A0A077YZG0_TRITR Loading...

Cast domain containing protein

AlphaFold DB , UniProt , Accession A0A077YZG0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 962 aa.

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(Predicted Aligned Error values between residue pairs)
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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M38.2Very low36.3Very low247 Ų247138.9 Ų138.9100%1.21788%0.879SS**  085.80-78.7-87.714200108.7
2S38.4Very low36Very low124 Ų124138.3 Ų138.387%0.86787%0.872SS**  trans-159.8115.9155.2-147.10000107.2
3T37.8Very low35.9Very low144 Ų144140.6 Ų140.688%0.88387%0.873SS**  trans-78.2122.9-176.343.50000110
4A41.3Very low35.6Very low104 Ų104138.9 Ų138.986%0.8687%0.869SS**  trans-107.1124.1164.100000108.3
5G36.1Very low35.5Very low79 Ų79134.7 Ų134.781%0.81486%0.863SS**  trans-77.6157-161.500000116.2
6S31.8Very low35.4Very low131 Ų131137.5 Ų137.592%0.91686%0.864SS**  trans-67.7135.7160.9-68.50000111.5
7A35.1Very low35Very low90 Ų90138.9 Ų138.974%0.74486%0.863SS**  trans-171.5120.1146.400000110.6
8L36.3Very low35Very low175 Ų175138.3 Ų138.392%0.91686%0.862SS**  153.4140.8122.5-77.1171.2000112.3
9K34.3Very low34.6Very low195 Ų195137.2 Ų137.285%0.84886%0.859SS**PPolyproline II helixtrans-80.7155.7-156.8-69.6168.1171.6175.40114.4
10P35.7Very low34.5Very low125 Ų125136.1 Ų136.181%0.81286%0.857SS**PPolyproline II helixtrans-81134.4170.132.1-30.8000111.9
11S34Very low34.4Very low114 Ų114134.9 Ų134.980%0.79785%0.852SS**PPolyproline II helixtrans-88.9127.4175.439.80000111.2
12V33.5Very low34.1Very low131 Ų131129.8 Ų129.879%0.79483%0.83SS**PPolyproline II helixtrans-79.4123.5172.61770000108.4
13L34.5Very low33.8Very low169 Ų169133.9 Ų133.989%0.88583%0.833SS**  trans-120108.4163.2-89.1166.4000108.6
14S30.8Very low33.3Very low117 Ų117136.7 Ų136.782%0.81883%0.829SS**  trans-78.2134166.5-77.50000109.8
15G34.1Very low32.9Very low75 Ų75142.1 Ų142.177%0.77383%0.828SS**  trans-150.480.6179.300000112.3
16M34.4Very low32.7Very low180 Ų180146.1 Ų146.189%0.88783%0.826SS**  trans26.5122.2147.9-56.3-117.368.600121.3
17L28.5Very low32.4Very low162 Ų162147.1 Ų147.185%0.84882%0.821SS**  trans-61.3155.5156.3-70.3154.1000112.9
18P35.1Very low32.3Very low128 Ų128148.4 Ų148.483%0.83182%0.824SS**  trans-126.6135132.128.8-13.7000112
19S27.2Very low31.8Very low116 Ų116147.8 Ų147.881%0.81182%0.822SS**  trans-94.7143.6175.8-155.20000109.8
20S32.8Very low31.6Very low116 Ų116143.2 Ų143.281%0.81182%0.821SS**  trans-164.6136.3160.2-80.90000113.4
21S32.3Very low31.5Very low110 Ų110142 Ų14277%0.76982%0.821SS**  trans62.598.8161.962.50000118.4
22N31.7Very low31.2Very low140 Ų140145.7 Ų145.775%0.74983%0.826SS**  47.291.573.2-80.2-8.3000115.7
23F32.4Very low31.1Very low210 Ų210146 Ų14692%0.92182%0.823SS**  trans-128.996.8144.1-106.8-87.2000108.3
24Y28Very low30.8Very low204 Ų204146.3 Ų146.380%0.882%0.82SS**  trans-91125.4166.5-108.5-100000107.1
25Y32.6Very low30.9Very low217 Ų217152.1 Ų152.185%0.85182%0.824SS**  trans-145.3140.9150.1-114.1-82.9000110
26Q31.2Very low30.8Very low164 Ų164155.5 Ų155.577%0.76682%0.824SS**  trans-72.8148.7-155.9-81.7155.5-51.400115.7
27N27Very low30.6Very low152 Ų152151.5 Ų151.581%0.81382%0.82SS**  trans-58.3140.6155.8-66.4-34.4000111.2
28S31.8Very low30.9Very low116 Ų116152.2 Ų152.281%0.81182%0.819SS**  trans-14394.2160.8-62.20000107.6
29D26.6Very low30.9Very low162 Ų162157.7 Ų157.787%0.86682%0.823SS**  trans-72.4120.4163.5-71.2-47.9000108.7
30A29.8Very low31.2Very low100 Ų100158.6 Ų158.683%0.82682%0.824SS**  trans-171.1139.1154.400000112
31A32.6Very low31Very low98 Ų98158.9 Ų158.981%0.8183%0.826SS**  trans86.476.2159.500000118.2
32E27.4Very low31.1Very low192 Ų192157.2 Ų157.290%0.89783%0.826SS**  trans-65.8114.4137.2-73-179.2144.200108.8
33D33.2Very low31Very low139 Ų139155.8 Ų155.874%0.74383%0.827SS**  trans-162.7110.1152.7-104.1-28.2000112.1
34Q27.2Very low31.1Very low175 Ų175154.6 Ų154.682%0.81882%0.824SS**  trans34103141.4-58.6176.311.800118.7
35R33.5Very low31.3Very low239 Ų239157.2 Ų157.290%0.90283%0.832SS**  trans-139.1107.6147.8-86.7-169.8-111.9-151.9-2.2112.9
36N31.8Very low31.1Very low145 Ų145158.4 Ų158.478%0.77584%0.835SS**  trans52.7106.8135.6-65.8-10.9000120.3E38N36-E38 PolarHBondContact O-N 3.4Å
37A30.6Very low31.2Very low96 Ų96161.7 Ų161.779%0.79384%0.84SS**  trans-62.4114.2152.200000111.2
38E34.8Very low31.6Very low177 Ų177163 Ų16383%0.82785%0.847SS**  trans-96.8101.3160.9-74.1-174.8171.100109N36 T40N36-E38 PolarHBondContact O-N 3.4Å; E38-T40 PolarHBondContact O-N 2.89Å
39R34.3Very low31.5Very low243 Ų243165.5 Ų165.592%0.91785%0.85SS**  trans-78.4103.6166.7-70.3-179.7-177-164.40.7108.3S41R39-S41 PolarHBondContact O-N 3.07Å
40T34.6Very low31.8Very low136 Ų136161.7 Ų161.783%0.83485%0.849SS**  trans-83.1101.8166.651.80000109.8E38E38-T40 PolarHBondContact O-N 2.89Å
41S28.8Very low31.9Very low121 Ų121168.6 Ų168.685%0.84685%0.854SS**  trans-88.7123.1163.6-177.10000108.6R39R39-S41 PolarHBondContact O-N 3.07Å
42G32.9Very low31.9Very low75 Ų75172.5 Ų172.577%0.77386%0.857SS**  trans-150.951.7-175.600000112.8H44G42-H44 PolarHBondContact O-N 2.83Å
