..THydrogen-bonded Turntrans-87.7-4.8175.255.20000114.4Q360 F364 G365 K366Q360-T362 PolarHBondContact O-N 3.45Å; T362-F364 PolarHBondContact O-N 3.26Å; T362-G365 PolarHBondContact O-N 2.92Å; T362-K366 WeakPolarHBondContact O-CG 3.45Å; T362-K366 PolarHBondContact O-N 3.46Å; T362-K366 WeakPolarHBondContact OG1-CE 3.44Å; T362-K366 PolarHBondContact OG1-NZ 3.35Å
363R97.9Very high96Very high11 Ų1168 Ų684%0.04237%0.367CS..Hα-helixtrans-62.5-44.6-170.4-176.9174.9-176.188.12.5112.7L309 H310 E315 V353 Q360 G365 K366 L367L309-R363 PolarHBondContact O-NH1 2.96Å; L309-R363 PolarHBondContact O-NH2 2.88Å; H310-R363 PolarHBondContact O-NH2 3.48Å; E315-R363 IonicContact OE1-CZ 3.45Å; E315-R363 IonicContact OE1-NE 2.7Å; E315-R363 PolarHBondContact OE1-NE 3.48Å; E315-R363 IonicContact OE1-NH2 3.33Å; E315-R363 PolarHBondContact OE1-NH2 2.95Å; E315-R363 IonicContact OE2-CZ 3.56Å; E315-R363 IonicContact OE2-NE 3.61Å; E315-R363 IonicContact OE2-NH2 2.69Å; E315-R363 PolarHBondContact OE2-NH2 3.07Å; V353-R363 HydrophobicContact CG1-CB 3.71Å; V353-R363 HydrophobicContact CG1-CG 4Å; Q360-R363 HydrophobicContact CB-CB 3.86Å; Q360-R363 WeakPolarHBondContact O-CB 3.32Å; Q360-R363 PolarHBondContact O-N 3.32Å; Q360-R363 VanDerWaalsContact OE1-NH1 3.1Å; R363-G365 PolarHBondContact O-N 3.13Å; R363-K366 WeakPolarHBondContact O-CB 3.44Å; R363-K366 PolarHBondContact O-N 2.86Å; R363-K366 VanDerWaalsContact O-N 3.11Å; R363-L367 HydrophobicContact CG-CD1 4.06Å; R363-L367 HydrophobicContact CG-CG 4.34Å; R363-L367 VanDerWaalsContact O-CG 3.31Å; R363-L367 WeakPolarHBondContact O-CG 3.37Å; R363-L367 PolarHBondContact O-N 3.28Å
364F98.4Very high95.9Very high46 Ų4667.8 Ų67.820%0.20237%0.365CS..Hα-helixtrans-55.5-50.8177.6174.7-113.1000111.9Q346 L349 E350 V353 T362 K366 L367 L368Q346-F364 WeakPolarHBondContact O-CE2 3.42Å; L349-F364 HydrophobicContact CB-CD2 4.4Å; L349-F364 HydrophobicContact CB-CE2 4.14Å; L349-F364 HydrophobicContact CD2-CD2 4.2Å; L349-F364 HydrophobicContact CD2-CE2 4.2Å; L349-F364 HydrophobicContact CG-CD2 3.99Å; L349-F364 HydrophobicContact CG-CE2 4.15Å; E350-F364 VanDerWaalsContact CA-CD2 3.5Å; E350-F364 HydrophobicContact CB-CD1 4.3Å; E350-F364 HydrophobicContact CB-CD2 3.8Å; E350-F364 HydrophobicContact CB-CE1 4.11Å; E350-F364 HydrophobicContact CB-CE2 3.59Å; E350-F364 HydrophobicContact CB-CG 4.14Å; E350-F364 HydrophobicContact CB-CZ 3.74Å; E350-F364 HydrophobicContact CG-CD1 3.77Å; E350-F364 HydrophobicContact CG-CD2 4.07Å; E350-F364 HydrophobicContact CG-CE1 3.84Å; E350-F364 HydrophobicContact CG-CE2 4.15Å; E350-F364 HydrophobicContact CG-CG 3.86Å; E350-F364 HydrophobicContact CG-CZ 4.02Å; V353-F364 HydrophobicContact CB-CB 4.46Å; V353-F364 HydrophobicContact CG1-CB 4.14Å; T362-F364 PolarHBondContact O-N 3.26Å; F364-K366 PolarHBondContact O-N 3.31Å; F364-L367 PolarHBondContact O-N 2.91Å; F364-L368 HydrophobicContact CD1-CD1 4.37Å; F364-L368 HydrophobicContact CD2-CG 4.48Å; F364-L368 HydrophobicContact CE1-CD1 3.73Å; F364-L368 HydrophobicContact CE2-CD1 3.92Å; F364-L368 HydrophobicContact CE2-CD2 4.43Å; F364-L368 HydrophobicContact CE2-CG 4.14Å; F364-L368 HydrophobicContact CZ-CD1 3.49Å; F364-L368 VanDerWaalsContact CZ-CD1 3.49Å; F364-L368 HydrophobicContact CZ-CG 4.22Å; F364-L368 PolarHBondContact O-N 2.86Å
365G98.2Very high95.9Very high33 Ų3368.5 Ų68.534%0.3437%0.368SS..Hα-helixtrans-61.3-40.7175.400000113T362 R363 L367 L368 L369T362-G365 PolarHBondContact O-N 2.92Å; R363-G365 PolarHBondContact O-N 3.13Å; G365-L367 VanDerWaalsContact C-N 3.34Å; G365-L367 PolarHBondContact O-N 2.9Å; G365-L368 PolarHBondContact O-N 2.85Å; G365-L369 VanDerWaalsContact O-CB 3.26Å; G365-L369 WeakPolarHBondContact O-CB 3.4Å; G365-L369 WeakPolarHBondContact O-CD1 3.39Å; G365-L369 WeakPolarHBondContact O-CG 3.34Å; G365-L369 PolarHBondContact O-N 3.07Å