43S29.5Very low32.2Very low110 Ų110173.9 Ų173.977%0.76985%0.854SS**  trans-78.793.5171.6-175.10000109.9
44H35.1Very low32.1Very low186 Ų186176 Ų17686%0.86186%0.859SS**  trans-149.995.5171.5-94.761.7000111.6G42G42-H44 PolarHBondContact O-N 2.83Å
45R32.3Very low32.6Very low258 Ų258175.8 Ų175.897%0.97486%0.858SS**  trans165.894.6130.7-96.8-176.5-178.7-164.31.4110.4
46R27.9Very low32.5Very low243 Ų243169.4 Ų169.492%0.91785%0.85SS**  trans-108.7111.4158.1-170.7-172.6-79.2-156.9-2.1106.3
47R32.8Very low32.5Very low232 Ų232167.3 Ų167.388%0.87585%0.846SS**  trans168.1106.2153.8-99.7-177.9-95.6-152.5-0.3110.2
48L35.5Very low32.5Very low181 Ų181167.5 Ų167.595%0.94884%0.841SS**  trans-155.2105.4139-104.3159.5000107.3
49L29.7Very low32.5Very low167 Ų167165.5 Ų165.587%0.87484%0.836SS**  trans-80.3115.5173.9-76.7153000107.8
50G33.9Very low32.1Very low82 Ų82161.9 Ų161.985%0.84584%0.835SS**  trans-113.510516800000109.3
51R30.6Very low32.1Very low246 Ų246163.9 Ų163.993%0.92884%0.835SS**  trans-93.8122-171.8-178.5-175.7-168.3-173.83.5109.4
52M34.4Very low32Very low179 Ų179161.2 Ų161.288%0.88283%0.826SS**  trans-137.797.3167.1-121164.3160.400112.3
53R32.1Very low32Very low222 Ų222166 Ų16684%0.83883%0.833SS**  trans45.5120.1144.4-63.6-178.1-164.5-1251120.9
54H31.6Very low32Very low182 Ų182165.6 Ų165.684%0.84383%0.83SS**  trans-72.5142.8161.2-64.2-97.4000112.7
55H38.2Very low31.5Very low172 Ų172161.2 Ų161.280%0.79682%0.821SS**  trans-119.1109.3143.5-59.3-56.4000104
56S32.1Very low31.3Very low105 Ų105159.9 Ų159.973%0.73482%0.817SS**  48127.582.872.80000111.5
57S30.5Very low31.4Very low100 Ų100153.4 Ų153.470%0.69981%0.807SS**  cis-178.8161.420.8-165.80000108
58C31.5Very low31.1Very low100 Ų100151.5 Ų151.568%0.67681%0.805SS**  trans74135.9152.2-680000118
59D33.2Very low30.9Very low135 Ų135150.3 Ų150.372%0.72280%0.799SS**  cis-154.6135.4-0.2-84.5-39.4000108
60D27.4Very low30.9Very low167 Ų167150.1 Ų150.189%0.89380%0.795SS**  trans-110.4102172.3-160.29.2000105.9
61Q33.6Very low30.7Very low178 Ų178152.2 Ų152.283%0.83279%0.787SS**  trans-106.6110.1171.3-73.3-167.318.100108.5
62G27.2Very low30.7Very low65 Ų65148.7 Ų148.767%0.6779%0.786SS**  trans-70.3147.7179.300000113.5
63L32.8Very low30.3Very low175 Ų175147.8 Ų147.892%0.91679%0.785SS**  trans-131.797.6149.7-76176.9000109.2
64S29Very low30.3Very low102 Ų102141.7 Ų141.771%0.71378%0.782SS**  trans8.4112.2141.8-176.70000118.5
65S25.9Very low30.1Very low94 Ų94142.1 Ų142.166%0.65778%0.784SS**  30.5110.5117-153.40000118.4
66Y27.3Very low29.8Very low231 Ų231138.9 Ų138.991%0.90679%0.787SS**  trans-145113.6144.1-95.8-81.1000109.4
67P29.1Very low29.8Very low106 Ų106139.7 Ų139.769%0.68879%0.788SS**  trans-110.2112.917133.3-20.4000109.9
68F28Very low29.9Very low193 Ų193140.9 Ų140.985%0.84679%0.793SS**  trans-172.8113.1157.2-136.9-111.3000110.7
69L31.5Very low29.8Very low156 Ų156142.9 Ų142.982%0.81780%0.796SS**  171.7124.2116.6-88.8171.5000109.7
70M29.5Very low29.5Very low162 Ų162145.3 Ų145.380%0.79880%0.803SS**  trans-82.5154.2174.9-78.4-133.9173.700111.8
71N28.7Very low29.6Very low127 Ų127147.8 Ų147.868%0.67980%0.8SS**  trans47.7109.3141.8-68.1-21.9000119
72L30.9Very low29.1Very low172 Ų172147.8 Ų147.890%0.90180%0.8SS**  trans-133.296.3136.5-86.1106.6000109.4
73D25.6Very low29.3Very low159 Ų159151.4 Ų151.485%0.8581%0.808SS**  trans-72.3123.9151.5-81.8-42.5000107.9
74A33.1Very low29Very low95 Ų95149.2 Ų149.279%0.78580%0.798SS**  trans-148.6121.6161.700000110.7
75Q27.4Very low28.8Very low191 Ų191149.7 Ų149.789%0.89380%0.796SS**  trans-65.1142.7-178.7-55.9173.510.800112
76A30.5Very low29Very low104 Ų104149.1 Ų149.186%0.8681%0.805SS**  trans-149.4116.2152.800000109.9
77T33.7Very low28.9Very low121 Ų121146.7 Ų146.774%0.74280%0.801SS**  trans-76.5156.9-17543.20000113.6
78P31.3Very low29Very low126 Ų126147.3 Ų147.382%0.81881%0.808SS**  trans-83.7138.6-176.55.813.8000111.7
79I30.6Very low29Very low141 Ų141149.4 Ų149.472%0.72381%0.81SS**  trans-98.5106.3177.4-64.9172.4000108.7R81I79-R81 HydrophobicContact CG2-CG 4.15Å
80E25.8Very low29Very low187 Ų187149.8 Ų149.887%0.87481%0.813SS**  trans-67.5130.3161.5-82.2177.9138.100109.9
81R30Very low29Very low219 Ų219147.8 Ų147.883%0.82682%0.815SS**  trans-125.595.7163.7-76.7-173.6-177.1154.81.7109.1I79I79-R81 HydrophobicContact CG2-CG 4.15Å
82Q24Very low29.1Very low177 Ų177145.3 Ų145.383%0.82782%0.82SS**  trans-76.2125.4156.4-97.1176.6-4600108.6
83V30.7Very low29Very low141 Ų141141.9 Ų141.986%0.85582%0.817SS**  trans-132.8116.9160.7-179.10000107.8
84D26.7Very low29.4Very low130 Ų130141 Ų14170%0.69582%0.816SS**  trans-80.2146.8-178.1-94.9-40000113.2
85V25.2Very low29.2Very low112 Ų112141.6 Ų141.668%0.67981%0.812SS**  trans47111136.8-169.50000119.1
86G29.1Very low29.2Very low81 Ų81143.5 Ų143.584%0.83581%0.811SS**  trans-138.4104.9158.100000111.2
87H26.5Very low29.2Very low181 Ų181144.5 Ų144.584%0.83881%0.812SS**  trans-80.4133.9170.6-75.158.1000109.9
88S31.1Very low29.1Very low119 Ų119143.8 Ų143.883%0.83281%0.808SS**  trans-153.5118.8151.3-167.90000111.3
89R26.5Very low28.9Very low236 Ų236142.9 Ų142.989%0.89180%0.804SS**  trans-77.6135.1169.4-75.3169.3162.3176.4-6.8108.3