366K98.1Very high96Very high105 Ų10568.6 Ų68.646%0.45737%0.366SS..Hα-helixtrans-61.5-39.7176-74.1173.9178.2177.30112.7L309 T362 R363 F364L309-K366 HydrophobicContact CD2-CB 4.22Å; L309-K366 HydrophobicContact CD2-CD 4.32Å; T362-K366 WeakPolarHBondContact O-CG 3.45Å; T362-K366 PolarHBondContact O-N 3.46Å; T362-K366 WeakPolarHBondContact OG1-CE 3.44Å; T362-K366 PolarHBondContact OG1-NZ 3.35Å; R363-K366 WeakPolarHBondContact O-CB 3.44Å; R363-K366 PolarHBondContact O-N 2.86Å; R363-K366 VanDerWaalsContact O-N 3.11Å; F364-K366 PolarHBondContact O-N 3.31Å
367L98.5Very high96Very high1 Ų163.9 Ų63.91%0.00534%0.344CS..Hα-helixtrans-67.1-51.3177.2-66.2168.9000111.2L309 V311 E315 L319 L349 V353 R363 F364 G365 L369 R370L309-L367 HydrophobicContact CD1-CD2 4.29Å; V311-L367 HydrophobicContact CG1-CD2 4.3Å; V311-L367 HydrophobicContact CG2-CD2 3.65Å; E315-L367 HydrophobicContact CB-CD1 4.45Å; E315-L367 HydrophobicContact CG-CD1 4.14Å; E315-L367 WeakPolarHBondContact OE1-CD1 3.47Å; L319-L367 HydrophobicContact CD1-CD2 4.29Å; L319-L367 HydrophobicContact CD2-CB 4.3Å; L349-L367 HydrophobicContact CD1-CD1 4.16Å; V353-L367 HydrophobicContact CG2-CD1 3.83Å; R363-L367 HydrophobicContact CG-CD1 4.06Å; R363-L367 HydrophobicContact CG-CG 4.34Å; R363-L367 VanDerWaalsContact O-CG 3.31Å; R363-L367 WeakPolarHBondContact O-CG 3.37Å; R363-L367 PolarHBondContact O-N 3.28Å; F364-L367 PolarHBondContact O-N 2.91Å; G365-L367 VanDerWaalsContact C-N 3.34Å; G365-L367 PolarHBondContact O-N 2.9Å; L367-L369 VanDerWaalsContact C-N 3.28Å; L367-L369 PolarHBondContact O-N 2.81Å; L367-R370 WeakPolarHBondContact O-CB 3.45Å; L367-R370 PolarHBondContact O-N 3.16Å
368L98.3Very high95.8Very high44 Ų4463.5 Ų63.523%0.2335%0.35CS..Hα-helixtrans-59.8-38.8177-67.5-171.9000112.2I322 L349 F364 G365 R370 L371 P372I322-L368 HydrophobicContact CD1-CD2 3.92Å; L349-L368 HydrophobicContact CD2-CD2 4.18Å; F364-L368 HydrophobicContact CD1-CD1 4.37Å; F364-L368 HydrophobicContact CD2-CG 4.48Å; F364-L368 HydrophobicContact CE1-CD1 3.73Å; F364-L368 HydrophobicContact CE2-CD1 3.92Å; F364-L368 HydrophobicContact CE2-CD2 4.43Å; F364-L368 HydrophobicContact CE2-CG 4.14Å; F364-L368 HydrophobicContact CZ-CD1 3.49Å; F364-L368 VanDerWaalsContact CZ-CD1 3.49Å; F364-L368 HydrophobicContact CZ-CG 4.22Å; F364-L368 PolarHBondContact O-N 2.86Å; G365-L368 PolarHBondContact O-N 2.85Å; L368-R370 PolarHBondContact O-N 3.13Å; L368-L371 HydrophobicContact CD2-CD1 4.16Å; L368-L371 WeakPolarHBondContact O-CB 3.49Å; L368-L371 PolarHBondContact O-N 3.06Å; L368-P372 WeakPolarHBondContact O-CD 3.36Å
369L97.5Very high95.9Very high117 Ų11761.2 Ų61.261%0.61334%0.336SS*.THydrogen-bonded Turntrans-65-5.7175-74.5170.1000114G365 L367G365-L369 VanDerWaalsContact O-CB 3.26Å; G365-L369 WeakPolarHBondContact O-CB 3.4Å; G365-L369 WeakPolarHBondContact O-CD1 3.39Å; G365-L369 WeakPolarHBondContact O-CG 3.34Å; G365-L369 PolarHBondContact O-N 3.07Å; L367-L369 VanDerWaalsContact C-N 3.28Å; L367-L369 PolarHBondContact O-N 2.81Å
370R97.6Very high95.6Very high51 Ų5156.1 Ų56.119%0.19231%0.313CS..THydrogen-bonded Turntrans-81.5-30.2167.7-58.5-62.474.7-126.7-8113L306 L309 L367 L368 S373 L374L306-R370 HydrophobicContact CD2-CB 4.03Å; L306-R370 HydrophobicContact CD2-CG 4.04Å; L309-R370 HydrophobicContact CD1-CG 3.65Å; L367-R370 WeakPolarHBondContact O-CB 3.45Å; L367-R370 PolarHBondContact O-N 3.16Å; L368-R370 PolarHBondContact O-N 3.13Å; R370-S373 PolarHBondContact NH1-OG 3.21Å; R370-S373 VanDerWaalsContact NH1-OG 3.1Å; R370-S373 PolarHBondContact NH2-OG 3.12Å; R370-S373 WeakPolarHBondContact O-CA 3.44Å; R370-S373 VanDerWaalsContact O-CB 3.26Å; R370-S373 WeakPolarHBondContact O-CB 3.5Å; R370-S373 PolarHBondContact O-N 2.89Å; R370-L374 PolarHBondContact O-N 3.36Å
371L97Very high95.3Very high24 Ų2452.7 Ų52.713%0.12630%0.297CS..Hα-helixtrans-57.4-48.6-173.7-56.5-177.1000112.9L319 I322 V323 L368 S373 L374L319-L371 HydrophobicContact CB-CD2 4.39Å; L319-L371 HydrophobicContact CD2-CD1 4.27Å; L319-L371 HydrophobicContact CD2-CD2 3.77Å; L319-L371 HydrophobicContact CD2-CG 4.15Å; I322-L371 HydrophobicContact CB-CD1 4.24Å; I322-L371 HydrophobicContact CG2-CD1 3.58Å; V323-L371 HydrophobicContact CG2-CD2 3.64Å; L368-L371 HydrophobicContact CD2-CD1 4.16Å; L368-L371 WeakPolarHBondContact O-CB 3.49Å; L368-L371 PolarHBondContact O-N 3.06Å; L371-S373 PolarHBondContact O-N 2.91Å; L371-S373 VanDerWaalsContact O-N 3.07Å; L371-L374 HydrophobicContact CD2-CD1 3.85Å; L371-L374 WeakPolarHBondContact O-CB 3.14Å; L371-L374 WeakPolarHBondContact O-CG 3.25Å; L371-L374 PolarHBondContact O-N 2.92Å
372P95.9Very high95.2Very high89 Ų8947 Ų4758%0.57826%0.26SS*.Hα-helixtrans-63.4-20.1176.2-21.234000114L368L368-P372 WeakPolarHBondContact O-CD 3.36Å
373S94.1Very high94.9Very high25 Ų2545.1 Ų45.118%0.17525%0.245CC..Hα-helixtrans-78.8-23.9176.2-50.10000112.5R370 L371 R375 T376R370-S373 PolarHBondContact NH1-OG 3.21Å; R370-S373 VanDerWaalsContact NH1-OG 3.1Å; R370-S373 PolarHBondContact NH2-OG 3.12Å; R370-S373 WeakPolarHBondContact O-CA 3.44Å; R370-S373 VanDerWaalsContact O-CB 3.26Å; R370-S373 WeakPolarHBondContact O-CB 3.5Å; R370-S373 PolarHBondContact O-N 2.89Å; L371-S373 PolarHBondContact O-N 2.91Å; L371-S373 VanDerWaalsContact O-N 3.07Å; S373-R375 VanDerWaalsContact C-N 3.3Å; S373-R375 PolarHBondContact O-N 3.48Å; S373-T376 WeakPolarHBondContact O-CB 3.48Å; S373-T376 WeakPolarHBondContact O-CG2 3.43Å; S373-T376 PolarHBondContact O-N 3.34Å; S373-T376 PolarHBondContact O-OG1 3.47Å
374L94.8Very high94.3Very high2 Ų248.8 Ų48.81%0.0126%0.263CS..Hα-helixtrans-61.5-40.9178-55.5-180000110.9E255 V258 L259 L306 V323 R370 L371 T376 V377E255-L374 HydrophobicContact CB-CB 4.15Å; E255-L374 HydrophobicContact CB-CD1 4.08Å; E255-L374 HydrophobicContact CG-CB 3.88Å; V258-L374 HydrophobicContact CB-CD2 4.29Å; V258-L374 HydrophobicContact CG1-CD2 3.76Å; L259-L374 HydrophobicContact CD1-CD1 4.21Å; L259-L374 HydrophobicContact CD2-CD1 4.14Å; L259-L374 HydrophobicContact CD2-CD2 4.5Å; L259-L374 HydrophobicContact CG-CD1 3.97Å; L306-L374 HydrophobicContact CD1-CD2 4.1Å; V323-L374 HydrophobicContact CG2-CD1 4.12Å; R370-L374 PolarHBondContact O-N 3.36Å; L371-L374 HydrophobicContact CD2-CD1 3.85Å; L371-L374 WeakPolarHBondContact O-CB 3.14Å; L371-L374 WeakPolarHBondContact O-CG 3.25Å; L371-L374 PolarHBondContact O-N 2.92Å; L374-T376 PolarHBondContact O-N 2.68Å; L374-V377 PolarHBondContact O-N 3.32Å
375R93.4Very high93.7Very high135 Ų13546.7 Ų46.751%0.50925%0.254SS..THydrogen-bonded Turntrans-60.2-10.3176.8-63.8-177.1178.7-172.6-1.9114.9E255 D328 S373 V377E255-R375 HydrophobicContact CG-CG 4.27Å; E255-R375 WeakPolarHBondContact OE1-CG 3.21Å; E255-R375 IonicContact OE1-CZ 3.94Å; E255-R375 IonicContact OE1-NE 3.14Å; E255-R375 PolarHBondContact OE1-NE 2.87Å; E255-R375 IonicContact OE1-NH2 3.95Å; E255-R375 PolarHBondContact OE1-NH2 2.91Å; D328-R375 IonicContact OD2-CZ 2.65Å; D328-R375 VanDerWaalsContact OD2-CZ 3.24Å; D328-R375 IonicContact OD2-NH1 2.66Å; D328-R375 PolarHBondContact OD2-NH1 2.78Å; D328-R375 IonicContact OD2-NH2 2.81Å; D328-R375 PolarHBondContact OD2-NH2 2.88Å; S373-R375 VanDerWaalsContact C-N 3.3Å; S373-R375 PolarHBondContact O-N 3.48Å; R375-V377 VanDerWaalsContact C-N 3.28Å
376T94.2Very high93.2Very high73 Ų7345.2 Ų45.245%0.44824%0.238SC..THydrogen-bonded Turntrans-75.1-17.7171.467.10000113Q302 S373 L374Q302-T376 PolarHBondContact NE2-OG1 2.93Å; S373-T376 WeakPolarHBondContact O-CB 3.48Å; S373-T376 WeakPolarHBondContact O-CG2 3.43Å; S373-T376 PolarHBondContact O-N 3.34Å; S373-T376 PolarHBondContact O-OG1 3.47Å; L374-T376 PolarHBondContact O-N 2.68Å
377V94.2Very high92.8Very high6 Ų640.4 Ų40.44%0.03622%0.217CC..SBendtrans-93104.8174.6-171.30000108.6V258 I298 F299 Q302 L374 R375 I382V258-V377 HydrophobicContact CG2-CB 3.94Å; V258-V377 HydrophobicContact CG2-CG1 4.04Å; V258-V377 HydrophobicContact CG2-CG2 4.09Å; I298-V377 HydrophobicContact CG2-CG2 4.42Å; F299-V377 HydrophobicContact CB-CG1 3.96Å; F299-V377 HydrophobicContact CB-CG2 4.25Å; F299-V377 HydrophobicContact CD2-CG1 3.9Å; F299-V377 HydrophobicContact CD2-CG2 4.11Å; F299-V377 HydrophobicContact CG-CG1 3.97Å; Q302-V377 HydrophobicContact CB-CG2 4.37Å; Q302-V377 HydrophobicContact CG-CG2 3.87Å; L374-V377 PolarHBondContact O-N 3.32Å; R375-V377 VanDerWaalsContact C-N 3.28Å; V377-I382 HydrophobicContact CG1-CD1 3.87Å; V377-I382 HydrophobicContact CG1-CG1 3.87Å