90N32.6Very low29Very low164 Ų164144.2 Ų144.288%0.87781%0.812SS**  trans-134.5103.6150.2-108.86.7000109.6G92N90-G92 PolarHBondContact O-N 2.94Å
91S29.4Very low29.3Very low120 Ų120141.1 Ų141.184%0.83981%0.808SS**  trans-76.3103.6169.450.60000109.4
92G31.3Very low29.5Very low75 Ų75140.3 Ų140.377%0.77381%0.811SS**  trans-93.5104.9165.500000109.8N90N90-G92 PolarHBondContact O-N 2.94Å
93A27.4Very low29.9Very low101 Ų101136.2 Ų136.284%0.83581%0.807SS**  trans-79.3122.616900000109.4
94V33.8Very low29.9Very low139 Ų139138.5 Ų138.584%0.84281%0.808SS**  trans-133.7134.4165.9-178.80000108.8
95P29.5Very low30.2Very low109 Ų109140.3 Ų140.371%0.70882%0.817SS**  trans-97.5150.8-16536.9-30.9000114
96R26.9Very low30.5Very low230 Ų230139.3 Ų139.387%0.86882%0.815SS**  trans56.797.3136.5-159.7-178.7-61.5-1471.5117.2
97S31.3Very low30.8Very low125 Ų125140 Ų14087%0.87481%0.807SS**  trans-115.7125.9149.6-174.20000109.8
98T31.1Very low31.2Very low107 Ų107139.6 Ų139.666%0.65681%0.805SS**  trans-84.5143.7-177.133.20000112.1
99S27.7Very low31.2Very low106 Ų106140.5 Ų140.574%0.74180%0.8SS**  trans56.2105145.663.40000119.3
100L31.5Very low31.5Very low170 Ų170134.9 Ų134.989%0.8980%0.797SS**  trans-130.9129.9137.8-85.5168.6000108.9
101P34.1Very low31.6Very low122 Ų122135.2 Ų135.279%0.79279%0.793SS**PPolyproline II helixtrans-81.4129.7-176.15.412.2000110.6A103P101-A103 PolarHBondContact O-N 2.74Å
102K32.9Very low31.7Very low201 Ų201132.8 Ų132.887%0.87479%0.787SS**PPolyproline II helixtrans-72.3116.8170.9-76.9176.4176.2177.30109.4H104K102-H104 PolarHBondContact O-N 2.95Å
103A31.6Very low31.8Very low92 Ų92136.3 Ų136.376%0.7679%0.788SS**PPolyproline II helixtrans-67.2121.2171.500000110.2P101 L105P101-A103 PolarHBondContact O-N 2.74Å; A103-L105 PolarHBondContact O-N 3.42Å
104H32.6Very low32Very low188 Ų188138.8 Ų138.887%0.8779%0.787SS**  trans-71.6105.4166-92.1-90.6000108.9K102 S106K102-H104 PolarHBondContact O-N 2.95Å; H104-S106 PolarHBondContact O-N 2.99Å
105L32.6Very low31.8Very low169 Ų169141 Ų14189%0.88579%0.785SS**  trans-80.794.2162.8-77.7162.5000108A103 S107A103-L105 PolarHBondContact O-N 3.42Å; L105-S107 PolarHBondContact O-N 3.31Å
106S31.5Very low32Very low91 Ų91145.7 Ų145.764%0.63679%0.79SS**  trans-76.895.7169-178.90000108.8H104 H108H104-S106 PolarHBondContact O-N 2.99Å; S106-H108 PolarHBondContact O-N 3.4Å
107S34.8Very low32.2Very low96 Ų96137.7 Ų137.767%0.67178%0.779SS**  trans-77.3103.5171.556.10000109.8L105 L109L105-S107 PolarHBondContact O-N 3.31Å; S107-L109 PolarHBondContact O-N 3.32Å
108H34.3Very low32Very low171 Ų171140.7 Ų140.779%0.79278%0.779SS**  trans-66.195.5164.8-68-95.7000109.4S106S106-H108 PolarHBondContact O-N 3.4Å
109L32.5Very low32Very low138 Ų138143.9 Ų143.972%0.72379%0.787SS**  trans-104.287.3163.6-77.3163.2000107.4S107 H111S107-L109 PolarHBondContact O-N 3.32Å; L109-H111 PolarHBondContact O-N 3.36Å; L109-H111 VanDerWaalsContact O-N 3.11Å
110S32.8Very low32.1Very low119 Ų119145 Ų14583%0.83279%0.792SS**  trans-7494.3170.364.30000108.7G112S110-G112 PolarHBondContact O-N 2.72Å; S110-G112 VanDerWaalsContact O-N 3.13Å
111H33.9Very low32.2Very low170 Ų170145.1 Ų145.179%0.78779%0.792SS**  trans-70.8100.5162.6-83.6-67.3000109.1L109 N113L109-H111 PolarHBondContact O-N 3.36Å; L109-H111 VanDerWaalsContact O-N 3.11Å; H111-N113 VanDerWaalsContact C-N 3.34Å; H111-N113 PolarHBondContact O-N 2.82Å
112G32.4Very low32.1Very low69 Ų69144.6 Ų144.671%0.71179%0.792SS**  trans-6791.2166.500000110S110 L114S110-G112 PolarHBondContact O-N 2.72Å; S110-G112 VanDerWaalsContact O-N 3.13Å; G112-L114 PolarHBondContact O-N 3.15Å
113N32.4Very low31.9Very low149 Ų149139.5 Ų139.580%0.79779%0.787SS**  trans-81.696.2169.3-119.719.6000108.3H111 F115H111-N113 VanDerWaalsContact C-N 3.34Å; H111-N113 PolarHBondContact O-N 2.82Å; N113-F115 VanDerWaalsContact C-N 3.25Å; N113-F115 PolarHBondContact O-N 3.25Å
114L32.9Very low31.9Very low154 Ų154146 Ų14681%0.80679%0.792SS**  trans-68.786.5164.9-91.2108.2000108.7G112 Y116G112-L114 PolarHBondContact O-N 3.15Å; L114-Y116 PolarHBondContact O-N 3.37Å
115F29.2Very low31.7Very low185 Ų185146.2 Ų146.281%0.81179%0.793SS**  trans-82.2102170.3-161.1-101.7000108.5N113 G117N113-F115 VanDerWaalsContact C-N 3.25Å; N113-F115 PolarHBondContact O-N 3.25Å; F115-G117 VanDerWaalsContact C-N 3.29Å; F115-G117 PolarHBondContact O-N 2.74Å
116Y33.9Very low31.8Very low208 Ų208144.2 Ų144.282%0.81679%0.788SS**  trans-6688.5168.2-97.1-92.2000109.1L114 Q118L114-Y116 PolarHBondContact O-N 3.37Å; Y116-Q118 PolarHBondContact O-N 2.83Å
117G30.8Very low31.8Very low62 Ų62145.7 Ų145.764%0.63979%0.793SS**  trans-74.498.116800000110.3F115 Q119F115-G117 VanDerWaalsContact C-N 3.29Å; F115-G117 PolarHBondContact O-N 2.74Å; G117-Q119 PolarHBondContact O-N 2.81Å
118Q27.3Very low31.5Very low187 Ų187148.8 Ų148.887%0.87480%0.802SS**  trans-72.1108.1159.6-78.7179.2-5.700108.5Y116Y116-Q118 PolarHBondContact O-N 2.83Å
119Q30.2Very low31.5Very low175 Ų175149.4 Ų149.482%0.81881%0.805SS**  trans-124.4121.8157.1-97.1-174.5-800109.3G117 L121G117-Q119 PolarHBondContact O-N 2.81Å; Q119-L121 PolarHBondContact O-N 3.27Å
120P31Very low31.5Very low130 Ų130151.1 Ų151.184%0.84482%0.815SS**  trans-75.4110.4-17928.8-30.7000109.6