378S91.1Very high92.1Very high50 Ų5044 Ų4435%0.3524%0.239SC..  trans-64.1139.6-179.7-176.80000111.9S380 V381 I382S378-S380 VanDerWaalsContact C-N 3.27Å; S378-S380 PolarHBondContact O-N 3.47Å; S378-S380 PolarHBondContact OG-N 2.92Å; S378-S380 PolarHBondContact OG-OG 3.37Å; S378-V381 WeakPolarHBondContact O-CB 3.43Å; S378-V381 PolarHBondContact O-N 2.87Å; S378-V381 VanDerWaalsContact O-N 3.11Å; S378-I382 PolarHBondContact O-N 3.11Å
379S93.3Very high91.2Very high40 Ų4048.2 Ų48.228%0.2825%0.252SS..Hα-helixtrans-51.6-47.7168.148.20000111.3V381 I382 E383S379-V381 PolarHBondContact O-N 3.49Å; S379-V381 VanDerWaalsContact O-N 3.16Å; S379-I382 WeakPolarHBondContact O-CA 3.31Å; S379-I382 WeakPolarHBondContact O-CB 3.47Å; S379-I382 PolarHBondContact O-N 3.17Å; S379-E383 WeakPolarHBondContact O-CG 3.28Å; S379-E383 PolarHBondContact O-N 3.04Å
380S89.4Confident90.4Very high48 Ų4846.9 Ų46.934%0.33625%0.245SC..Hα-helixtrans-59-28.1178.671.10000114.5S378 Q384S378-S380 VanDerWaalsContact C-N 3.27Å; S378-S380 PolarHBondContact O-N 3.47Å; S378-S380 PolarHBondContact OG-N 2.92Å; S378-S380 PolarHBondContact OG-OG 3.37Å; S380-Q384 WeakPolarHBondContact O-CB 3.34Å; S380-Q384 WeakPolarHBondContact O-CG 3.22Å; S380-Q384 PolarHBondContact O-N 3.01Å; S380-Q384 VanDerWaalsContact O-N 3.12Å; S380-Q384 PolarHBondContact O-NE2 3.17Å
381V88.3Confident89.7Confident5 Ų546.4 Ų46.43%0.0325%0.248CC..Hα-helixtrans-74.4-43.6174.2162.50000110.3H295 S378 S379 E383 Q384 L385H295-V381 HydrophobicContact CB-CG1 3.84Å; H295-V381 HydrophobicContact CB-CG2 3.84Å; S378-V381 WeakPolarHBondContact O-CB 3.43Å; S378-V381 PolarHBondContact O-N 2.87Å; S378-V381 VanDerWaalsContact O-N 3.11Å; S379-V381 PolarHBondContact O-N 3.49Å; S379-V381 VanDerWaalsContact O-N 3.16Å; V381-E383 VanDerWaalsContact C-N 3.32Å; V381-E383 PolarHBondContact O-N 3.46Å; V381-Q384 PolarHBondContact O-N 2.97Å; V381-L385 HydrophobicContact CG1-CD1 3.66Å; V381-L385 HydrophobicContact CG1-CG 4.36Å; V381-L385 WeakPolarHBondContact O-CB 3.13Å; V381-L385 VanDerWaalsContact O-CG 3.23Å; V381-L385 WeakPolarHBondContact O-CG 3.22Å; V381-L385 PolarHBondContact O-N 3.21Å
382I92Very high89Confident0 Ų047.1 Ų47.10%026%0.261CS..Hα-helixtrans-61.6-42.1175-62.8168.2000110W253 F257 V258 V377 S378 S379 L385 F386 F387W253-I382 HydrophobicContact CH2-CB 4.17Å; W253-I382 HydrophobicContact CH2-CG2 3.98Å; W253-I382 HydrophobicContact CZ3-CB 4.24Å; W253-I382 HydrophobicContact CZ3-CG2 3.65Å; F257-I382 HydrophobicContact CD1-CD1 3.98Å; F257-I382 HydrophobicContact CD1-CG1 4.3Å; F257-I382 HydrophobicContact CD1-CG2 3.62Å; F257-I382 HydrophobicContact CD2-CG2 4.36Å; F257-I382 HydrophobicContact CE1-CG2 3.63Å; F257-I382 HydrophobicContact CE2-CG2 4.37Å; F257-I382 HydrophobicContact CG-CG2 4.01Å; F257-I382 HydrophobicContact CZ-CG2 4.03Å; V258-I382 HydrophobicContact CG2-CD1 4.24Å; V377-I382 HydrophobicContact CG1-CD1 3.87Å; V377-I382 HydrophobicContact CG1-CG1 3.87Å; S378-I382 PolarHBondContact O-N 3.11Å; S379-I382 WeakPolarHBondContact O-CA 3.31Å; S379-I382 WeakPolarHBondContact O-CB 3.47Å; S379-I382 PolarHBondContact O-N 3.17Å; I382-L385 PolarHBondContact O-N 2.88Å; I382-F386 HydrophobicContact CG2-CD2 4.04Å; I382-F386 WeakPolarHBondContact O-CD2 3.36Å; I382-F386 PolarHBondContact O-N 3.21Å; I382-F386 VanDerWaalsContact O-N 3.15Å; I382-F387 HydrophobicContact CG2-CD2 4.24Å; I382-F387 HydrophobicContact CG2-CE2 3.84Å
383E90.6Very high88.2Confident42 Ų4252.9 Ų52.920%0.19628%0.277CS..Iπ-helixtrans-57.7-51.3174.1-68.2-167.8130.300112.2W253 S379 V381 L385 F386 F387 V388 I396W253-E383 HydrophobicContact CH2-CG 3.79Å; W253-E383 HydrophobicContact CZ2-CG 3.93Å; S379-E383 WeakPolarHBondContact O-CG 3.28Å; S379-E383 PolarHBondContact O-N 3.04Å; V381-E383 VanDerWaalsContact C-N 3.32Å; V381-E383 PolarHBondContact O-N 3.46Å; E383-L385 PolarHBondContact O-N 3.4Å; E383-F386 PolarHBondContact O-N 3.31Å; E383-F387 WeakPolarHBondContact O-CA 3.47Å; E383-F387 PolarHBondContact O-N 3.49Å; E383-V388 PolarHBondContact O-N 3.42Å; E383-I396 HydrophobicContact CG-CG1 3.83Å; E383-I396 WeakPolarHBondContact OE1-CG1 3.46Å; E383-I396 PolarHBondContact OE1-N 3.42Å