121L33.7Very low31.3Very low171 Ų171150.9 Ų150.990%0.89581%0.813SS**  trans-83.3120.5172.7-72.3174.5000110.3Q119Q119-L121 PolarHBondContact O-N 3.27Å
122S31.7Very low31.3Very low112 Ų112150.4 Ų150.478%0.78382%0.815SS**  trans-34.1132.8168.8176.40000114.5R124S122-R124 PolarHBondContact O-N 3.45Å
123A27.9Very low31.3Very low94 Ų94150.7 Ų150.778%0.77781%0.811SS**  trans-47.3126.8162.400000111
124R31.9Very low31.1Very low229 Ų229151.9 Ų151.986%0.86482%0.817SS**  trans-136.9104.6163.4-159.9170.3-176.7159.20.2107.5S122 V126S122-R124 PolarHBondContact O-N 3.45Å; R124-V126 PolarHBondContact O-N 2.78Å
125E27.6Very low31Very low191 Ų191148 Ų14889%0.89382%0.815SS**  trans-53.8120.9168.3-70.6167.5140.100109.3
126V34.5Very low31.4Very low127 Ų127145 Ų14577%0.7781%0.814SS**  trans-135.1118.5160.6-178.70000107.4R124R124-V126 PolarHBondContact O-N 2.78Å
127T32.7Very low31.1Very low122 Ų122141.9 Ų141.975%0.74881%0.811SS**  trans-58.4145.1178.942.50000114Q129T127-Q129 PolarHBondContact O-N 3.14Å
128D28.6Very low31.4Very low162 Ų162147 Ų14787%0.86682%0.823SS**  trans-36.2119.5169.7-68.6-49.1000115.1
129Q33.6Very low31.7Very low183 Ų183149 Ų14986%0.85582%0.822SS**  trans-143.776.9154.3-68.3-168.610.100108.8T127T127-Q129 PolarHBondContact O-N 3.14Å
130N33.7Very low31.7Very low174 Ų174148.1 Ų148.193%0.9382%0.824SS**  trans-92101.9165.8-105.5-1.1000108.7
131S28.4Very low32Very low114 Ų114148 Ų14880%0.79782%0.82SS**  trans-132.595.3170.7-154.80000108.4
132I33.8Very low32Very low161 Ų161145.6 Ų145.683%0.82682%0.815SS**  trans-143.591.7164.3-57.7-179.2000103.7
133A31.2Very low32.1Very low75 Ų75145.8 Ų145.862%0.6282%0.816SS**  62.998.276.700000113
134D29.6Very low32.3Very low173 Ų173149.5 Ų149.593%0.92582%0.822SS**  trans56.5118.2136.7-59.4-27000121.5
135G30.4Very low32.3Very low74 Ų74145.8 Ų145.876%0.76382%0.819SS**  trans171.4122.5155.100000113.3
136P36.4Very low32.8Very low121 Ų121143.2 Ų143.279%0.78682%0.817SS**  trans-114.4163-143.440.6-30.8000116.8
137N29.2Very low32.6Very low142 Ų142140.1 Ų140.176%0.75981%0.81SS**  trans50.1104.6140-82-28.9000119.6
138L36Very low32.7Very low169 Ų169142.8 Ų142.889%0.88581%0.814SS**  trans-145.3111139-87.6175.5000111.6
139R33.2Very low33Very low229 Ų229145.1 Ų145.186%0.86482%0.817SS**  trans74.683.3155.2-72.9-177.1170.9-179.7-2.6119
140D31Very low33.3Very low158 Ų158142.2 Ų142.285%0.84581%0.811SS**  trans-61.8129.8141.3-71.1-47.6000111.3
141V36.1Very low33.5Very low127 Ų127143.3 Ų143.377%0.7781%0.808SS**  trans-124.3136.8158.3173.70000106S143V141-S143 PolarHBondContact O-N 2.81Å
142P34.1Very low34Very low121 Ų121140.6 Ų140.679%0.78680%0.798SS**  trans-75123.5-143.1-13.828.5000112.9L144P142-L144 PolarHBondContact O-N 3.49Å
143S34.3Very low34.4Very low116 Ų116141.4 Ų141.481%0.81180%0.798SS**  trans-70.5122.9164.8-1640000108.9V141 D145V141-S143 PolarHBondContact O-N 2.81Å; S143-D145 VanDerWaalsContact C-N 3.28Å; S143-D145 PolarHBondContact O-N 3.38Å
144L32.4Very low35.1Very low171 Ų171146.8 Ų146.890%0.89581%0.81SS**  trans-67.582.3178.2-165.183.6000109.4P142 T146P142-L144 PolarHBondContact O-N 3.49Å; L144-T146 PolarHBondContact O-N 3.44Å
145D31.5Very low36.1Very low152 Ų152145.7 Ų145.781%0.81380%0.798SS**  trans-92.383.4175.7-155.111.1000109.1S143S143-D145 VanDerWaalsContact C-N 3.28Å; S143-D145 PolarHBondContact O-N 3.38Å
146T37.7Very low37.7Very low137 Ų137144.2 Ų144.284%0.8478%0.776SS**  trans-145.793.6164-51.30000109.4L144L144-T146 PolarHBondContact O-N 3.44Å
147G30.5Very low39.3Very low61 Ų61143.5 Ų143.563%0.62977%0.771SS**SBendtrans103.666.7146.500000116.8
148Q34.2Very low41.6Very low178 Ų178143.9 Ų143.983%0.83277%0.768SS**  trans-147.852.8148.7-120.7156-9.200113.1V150Q148-V150 VanDerWaalsContact C-N 3.26Å; Q148-V150 PolarHBondContact O-N 2.94Å
149K35.7Very low43.5Very low211 Ų211142 Ų14292%0.91775%0.751SS**THydrogen-bonded Turntrans-89.254165.3-135.3179.5-167178.10110.3
150V39.8Very low45.9Very low123 Ų123135.8 Ų135.875%0.74573%0.731SS**THydrogen-bonded Turntrans-142.3-4.3175.1-164.90000114.9Q148Q148-V150 VanDerWaalsContact C-N 3.26Å; Q148-V150 PolarHBondContact O-N 2.94Å
151F37.3Very low48.4Very low197 Ų197133.2 Ų133.286%0.86472%0.717SS**  trans-12471.5175.7-88.6-88.1000111.3
152G39.2Very low50.9Low57 Ų57132.3 Ų132.359%0.58871%0.707SS**  trans-149.364.6177.900000110.8
153Q43.3Very low53.4Low177 Ų177134.2 Ų134.283%0.82770%0.699SS**SBendtrans-176.8132.4160-100.5153.741.100107
154H46.1Very low56Low188 Ų188135.8 Ų135.887%0.8769%0.687SS**  trans8649.2-165.8-50-78.8000115.3S156H154-S156 PolarHBondContact O-N 3.37Å; H154-S156 VanDerWaalsContact O-N 3.14Å
155F49.9Very low58.9Low150 Ų150132.7 Ų132.766%0.65867%0.667SS**  trans-64.1111.1140.4-76.8-78.3000105.7Y159F155-Y159 AromaticContact CD1-CD1 3.89Å; F155-Y159 HydrophobicContact CD1-CD1 3.89Å; F155-Y159 HydrophobicContact CD1-CE1 4.17Å; F155-Y159 HydrophobicContact CD1-CG 4.42Å