384Q85.8Confident87.8Confident89 Ų8954.6 Ų54.642%0.41629%0.286SS..Iπ-helixtrans-64.4-36.9-179.3-73.3168.545.100113.3F292 S380 V381F292-Q384 HydrophobicContact CE2-CB 3.99Å; F292-Q384 HydrophobicContact CZ-CB 4.44Å; S380-Q384 WeakPolarHBondContact O-CB 3.34Å; S380-Q384 WeakPolarHBondContact O-CG 3.22Å; S380-Q384 PolarHBondContact O-N 3.01Å; S380-Q384 VanDerWaalsContact O-N 3.12Å; S380-Q384 PolarHBondContact O-NE2 3.17Å; V381-Q384 PolarHBondContact O-N 2.97Å
385L85.9Confident87.4Confident2 Ų257.3 Ų57.31%0.0130%0.304CS..Iπ-helixtrans-71.3-37-179.7-75.4168000113.3L273 F292 I296 F299 V381 I382 E383L273-L385 HydrophobicContact CB-CD2 3.94Å; L273-L385 HydrophobicContact CD1-CD2 4.45Å; L273-L385 HydrophobicContact CD2-CD2 4.27Å; L273-L385 HydrophobicContact CG-CD2 4.44Å; F292-L385 HydrophobicContact CE1-CD2 3.54Å; F292-L385 HydrophobicContact CE1-CG 4.46Å; F292-L385 HydrophobicContact CZ-CD2 3.44Å; F292-L385 VanDerWaalsContact CZ-CD2 3.44Å; F292-L385 HydrophobicContact CZ-CG 3.89Å; I296-L385 HydrophobicContact CD1-CD2 4.09Å; I296-L385 HydrophobicContact CG1-CD2 3.67Å; F299-L385 HydrophobicContact CD1-CD1 4.24Å; V381-L385 HydrophobicContact CG1-CD1 3.66Å; V381-L385 HydrophobicContact CG1-CG 4.36Å; V381-L385 WeakPolarHBondContact O-CB 3.13Å; V381-L385 VanDerWaalsContact O-CG 3.23Å; V381-L385 WeakPolarHBondContact O-CG 3.22Å; V381-L385 PolarHBondContact O-N 3.21Å; I382-L385 PolarHBondContact O-N 2.88Å; E383-L385 PolarHBondContact O-N 3.4Å
386F87.9Confident87.3Confident1 Ų150.9 Ų50.90%0.00428%0.28CS..Iπ-helixtrans-127.4-31.1-165.4-55.1-65.2000115.6I216 C217 A220 F257 M266 L268 L273 F299 I382 E383I216-F386 HydrophobicContact CG2-CD1 4.13Å; I216-F386 HydrophobicContact CG2-CE1 3.76Å; C217-F386 PolarHBondContact SG-O 3.17Å; C217-F386 VanDerWaalsContact SG-O 3.4Å; A220-F386 HydrophobicContact CB-CB 3.54Å; A220-F386 HydrophobicContact CB-CD1 3.91Å; A220-F386 HydrophobicContact CB-CD2 4.42Å; A220-F386 HydrophobicContact CB-CG 3.69Å; F257-F386 HydrophobicContact CE1-CD2 4.01Å; F257-F386 AromaticContact CE1-CE2 3.95Å; F257-F386 HydrophobicContact CE1-CE2 3.95Å; F257-F386 AromaticContact CZ-CD2 3.8Å; F257-F386 HydrophobicContact CZ-CD2 3.8Å; F257-F386 HydrophobicContact CZ-CE2 4.09Å; F257-F386 HydrophobicContact CZ-CG 4.35Å; M266-F386 HydrophobicContact CE-CD1 3.75Å; M266-F386 HydrophobicContact CE-CE1 3.3Å; M266-F386 HydrophobicContact CE-CE2 4.32Å; M266-F386 HydrophobicContact CE-CG 4.42Å; M266-F386 HydrophobicContact CE-CZ 3.65Å; M266-F386 HydrophobicContact SD-CZ 4.41Å; L268-F386 HydrophobicContact CD2-CZ 3.9Å; L273-F386 HydrophobicContact CD2-CD1 4.45Å; L273-F386 HydrophobicContact CD2-CE1 3.49Å; L273-F386 VanDerWaalsContact CD2-CE1 3.49Å; L273-F386 HydrophobicContact CD2-CZ 3.89Å; F299-F386 HydrophobicContact CD1-CE2 4.33Å; F299-F386 HydrophobicContact CD1-CZ 4.48Å; F299-F386 AromaticContact CE1-CE2 3.63Å; F299-F386 HydrophobicContact CE1-CE2 3.63Å; F299-F386 AromaticContact CE1-CZ 3.79Å; F299-F386 HydrophobicContact CE1-CZ 3.79Å; I382-F386 HydrophobicContact CG2-CD2 4.04Å; I382-F386 WeakPolarHBondContact O-CD2 3.36Å; I382-F386 PolarHBondContact O-N 3.21Å; I382-F386 VanDerWaalsContact O-N 3.15Å; E383-F386 PolarHBondContact O-N 3.31Å
387F88.4Confident87Confident5 Ų549.7 Ų49.72%0.02227%0.269CS..Iπ-helixtrans-109.6-29.6-163.4-66.2-80.8000114.2A220 A221 L224 W253 F257 I382 E383 R389 L390 V391 I396A220-F387 HydrophobicContact CB-CE2 4.4Å; A220-F387 HydrophobicContact CB-CZ 4.12Å; A221-F387 HydrophobicContact CB-CE1 4.44Å; L224-F387 HydrophobicContact CB-CE1 4.04Å; L224-F387 HydrophobicContact CB-CZ 3.79Å; L224-F387 HydrophobicContact CD2-CD1 4.24Å; L224-F387 HydrophobicContact CD2-CE1 3.52Å; L224-F387 HydrophobicContact CD2-CZ 3.81Å; L224-F387 HydrophobicContact CG-CE1 4.43Å; L224-F387 HydrophobicContact CG-CZ 4.39Å; W253-F387 HydrophobicContact CZ3-CE2 4.46Å; F257-F387 HydrophobicContact CD2-CE2 4.38Å; F257-F387 HydrophobicContact CD2-CZ 4.34Å; F257-F387 AromaticContact CE2-CE2 3.86Å; F257-F387 HydrophobicContact CE2-CE2 3.86Å; F257-F387 AromaticContact CE2-CZ 3.82Å; F257-F387 HydrophobicContact CE2-CZ 3.82Å; F257-F387 HydrophobicContact CZ-CE2 4.28Å; I382-F387 HydrophobicContact CG2-CD2 4.24Å; I382-F387 HydrophobicContact CG2-CE2 3.84Å; E383-F387 WeakPolarHBondContact O-CA 3.47Å; E383-F387 PolarHBondContact O-N 3.49Å; F387-R389 PolarHBondContact O-N 3.07Å; F387-R389 VanDerWaalsContact O-N 3.11Å; F387-L390 WeakPolarHBondContact O-CA 3.35Å; F387-L390 PolarHBondContact O-N 2.73Å; F387-V391 HydrophobicContact CB-CG2 4.25Å; F387-V391 WeakPolarHBondContact O-CG2 3.24Å; F387-V391 PolarHBondContact O-N 3.01Å; F387-I396 HydrophobicContact CB-CD1 3.94Å; F387-I396 HydrophobicContact CB-CG1 4.42Å; F387-I396 HydrophobicContact CD1-CD1 3.74Å; F387-I396 HydrophobicContact CD2-CD1 4.45Å; F387-I396 HydrophobicContact CE1-CD1 4.37Å; F387-I396 HydrophobicContact CG-CD1 3.78Å; F387-I396 HydrophobicContact CG-CG1 4.28Å
388V84.5Confident86.7Confident77 Ų7751.2 Ų51.247%0.46728%0.279SS..Hα-helixtrans-54-34.9178167.20000112.5E383 L390 G392E383-V388 PolarHBondContact O-N 3.42Å; V388-L390 VanDerWaalsContact C-N 3.33Å; V388-L390 PolarHBondContact O-N 3.24Å; V388-G392 VanDerWaalsContact O-CA 3.29Å; V388-G392 WeakPolarHBondContact O-CA 3.44Å; V388-G392 PolarHBondContact O-N 3.4Å; V388-G392 VanDerWaalsContact O-N 3.15Å
389R78.6Confident86.5Confident131 Ų13150.7 Ų50.749%0.49427%0.272SS..Hα-helixtrans-71.9-19.9174.7-76.5-167.960.6-177.7-5.1115E214 A276 F387E214-R389 IonicContact OE1-CZ 3.14Å; E214-R389 IonicContact OE1-NH1 2.66Å; E214-R389 IonicContact OE1-NH2 2.7Å; E214-R389 PolarHBondContact OE1-NH2 3.44Å; A276-R389 VanDerWaalsContact O-CD 3.28Å; A276-R389 WeakPolarHBondContact O-CD 3.31Å; F387-R389 PolarHBondContact O-N 3.07Å; F387-R389 VanDerWaalsContact O-N 3.11Å
390L81.8Confident86.3Confident89 Ų8948.9 Ų48.947%0.46626%0.259SS..Hα-helixtrans-104.2-37.3-174.1-62.2179.7000112.9C217 A221 F387 V388C217-L390 HydrophobicContact CB-CD1 4.13Å; C217-L390 HydrophobicContact CB-CD2 4.44Å; C217-L390 HydrophobicContact CB-CG 4.36Å; A221-L390 HydrophobicContact CB-CD1 3.86Å; F387-L390 WeakPolarHBondContact O-CA 3.35Å; F387-L390 PolarHBondContact O-N 2.73Å; V388-L390 VanDerWaalsContact C-N 3.33Å; V388-L390 PolarHBondContact O-N 3.24Å
391V82.9Confident86.2Confident41 Ų4150.9 Ų50.925%0.24826%0.259CS..Hα-helixtrans-123.53.9-172.3-50.40000113.3F387 K393 T394 I396 L399F387-V391 HydrophobicContact CB-CG2 4.25Å; F387-V391 WeakPolarHBondContact O-CG2 3.24Å; F387-V391 PolarHBondContact O-N 3.01Å; V391-K393 PolarHBondContact O-N 2.85Å; V391-T394 WeakPolarHBondContact CG2-O 3.35Å; V391-T394 WeakPolarHBondContact O-CB 3.27Å; V391-T394 PolarHBondContact O-N 2.8Å; V391-T394 PolarHBondContact O-OG1 2.88Å; V391-I396 HydrophobicContact CG2-CD1 4.22Å; V391-L399 HydrophobicContact CB-CD1 3.9Å; V391-L399 HydrophobicContact CG1-CD1 3.57Å; V391-L399 HydrophobicContact CG2-CD1 4.05Å
392G81.9Confident86.2Confident39 Ų3954.7 Ų54.740%0.40228%0.279SS..THydrogen-bonded Turntrans66.5-117.1175.900000112.6V388V388-G392 VanDerWaalsContact O-CA 3.29Å; V388-G392 WeakPolarHBondContact O-CA 3.44Å; V388-G392 PolarHBondContact O-N 3.4Å; V388-G392 VanDerWaalsContact O-N 3.15Å
393K79.1Confident85.9Confident211 Ų21157.4 Ų57.492%0.91729%0.293SS*.THydrogen-bonded Turntrans-99.99.3179.2-64-179.4179.9175.90113.2V391 P395V391-K393 PolarHBondContact O-N 2.85Å; K393-P395 WeakPolarHBondContact O-CD 3.29Å
394T85Confident85.5Confident60 Ų6056 Ų5637%0.36829%0.286SS..  trans-80.2116.3-177.5-45.70000109.8V391 T398 L399V391-T394 WeakPolarHBondContact CG2-O 3.35Å; V391-T394 WeakPolarHBondContact O-CB 3.27Å; V391-T394 PolarHBondContact O-N 2.8Å; V391-T394 PolarHBondContact O-OG1 2.88Å; T394-T398 HydrophobicContact CG2-CG2 4.38Å; T394-L399 HydrophobicContact CG2-CD2 3.89Å; T394-L399 HydrophobicContact CG2-CG 4.16Å
395P87.3Confident85Confident60 Ų6058.8 Ų58.839%0.3930%0.304SS..  trans-64.5142180-20.632.9000111.5K393 E397 T398K393-P395 WeakPolarHBondContact O-CD 3.29Å; P395-E397 PolarHBondContact O-N 3.48Å; P395-T398 WeakPolarHBondContact O-CA 3.39Å; P395-T398 WeakPolarHBondContact O-CB 3.43Å; P395-T398 PolarHBondContact O-N 2.9Å; P395-T398 PolarHBondContact O-OG1 2.89Å