156S63.1Low61.8Low44 Ų44133 Ų13331%0.30866%0.657SS.*  trans-49137.8-178.6173.50000109.1H154 E158 Y159 E160H154-S156 PolarHBondContact O-N 3.37Å; H154-S156 VanDerWaalsContact O-N 3.14Å; S156-E158 PolarHBondContact O-N 3.39Å; S156-E158 VanDerWaalsContact OG-CB 3.27Å; S156-E158 WeakPolarHBondContact OG-CB 3.4Å; S156-E158 WeakPolarHBondContact OG-CG 3.5Å; S156-E158 PolarHBondContact OG-N 2.95Å; S156-E158 VanDerWaalsContact OG-N 3.09Å; S156-E158 PolarHBondContact OG-OE2 2.92Å; S156-Y159 WeakPolarHBondContact O-CA 3.37Å; S156-Y159 WeakPolarHBondContact O-CB 3.49Å; S156-Y159 PolarHBondContact O-N 3.01Å; S156-E160 PolarHBondContact O-N 3.13Å
157P71.1Confident64.4Low106 Ų106130.5 Ų130.569%0.68864%0.636SS**Hα-helixtrans-48.5-29.1167.3-24.432.4000112E160 L161P157-E160 PolarHBondContact O-N 3.44Å; P157-L161 WeakPolarHBondContact O-CB 3.23Å; P157-L161 PolarHBondContact O-N 2.84Å
158E76.4Confident67.4Low150 Ų150131.5 Ų131.570%0.70163%0.627SS**Hα-helixtrans-65.7-36.7173.7-61.4172.9149.500112.9S156 L161 L162S156-E158 PolarHBondContact O-N 3.39Å; S156-E158 VanDerWaalsContact OG-CB 3.27Å; S156-E158 WeakPolarHBondContact OG-CB 3.4Å; S156-E158 WeakPolarHBondContact OG-CG 3.5Å; S156-E158 PolarHBondContact OG-N 2.95Å; S156-E158 VanDerWaalsContact OG-N 3.09Å; S156-E158 PolarHBondContact OG-OE2 2.92Å; E158-L161 PolarHBondContact O-N 3.09Å; E158-L162 WeakPolarHBondContact O-CB 3.15Å; E158-L162 PolarHBondContact O-N 2.85Å
159Y77.1Confident70.2Confident130 Ų130126.9 Ų126.951%0.5161%0.611SS.*Hα-helixtrans-67.4-41.3175.8-179-95.8000110.9F155 S156 L161 L162 R163F155-Y159 AromaticContact CD1-CD1 3.89Å; F155-Y159 HydrophobicContact CD1-CD1 3.89Å; F155-Y159 HydrophobicContact CD1-CE1 4.17Å; F155-Y159 HydrophobicContact CD1-CG 4.42Å; S156-Y159 WeakPolarHBondContact O-CA 3.37Å; S156-Y159 WeakPolarHBondContact O-CB 3.49Å; S156-Y159 PolarHBondContact O-N 3.01Å; Y159-L161 VanDerWaalsContact C-N 3.35Å; Y159-L162 PolarHBondContact O-N 2.81Å; Y159-R163 VanDerWaalsContact O-CB 3.23Å; Y159-R163 WeakPolarHBondContact O-CB 3.49Å; Y159-R163 PolarHBondContact O-N 2.76Å
160E82.1Confident73Confident98 Ų98119.7 Ų119.746%0.45859%0.585SS.*Hα-helixtrans-64.8-37.7173.2-81.7-127.7178.300112.8S156 P157 R164S156-E160 PolarHBondContact O-N 3.13Å; P157-E160 PolarHBondContact O-N 3.44Å; E160-R164 PolarHBondContact O-N 3.46Å; E160-R164 VanDerWaalsContact O-N 3.08Å; E160-R164 IonicContact OE2-CZ 3.8Å; E160-R164 IonicContact OE2-NH1 3.26Å; E160-R164 PolarHBondContact OE2-NH1 3.46Å; E160-R164 IonicContact OE2-NH2 2.89Å
161L84.2Confident75.6Confident103 Ų103119.2 Ų119.254%0.53957%0.574SS.*Hα-helixtrans-64.6-51.5174-128.791.8000110.5P157 E158 Y159 R163 R164 E165P157-L161 WeakPolarHBondContact O-CB 3.23Å; P157-L161 PolarHBondContact O-N 2.84Å; E158-L161 PolarHBondContact O-N 3.09Å; Y159-L161 VanDerWaalsContact C-N 3.35Å; L161-R163 VanDerWaalsContact C-N 3.27Å; L161-R163 PolarHBondContact O-N 3.39Å; L161-R164 CarbonylContact O-C 3.59Å; L161-R164 WeakPolarHBondContact O-CA 3.28Å; L161-R164 WeakPolarHBondContact O-CB 3.46Å; L161-R164 PolarHBondContact O-N 2.78Å; L161-E165 WeakPolarHBondContact O-CG 3.38Å; L161-E165 PolarHBondContact O-N 2.88Å
162L88.8Confident78.3Confident108 Ų108116.9 Ų116.957%0.56556%0.564SS**Hα-helixtrans-62.3-37.2-178.2-170.266.6000111.2E158 Y159 E165 W166E158-L162 WeakPolarHBondContact O-CB 3.15Å; E158-L162 PolarHBondContact O-N 2.85Å; Y159-L162 PolarHBondContact O-N 2.81Å; L162-E165 PolarHBondContact O-N 3.4Å; L162-W166 WeakPolarHBondContact O-CB 3.39Å; L162-W166 PolarHBondContact O-N 2.97Å
163R87Confident80.8Confident162 Ų162119.6 Ų119.661%0.61156%0.564SS**Hα-helixtrans-65.9-41.3173.6-171.1178.9-179.9-148.30.4112Y159 L161 W166 Q167Y159-R163 VanDerWaalsContact O-CB 3.23Å; Y159-R163 WeakPolarHBondContact O-CB 3.49Å; Y159-R163 PolarHBondContact O-N 2.76Å; L161-R163 VanDerWaalsContact C-N 3.27Å; L161-R163 PolarHBondContact O-N 3.39Å; R163-W166 PolarHBondContact O-N 3.22Å; R163-Q167 WeakPolarHBondContact O-CB 3.44Å; R163-Q167 PolarHBondContact O-N 3.15Å
164R88.2Confident82.8Confident149 Ų149115.6 Ų115.656%0.56255%0.549SS*.Hα-helixtrans-64.4-41.9173.5-82.7-177.3-178.686-0.9111.7E160 L161 Q167 N168E160-R164 PolarHBondContact O-N 3.46Å; E160-R164 VanDerWaalsContact O-N 3.08Å; E160-R164 IonicContact OE2-CZ 3.8Å; E160-R164 IonicContact OE2-NH1 3.26Å; E160-R164 PolarHBondContact OE2-NH1 3.46Å; E160-R164 IonicContact OE2-NH2 2.89Å; L161-R164 CarbonylContact O-C 3.59Å; L161-R164 WeakPolarHBondContact O-CA 3.28Å; L161-R164 WeakPolarHBondContact O-CB 3.46Å; L161-R164 PolarHBondContact O-N 2.78Å; R164-Q167 PolarHBondContact O-N 3.33Å; R164-N168 WeakPolarHBondContact O-CB 3.48Å; R164-N168 PolarHBondContact O-N 3.11Å; R164-N168 PolarHBondContact O-ND2 3.44Å
165E93.8Very high84.8Confident105 Ų105109.4 Ų109.449%0.49153%0.53SS..Hα-helixtrans-63.6-43.7176.4-72.6179.9168.900111.7L161 L162 N168 T169L161-E165 WeakPolarHBondContact O-CG 3.38Å; L161-E165 PolarHBondContact O-N 2.88Å; L162-E165 PolarHBondContact O-N 3.4Å; E165-N168 PolarHBondContact O-N 2.87Å; E165-T169 WeakPolarHBondContact O-CG2 3.47Å; E165-T169 PolarHBondContact O-N 2.83Å; E165-T169 PolarHBondContact O-OG1 3.02Å; E165-T169 VanDerWaalsContact O-OG1 3.12Å