396I90.7Very high84.9Confident0 Ų061.7 Ų61.70%032%0.318CS..Hα-helixtrans-60.5-30.5-178.4-67.8-55.3000112.2L224 W253 E383 F387 V391 T398 L399 I400L224-I396 HydrophobicContact CD1-CG2 3.98Å; L224-I396 HydrophobicContact CD2-CD1 3.91Å; L224-I396 HydrophobicContact CD2-CG2 3.78Å; W253-I396 HydrophobicContact CD2-CB 4.47Å; W253-I396 HydrophobicContact CD2-CG2 3.66Å; W253-I396 HydrophobicContact CE3-CG2 3.88Å; W253-I396 HydrophobicContact CG-CG2 4.23Å; W253-I396 HydrophobicContact CH2-CB 3.98Å; W253-I396 HydrophobicContact CH2-CG1 3.91Å; W253-I396 HydrophobicContact CH2-CG2 3.97Å; W253-I396 HydrophobicContact CZ2-CB 3.64Å; W253-I396 HydrophobicContact CZ2-CG1 4.04Å; W253-I396 HydrophobicContact CZ2-CG2 3.75Å; W253-I396 HydrophobicContact CZ3-CG1 4.47Å; W253-I396 HydrophobicContact CZ3-CG2 4.03Å; E383-I396 HydrophobicContact CG-CG1 3.83Å; E383-I396 WeakPolarHBondContact OE1-CG1 3.46Å; E383-I396 PolarHBondContact OE1-N 3.42Å; F387-I396 HydrophobicContact CB-CD1 3.94Å; F387-I396 HydrophobicContact CB-CG1 4.42Å; F387-I396 HydrophobicContact CD1-CD1 3.74Å; F387-I396 HydrophobicContact CD2-CD1 4.45Å; F387-I396 HydrophobicContact CE1-CD1 4.37Å; F387-I396 HydrophobicContact CG-CD1 3.78Å; F387-I396 HydrophobicContact CG-CG1 4.28Å; V391-I396 HydrophobicContact CG2-CD1 4.22Å; I396-T398 PolarHBondContact O-N 2.93Å; I396-L399 HydrophobicContact CD1-CD1 3.91Å; I396-L399 PolarHBondContact O-N 3.4Å; I396-L399 VanDerWaalsContact O-N 3.11Å; I396-I400 HydrophobicContact CG2-CD1 3.65Å; I396-I400 HydrophobicContact CG2-CG1 4.06Å; I396-I400 WeakPolarHBondContact O-CG1 3.43Å; I396-I400 PolarHBondContact O-N 3.15Å
397E88.4Confident84.8Confident47 Ų4764.8 Ų64.822%0.2234%0.335CS..Hα-helixtrans-62.8-20.8173.8-6275.6-161.100113.3R250 W253 P395R250-E397 HydrophobicContact CB-CB 4.48Å; R250-E397 HydrophobicContact CB-CG 4.19Å; R250-E397 HydrophobicContact CG-CB 3.84Å; R250-E397 HydrophobicContact CG-CG 4.08Å; R250-E397 VanDerWaalsContact CZ-O 3.25Å; R250-E397 PolarHBondContact NE-O 3.15Å; R250-E397 PolarHBondContact NH2-O 3.25Å; W253-E397 PolarHBondContact NE1-OE1 3.18Å; P395-E397 PolarHBondContact O-N 3.48Å
398T87.6Confident84.6Confident39 Ų3968.2 Ų68.224%0.23935%0.352CS..Hα-helixtrans-75.5-51.5172.2-46.50000109.5T394 P395 I396 I400 R401 D402T394-T398 HydrophobicContact CG2-CG2 4.38Å; P395-T398 WeakPolarHBondContact O-CA 3.39Å; P395-T398 WeakPolarHBondContact O-CB 3.43Å; P395-T398 PolarHBondContact O-N 2.9Å; P395-T398 PolarHBondContact O-OG1 2.89Å; I396-T398 PolarHBondContact O-N 2.93Å; T398-I400 PolarHBondContact O-N 2.82Å; T398-R401 VanDerWaalsContact CG2-NH2 3.33Å; T398-R401 WeakPolarHBondContact O-CB 3.48Å; T398-R401 PolarHBondContact O-N 3.1Å; T398-D402 VanDerWaalsContact O-CG 3.32Å; T398-D402 PolarHBondContact O-N 3.16Å; T398-D402 VanDerWaalsContact O-N 3.16Å
399L87.5Confident84.6Confident39 Ų3967.6 Ų67.620%0.20435%0.345CS..Hα-helixtrans-64.7-37.2-178.5-57178.9000112.5V391 T394 I396 R401 D402 M403V391-L399 HydrophobicContact CB-CD1 3.9Å; V391-L399 HydrophobicContact CG1-CD1 3.57Å; V391-L399 HydrophobicContact CG2-CD1 4.05Å; T394-L399 HydrophobicContact CG2-CD2 3.89Å; T394-L399 HydrophobicContact CG2-CG 4.16Å; I396-L399 HydrophobicContact CD1-CD1 3.91Å; I396-L399 PolarHBondContact O-N 3.4Å; I396-L399 VanDerWaalsContact O-N 3.11Å; L399-R401 VanDerWaalsContact C-N 3.32Å; L399-R401 PolarHBondContact O-N 3.14Å; L399-D402 CarbonylContact O-C 3.44Å; L399-D402 PolarHBondContact O-N 2.7Å; L399-D402 VanDerWaalsContact O-N 3.1Å; L399-M403 HydrophobicContact CB-CE 4.33Å; L399-M403 WeakPolarHBondContact O-CB 3.46Å; L399-M403 VanDerWaalsContact O-CG 3.24Å; L399-M403 WeakPolarHBondContact O-CG 3.46Å; L399-M403 PolarHBondContact O-N 3.35Å