166W91.8Very high86.2Confident159 Ų159105.9 Ų105.960%0.60252%0.521SS*.Hα-helixtrans-60.6-46.6173.9-178.379.3000111.5L162 R163 N168 T169 V170L162-W166 WeakPolarHBondContact O-CB 3.39Å; L162-W166 PolarHBondContact O-N 2.97Å; R163-W166 PolarHBondContact O-N 3.22Å; W166-N168 VanDerWaalsContact C-N 3.34Å; W166-N168 PolarHBondContact O-N 3.48Å; W166-T169 WeakPolarHBondContact CA-OG1 3.43Å; W166-T169 PolarHBondContact O-N 3.32Å; W166-T169 PolarHBondContact O-OG1 2.77Å; W166-V170 HydrophobicContact CD2-CG2 4.24Å; W166-V170 HydrophobicContact CH2-CG2 4.43Å; W166-V170 HydrophobicContact CZ2-CG2 4.05Å; W166-V170 WeakPolarHBondContact O-CG2 3.34Å; W166-V170 PolarHBondContact O-N 2.84Å
167Q92.5Very high87.1Confident84 Ų84108.3 Ų108.339%0.39353%0.529SS..Hα-helixtrans-60.4-44176.5-15574.916.600111.8R163 R164 T169 V170 E171R163-Q167 WeakPolarHBondContact O-CB 3.44Å; R163-Q167 PolarHBondContact O-N 3.15Å; R164-Q167 PolarHBondContact O-N 3.33Å; Q167-T169 PolarHBondContact O-N 3.13Å; Q167-V170 PolarHBondContact O-N 3.17Å; Q167-E171 WeakPolarHBondContact O-CG 3.28Å; Q167-E171 PolarHBondContact O-N 2.79Å
168N93.9Very high87.4Confident82 Ų82107.2 Ų107.244%0.43952%0.517SS..Hα-helixtrans-64-38.2177.5-76.8-26000112.6R164 E165 W166 E171 K172R164-N168 WeakPolarHBondContact O-CB 3.48Å; R164-N168 PolarHBondContact O-N 3.11Å; R164-N168 PolarHBondContact O-ND2 3.44Å; E165-N168 PolarHBondContact O-N 2.87Å; W166-N168 VanDerWaalsContact C-N 3.34Å; W166-N168 PolarHBondContact O-N 3.48Å; N168-E171 PolarHBondContact O-N 3.47Å; N168-K172 WeakPolarHBondContact O-CB 3.33Å; N168-K172 VanDerWaalsContact O-CG 3.25Å; N168-K172 WeakPolarHBondContact O-CG 3.47Å; N168-K172 PolarHBondContact O-N 2.76Å
169T93.1Very high87.3Confident82 Ų82103.1 Ų103.150%0.50351%0.505SS..Hα-helixtrans-68.6-39.2176.351.40000111.5E165 W166 Q167 K172 L173E165-T169 WeakPolarHBondContact O-CG2 3.47Å; E165-T169 PolarHBondContact O-N 2.83Å; E165-T169 PolarHBondContact O-OG1 3.02Å; E165-T169 VanDerWaalsContact O-OG1 3.12Å; W166-T169 WeakPolarHBondContact CA-OG1 3.43Å; W166-T169 PolarHBondContact O-N 3.32Å; W166-T169 PolarHBondContact O-OG1 2.77Å; Q167-T169 PolarHBondContact O-N 3.13Å; T169-K172 PolarHBondContact O-N 3.18Å; T169-L173 VanDerWaalsContact O-CB 3.24Å; T169-L173 WeakPolarHBondContact O-CB 3.38Å; T169-L173 PolarHBondContact O-N 2.83Å
170V94.4Very high87Confident60 Ų60103 Ų10336%0.36451%0.512SS..Hα-helixtrans-62.7-45.4172.9171.80000111W166 Q167 L173 N174W166-V170 HydrophobicContact CD2-CG2 4.24Å; W166-V170 HydrophobicContact CH2-CG2 4.43Å; W166-V170 HydrophobicContact CZ2-CG2 4.05Å; W166-V170 WeakPolarHBondContact O-CG2 3.34Å; W166-V170 PolarHBondContact O-N 2.84Å; Q167-V170 PolarHBondContact O-N 3.17Å; V170-L173 PolarHBondContact O-N 2.76Å; V170-N174 VanDerWaalsContact O-CB 3.3Å; V170-N174 WeakPolarHBondContact O-CB 3.19Å; V170-N174 PolarHBondContact O-N 2.83Å
171E94.2Very high86.4Confident112 Ų112104.8 Ų104.852%0.52352%0.518SS..Hα-helixtrans-64-43.6177.1-75.9176.9-167.600112.3Q167 N168 N174 A175Q167-E171 WeakPolarHBondContact O-CG 3.28Å; Q167-E171 PolarHBondContact O-N 2.79Å; N168-E171 PolarHBondContact O-N 3.47Å; E171-N174 PolarHBondContact O-N 2.84Å; E171-A175 WeakPolarHBondContact O-CB 2.93Å; E171-A175 PolarHBondContact O-N 2.7Å
172K93.3Very high85.8Confident149 Ų149103.6 Ų103.665%0.64852%0.519SS*.Hα-helixtrans-61.3-44.4174-77175.5-178179.60111.7N168 T169 N174 A175 T176N168-K172 WeakPolarHBondContact O-CB 3.33Å; N168-K172 VanDerWaalsContact O-CG 3.25Å; N168-K172 WeakPolarHBondContact O-CG 3.47Å; N168-K172 PolarHBondContact O-N 2.76Å; T169-K172 PolarHBondContact O-N 3.18Å; K172-N174 VanDerWaalsContact C-N 3.31Å; K172-N174 PolarHBondContact O-N 3.38Å; K172-A175 PolarHBondContact O-N 3.23Å; K172-T176 PolarHBondContact O-N 2.83Å; K172-T176 PolarHBondContact O-OG1 3.35Å
173L92Very high84.8Confident113 Ų113106 Ų10659%0.59253%0.525SS*.Hα-helixtrans-60.8-44.3177.2-165.980.2000110.4T169 V170 T176 M177T169-L173 VanDerWaalsContact O-CB 3.24Å; T169-L173 WeakPolarHBondContact O-CB 3.38Å; T169-L173 PolarHBondContact O-N 2.83Å; V170-L173 PolarHBondContact O-N 2.76Å; L173-T176 VanDerWaalsContact C-OG1 3.31Å; L173-T176 VanDerWaalsContact CA-OG1 3.28Å; L173-T176 WeakPolarHBondContact CA-OG1 3.27Å; L173-T176 PolarHBondContact O-N 2.94Å; L173-T176 PolarHBondContact O-OG1 3.31Å; L173-M177 WeakPolarHBondContact O-CB 3.29Å; L173-M177 PolarHBondContact O-N 3.42Å
174N86.7Confident83.5Confident93 Ų93104.2 Ų104.250%0.49752%0.518SS..Hα-helixtrans-67.1-38178.2-151.916.9000111.6V170 E171 K172 M177 N178V170-N174 VanDerWaalsContact O-CB 3.3Å; V170-N174 WeakPolarHBondContact O-CB 3.19Å; V170-N174 PolarHBondContact O-N 2.83Å; E171-N174 PolarHBondContact O-N 2.84Å; K172-N174 VanDerWaalsContact C-N 3.31Å; K172-N174 PolarHBondContact O-N 3.38Å; N174-M177 WeakPolarHBondContact O-CB 3.43Å; N174-M177 PolarHBondContact O-N 3.37Å; N174-N178 WeakPolarHBondContact O-CB 3.2Å; N174-N178 VanDerWaalsContact O-CG 3.23Å; N174-N178 PolarHBondContact O-N 2.96Å; N174-N178 PolarHBondContact O-ND2 3.18Å
175A87.4Confident82.3Confident59 Ų5999 Ų9949%0.48850%0.504SS..Hα-helixtrans-63.9-43.5172.800000112E171 K172 N178 S179E171-A175 WeakPolarHBondContact O-CB 2.93Å; E171-A175 PolarHBondContact O-N 2.7Å; K172-A175 PolarHBondContact O-N 3.23Å; A175-N178 PolarHBondContact O-N 3.1Å; A175-S179 WeakPolarHBondContact O-CB 3.47Å; A175-S179 PolarHBondContact O-N 3.33Å
176T79.8Confident81Confident75 Ų7598.1 Ų98.146%0.4651%0.508SS..Hα-helixtrans-64.8-39.5173.644.80000112.2K172 L173 N178 S179 I180K172-T176 PolarHBondContact O-N 2.83Å; K172-T176 PolarHBondContact O-OG1 3.35Å; L173-T176 VanDerWaalsContact C-OG1 3.31Å; L173-T176 VanDerWaalsContact CA-OG1 3.28Å; L173-T176 WeakPolarHBondContact CA-OG1 3.27Å; L173-T176 PolarHBondContact O-N 2.94Å; L173-T176 PolarHBondContact O-OG1 3.31Å; T176-N178 VanDerWaalsContact C-N 3.32Å; T176-N178 PolarHBondContact O-N 2.84Å; T176-S179 PolarHBondContact O-N 2.77Å; T176-I180 WeakPolarHBondContact O-CB 3.25Å; T176-I180 WeakPolarHBondContact O-CD1 3.31Å; T176-I180 VanDerWaalsContact O-CG1 3.23Å; T176-I180 WeakPolarHBondContact O-CG1 3.28Å; T176-I180 PolarHBondContact O-N 2.83Å
177M82.2Confident79.8Confident95 Ų9597.5 Ų97.547%0.46851%0.512SS..Hα-helixtrans-61.1-42.2175.2-169.391.77800110.9L173 N174 I180 K181L173-M177 WeakPolarHBondContact O-CB 3.29Å; L173-M177 PolarHBondContact O-N 3.42Å; N174-M177 WeakPolarHBondContact O-CB 3.43Å; N174-M177 PolarHBondContact O-N 3.37Å; M177-I180 PolarHBondContact O-N 2.82Å; M177-K181 HydrophobicContact CG-CD 4.49Å; M177-K181 WeakPolarHBondContact O-CB 3.44Å; M177-K181 VanDerWaalsContact O-CG 3.27Å; M177-K181 WeakPolarHBondContact O-CG 3.2Å; M177-K181 PolarHBondContact O-N 3.5Å
178N77.5Confident78.9Confident83 Ų8397.4 Ų97.444%0.44451%0.513SS..Hα-helixtrans-71.6-38177.5-71.3-23.1000112.6N174 A175 T176 K181 S182N174-N178 WeakPolarHBondContact O-CB 3.2Å; N174-N178 VanDerWaalsContact O-CG 3.23Å; N174-N178 PolarHBondContact O-N 2.96Å; N174-N178 PolarHBondContact O-ND2 3.18Å; A175-N178 PolarHBondContact O-N 3.1Å; T176-N178 VanDerWaalsContact C-N 3.32Å; T176-N178 PolarHBondContact O-N 2.84Å; N178-K181 PolarHBondContact O-N 3.32Å; N178-S182 WeakPolarHBondContact O-CB 3.3Å; N178-S182 PolarHBondContact O-N 2.72Å; N178-S182 PolarHBondContact O-OG 3.24Å
179S73.1Confident78.2Confident65 Ų6599.3 Ų99.346%0.45552%0.518SS..Hα-helixtrans-58-51.8170.7-178.20000109.8A175 T176 K181 S182 F183A175-S179 WeakPolarHBondContact O-CB 3.47Å; A175-S179 PolarHBondContact O-N 3.33Å; T176-S179 PolarHBondContact O-N 2.77Å; S179-K181 PolarHBondContact O-N 2.86Å; S179-S182 CarbonylContact O-C 3.6Å; S179-S182 PolarHBondContact O-N 2.94Å; S179-S182 VanDerWaalsContact O-N 3.12Å; S179-S182 PolarHBondContact O-OG 3.32Å; S179-F183 WeakPolarHBondContact O-CB 3.48Å; S179-F183 PolarHBondContact O-N 3.12Å
180I72Confident77.5Confident126 Ų126102.6 Ų102.665%0.64653%0.525SS*.Hα-helixtrans-61.4-43.1179.1-66.6163000111.4T176 M177 S182 F183T176-I180 WeakPolarHBondContact O-CB 3.25Å; T176-I180 WeakPolarHBondContact O-CD1 3.31Å; T176-I180 VanDerWaalsContact O-CG1 3.23Å; T176-I180 WeakPolarHBondContact O-CG1 3.28Å; T176-I180 PolarHBondContact O-N 2.83Å; M177-I180 PolarHBondContact O-N 2.82Å; I180-S182 VanDerWaalsContact C-N 3.27Å; I180-S182 PolarHBondContact O-N 3.36Å; I180-F183 PolarHBondContact O-N 3.39Å
181K69.4Low77.1Confident137 Ų137104 Ų10460%0.59653%0.528SS*.Hα-helixtrans-63.1-29.1176.2-78.4178.3-179.9179.50113.6M177 N178 S179 W184M177-K181 HydrophobicContact CG-CD 4.49Å; M177-K181 WeakPolarHBondContact O-CB 3.44Å; M177-K181 VanDerWaalsContact O-CG 3.27Å; M177-K181 WeakPolarHBondContact O-CG 3.2Å; M177-K181 PolarHBondContact O-N 3.5Å; N178-K181 PolarHBondContact O-N 3.32Å; S179-K181 PolarHBondContact O-N 2.86Å; K181-W184 PolarHBondContact O-NE1 2.88Å
182S70.9Confident76.7Confident78 Ų78104.3 Ų104.355%0.54552%0.524SS..Hα-helixtrans-92.1-20176.758.50000113.1N178 S179 I180 W184N178-S182 WeakPolarHBondContact O-CB 3.3Å; N178-S182 PolarHBondContact O-N 2.72Å; N178-S182 PolarHBondContact O-OG 3.24Å; S179-S182 CarbonylContact O-C 3.6Å; S179-S182 PolarHBondContact O-N 2.94Å; S179-S182 VanDerWaalsContact O-N 3.12Å; S179-S182 PolarHBondContact O-OG 3.32Å; I180-S182 VanDerWaalsContact C-N 3.27Å; I180-S182 PolarHBondContact O-N 3.36Å; S182-W184 PolarHBondContact O-N 2.83Å
183F67.2Low76.4Confident159 Ų159100 Ų10070%0.69752%0.516SS*.  trans-77.454.1175.8-151.9-94.9000111.4S179 I180 S185S179-F183 WeakPolarHBondContact O-CB 3.48Å; S179-F183 PolarHBondContact O-N 3.12Å; I180-F183 PolarHBondContact O-N 3.39Å; F183-S185 PolarHBondContact O-N 3.37Å
184W60.9Low76.1Confident124 Ų12499.2 Ų99.247%0.4751%0.512SS..  trans-65.5117.7159.7-61.986.4000107K181 S182 K189K181-W184 PolarHBondContact O-NE1 2.88Å; S182-W184 PolarHBondContact O-N 2.83Å; W184-K189 HydrophobicContact CB-CD 4.5Å; W184-K189 HydrophobicContact CB-CG 4.32Å
185S61.9Low76.3Confident38 Ų38101.6 Ų101.627%0.26651%0.514SS..  trans-48.7130177-177.50000109.2F183 E187 L188 K189F183-S185 PolarHBondContact O-N 3.37Å; S185-E187 PolarHBondContact O-N 3.31Å; S185-L188 WeakPolarHBondContact O-CB 3.39Å; S185-L188 PolarHBondContact O-N 3.49Å; S185-K189 PolarHBondContact O-N 2.79Å
186P67.6Low76.6Confident88 Ų88106.3 Ų106.357%0.57152%0.524SS*.Hα-helixtrans-49.9-29.8176.4-28.835.3000113.1K189 K190P186-K189 PolarHBondContact O-N 2.84Å; P186-K190 WeakPolarHBondContact O-CG 3.21Å; P186-K190 PolarHBondContact O-N 3.36Å