400I88.9Confident85Confident1 Ų163.7 Ų63.71%0.00534%0.336CS..Hα-helixtrans-57.9-44.4175-74.7166.1000111.4V228 L249 W253 I396 T398 D402 M403 L404V228-I400 HydrophobicContact CG2-CG1 4.18Å; L249-I400 HydrophobicContact CB-CG2 3.71Å; W253-I400 HydrophobicContact CB-CD1 3.42Å; W253-I400 VanDerWaalsContact CB-CD1 3.42Å; W253-I400 HydrophobicContact CD2-CD1 4.24Å; W253-I400 HydrophobicContact CG-CD1 3.45Å; W253-I400 VanDerWaalsContact CG-CD1 3.45Å; I396-I400 HydrophobicContact CG2-CD1 3.65Å; I396-I400 HydrophobicContact CG2-CG1 4.06Å; I396-I400 WeakPolarHBondContact O-CG1 3.43Å; I396-I400 PolarHBondContact O-N 3.15Å; T398-I400 PolarHBondContact O-N 2.82Å; I400-D402 VanDerWaalsContact C-N 3.31Å; I400-D402 PolarHBondContact O-N 3.11Å; I400-M403 PolarHBondContact O-N 2.84Å; I400-L404 HydrophobicContact CG2-CD1 3.9Å; I400-L404 WeakPolarHBondContact O-CD1 3.49Å; I400-L404 VanDerWaalsContact O-CG 3.27Å; I400-L404 WeakPolarHBondContact O-CG 3.17Å; I400-L404 PolarHBondContact O-N 3.32Å
401R87.5Confident85.2Confident90 Ų9062 Ų6234%0.3433%0.327SS..Hα-helixtrans-61-44.8174.7177.6-158.565.3-147.7-11.5110.2V246 T398 L399 M403 L404 L405V246-R401 HydrophobicContact CG1-CB 4.31Å; V246-R401 HydrophobicContact CG1-CG 4.45Å; V246-R401 HydrophobicContact CG2-CG 4.36Å; T398-R401 VanDerWaalsContact CG2-NH2 3.33Å; T398-R401 WeakPolarHBondContact O-CB 3.48Å; T398-R401 PolarHBondContact O-N 3.1Å; L399-R401 VanDerWaalsContact C-N 3.32Å; L399-R401 PolarHBondContact O-N 3.14Å; R401-M403 PolarHBondContact O-N 3.3Å; R401-L404 PolarHBondContact O-N 3.2Å; R401-L405 HydrophobicContact CG-CD1 3.95Å; R401-L405 HydrophobicContact CG-CG 4.48Å; R401-L405 WeakPolarHBondContact O-CG 3.33Å; R401-L405 PolarHBondContact O-N 3.49Å; R401-L405 VanDerWaalsContact O-N 3.14Å
402D86.9Confident85.3Confident85 Ų8563.5 Ų63.546%0.45533%0.333SS..Hα-helixtrans-76.5-8.7-176.7-56.1-21.4000113.1T398 L399 I400T398-D402 VanDerWaalsContact O-CG 3.32Å; T398-D402 PolarHBondContact O-N 3.16Å; T398-D402 VanDerWaalsContact O-N 3.16Å; L399-D402 CarbonylContact O-C 3.44Å; L399-D402 PolarHBondContact O-N 2.7Å; L399-D402 VanDerWaalsContact O-N 3.1Å; I400-D402 VanDerWaalsContact C-N 3.31Å; I400-D402 PolarHBondContact O-N 3.11Å
403M86.9Confident85.6Confident58 Ų5865.4 Ų65.429%0.28633%0.328SS..THydrogen-bonded Turntrans-95.8-6.3168-70.5175-171.500113.4F225 V228 R232 L399 I400 R401F225-M403 HydrophobicContact CD2-SD 4.22Å; V228-M403 HydrophobicContact CG1-CB 3.9Å; V228-M403 HydrophobicContact CG2-SD 4.37Å; R232-M403 PolarHBondContact NH1-O 2.88Å; L399-M403 HydrophobicContact CB-CE 4.33Å; L399-M403 WeakPolarHBondContact O-CB 3.46Å; L399-M403 VanDerWaalsContact O-CG 3.24Å; L399-M403 WeakPolarHBondContact O-CG 3.46Å; L399-M403 PolarHBondContact O-N 3.35Å; I400-M403 PolarHBondContact O-N 2.84Å; R401-M403 PolarHBondContact O-N 3.3Å
404L81.6Confident86.1Confident11 Ų1153.3 Ų53.36%0.05828%0.279CS..THydrogen-bonded Turntrans-103.4-34.1178.9-75.3163000112.7V228 R232 F237 I242 V246 L249 I400 R401V228-L404 HydrophobicContact CG1-CD2 4.06Å; V228-L404 HydrophobicContact CG1-CG 4.1Å; R232-L404 HydrophobicContact CG-CD2 3.81Å; R232-L404 PolarHBondContact NH1-O 3.29Å; F237-L404 HydrophobicContact CE1-CD2 4.36Å; I242-L404 HydrophobicContact CD1-CB 4.31Å; V246-L404 HydrophobicContact CB-CD1 4.43Å; V246-L404 HydrophobicContact CG2-CB 4.43Å; V246-L404 HydrophobicContact CG2-CD1 3.69Å; L249-L404 HydrophobicContact CB-CD1 4.48Å; L249-L404 HydrophobicContact CD1-CD1 3.73Å; L249-L404 HydrophobicContact CD1-CD2 3.68Å; L249-L404 HydrophobicContact CD1-CG 4.16Å; I400-L404 HydrophobicContact CG2-CD1 3.9Å; I400-L404 WeakPolarHBondContact O-CD1 3.49Å; I400-L404 VanDerWaalsContact O-CG 3.27Å; I400-L404 WeakPolarHBondContact O-CG 3.17Å; I400-L404 PolarHBondContact O-N 3.32Å; R401-L404 PolarHBondContact O-N 3.2Å
405L75.1Confident86.2Confident149 Ų14952.6 Ų52.678%0.7827%0.27SS*.  trans-72.30171.9-59.9175.6000112.4I242 R401I242-L405 HydrophobicContact CD1-CD2 4.4Å; I242-L405 HydrophobicContact CG1-CD2 3.9Å; R401-L405 HydrophobicContact CG-CD1 3.95Å; R401-L405 HydrophobicContact CG-CG 4.48Å; R401-L405 WeakPolarHBondContact O-CG 3.33Å; R401-L405 PolarHBondContact O-N 3.49Å; R401-L405 VanDerWaalsContact O-N 3.14Å

Retrieved 405 of 405 residues in 154.8 ms (Link to these results)