187E66.4Low76.9Confident146 Ų146107.1 Ų107.168%0.68252%0.522SS*.Hα-helixtrans-64.6-45.1174.4-67.1164.9166.700112.3S185 K189 K190 E191S185-E187 PolarHBondContact O-N 3.31Å; E187-K189 VanDerWaalsContact C-N 3.33Å; E187-K189 PolarHBondContact O-N 2.99Å; E187-K190 CarbonylContact O-C 3.55Å; E187-K190 WeakPolarHBondContact O-CB 3.16Å; E187-K190 PolarHBondContact O-N 3.46Å; E187-E191 WeakPolarHBondContact O-CB 3.33Å; E187-E191 PolarHBondContact O-N 3.11Å
188L73.2Confident77.2Confident82 Ų82107.9 Ų107.943%0.42952%0.524SS..Hα-helixtrans-65.3-35.7177.4-117.1154.8000112.1S185 R192S185-L188 WeakPolarHBondContact O-CB 3.39Å; S185-L188 PolarHBondContact O-N 3.49Å; L188-R192 WeakPolarHBondContact O-CG 3.37Å; L188-R192 PolarHBondContact O-N 3.07Å
189K78.8Confident78Confident121 Ų121106.3 Ų106.353%0.52652%0.523SS..Hα-helixtrans-66.7-44.3171.6-83.8178.4176.5167.50111.6W184 S185 P186 E187 R192 A193W184-K189 HydrophobicContact CB-CD 4.5Å; W184-K189 HydrophobicContact CB-CG 4.32Å; S185-K189 PolarHBondContact O-N 2.79Å; P186-K189 PolarHBondContact O-N 2.84Å; E187-K189 VanDerWaalsContact C-N 3.33Å; E187-K189 PolarHBondContact O-N 2.99Å; K189-R192 PolarHBondContact O-N 3.44Å; K189-A193 PolarHBondContact O-N 3.31Å
190K79.6Confident78.8Confident152 Ų152107 Ų10766%0.66152%0.524SS*.Hα-helixtrans-60.7-43.4174.7-77.6178.4179.7-178.50111.5P186 E187 A193 L194P186-K190 WeakPolarHBondContact O-CG 3.21Å; P186-K190 PolarHBondContact O-N 3.36Å; E187-K190 CarbonylContact O-C 3.55Å; E187-K190 WeakPolarHBondContact O-CB 3.16Å; E187-K190 PolarHBondContact O-N 3.46Å; K190-A193 WeakPolarHBondContact O-CB 3.37Å; K190-A193 PolarHBondContact O-N 3.4Å; K190-L194 WeakPolarHBondContact O-CG 3.47Å; K190-L194 PolarHBondContact O-N 3.16Å
191E85Confident79.8Confident90 Ų90105.7 Ų105.742%0.42151%0.514SS..Hα-helixtrans-66.6-40.2179.6-168.5174.6146.200112.4E187 A193 L194 R195E187-E191 WeakPolarHBondContact O-CB 3.33Å; E187-E191 PolarHBondContact O-N 3.11Å; E191-A193 VanDerWaalsContact C-N 3.31Å; E191-A193 PolarHBondContact O-N 3.43Å; E191-L194 PolarHBondContact O-N 3.42Å; E191-R195 PolarHBondContact O-N 2.83Å; E191-R195 IonicContact OE1-CZ 2.68Å; E191-R195 VanDerWaalsContact OE1-CZ 3.26Å; E191-R195 IonicContact OE1-NH1 2.9Å; E191-R195 PolarHBondContact OE1-NH1 2.91Å; E191-R195 VanDerWaalsContact OE1-NH1 3.11Å; E191-R195 IonicContact OE1-NH2 3.92Å; E191-R195 PolarHBondContact OE1-NH2 3.29Å
192R86Confident80.9Confident118 Ų118104.6 Ų104.645%0.44551%0.514SS..Hα-helixtrans-63.3-37.3171.6-76179.8-174.5159.82112.7L188 K189 K196L188-R192 WeakPolarHBondContact O-CG 3.37Å; L188-R192 PolarHBondContact O-N 3.07Å; K189-R192 PolarHBondContact O-N 3.44Å; R192-K196 WeakPolarHBondContact O-CG 3.11Å; R192-K196 PolarHBondContact O-N 2.66Å
193A87.1Confident82Confident58 Ų58105.5 Ų105.548%0.47951%0.512SS..Hα-helixtrans-65.9-43.8175.500000110.9K189 K190 E191 K196 E197K189-A193 PolarHBondContact O-N 3.31Å; K190-A193 WeakPolarHBondContact O-CB 3.37Å; K190-A193 PolarHBondContact O-N 3.4Å; E191-A193 VanDerWaalsContact C-N 3.31Å; E191-A193 PolarHBondContact O-N 3.43Å; A193-K196 WeakPolarHBondContact O-CB 3.29Å; A193-K196 PolarHBondContact O-N 3.03Å; A193-E197 PolarHBondContact O-N 3.46Å
194L86.3Confident83.2Confident96 Ų96103.4 Ų103.450%0.50351%0.506SS..Hα-helixtrans-60.4-46.4173.9-75.7169.6000111.7K190 E191 K196 E197 E198K190-L194 WeakPolarHBondContact O-CG 3.47Å; K190-L194 PolarHBondContact O-N 3.16Å; E191-L194 PolarHBondContact O-N 3.42Å; L194-K196 VanDerWaalsContact C-N 3.29Å; L194-K196 PolarHBondContact O-N 3.39Å; L194-E197 CarbonylContact O-C 3.59Å; L194-E197 PolarHBondContact O-N 3Å; L194-E197 VanDerWaalsContact O-N 3.1Å; L194-E198 WeakPolarHBondContact O-CG 3.27Å; L194-E198 PolarHBondContact O-N 3.45Å
195R90.1Very high84.7Confident144 Ų144101.7 Ų101.754%0.54351%0.506SS..Hα-helixtrans-61.7-35.3175.1-73.1-145.7-174.780.97.3113.1E191 A199E191-R195 PolarHBondContact O-N 2.83Å; E191-R195 IonicContact OE1-CZ 2.68Å; E191-R195 VanDerWaalsContact OE1-CZ 3.26Å; E191-R195 IonicContact OE1-NH1 2.9Å; E191-R195 PolarHBondContact OE1-NH1 2.91Å; E191-R195 VanDerWaalsContact OE1-NH1 3.11Å; E191-R195 IonicContact OE1-NH2 3.92Å; E191-R195 PolarHBondContact OE1-NH2 3.29Å; R195-A199 VanDerWaalsContact O-CB 3.29Å; R195-A199 WeakPolarHBondContact O-CB 3.44Å; R195-A199 PolarHBondContact O-N 2.85Å
196K93.1Very high86.2Confident158 Ų158102.3 Ų102.369%0.68751%0.505SS*.Hα-helixtrans-65.8-41173.3-82.4-174.8176-172.90111.7R192 A193 L194 A199 T200R192-K196 WeakPolarHBondContact O-CG 3.11Å; R192-K196 PolarHBondContact O-N 2.66Å; A193-K196 WeakPolarHBondContact O-CB 3.29Å; A193-K196 PolarHBondContact O-N 3.03Å; L194-K196 VanDerWaalsContact C-N 3.29Å; L194-K196 PolarHBondContact O-N 3.39Å; K196-A199 PolarHBondContact O-N 3.42Å; K196-T200 WeakPolarHBondContact O-CG2 3.24Å; K196-T200 PolarHBondContact O-N 3.39Å; K196-T200 PolarHBondContact O-OG1 3.1Å
197E87.8Confident87.4Confident92 Ų92102 Ų10243%0.4350%0.498SS..Hα-helixtrans-69.4-37.8176.8-164.4-168.1149.100112.3A193 L194 T200 K201A193-E197 PolarHBondContact O-N 3.46Å; L194-E197 CarbonylContact O-C 3.59Å; L194-E197 PolarHBondContact O-N 3Å; L194-E197 VanDerWaalsContact O-N 3.1Å; E197-T200 WeakPolarHBondContact CA-OG1 3.37Å; E197-T200 PolarHBondContact O-N 2.71Å; E197-T200 PolarHBondContact O-OG1 3.17Å; E197-K201 WeakPolarHBondContact O-CB 3.39Å; E197-K201 VanDerWaalsContact O-CG 3.3Å; E197-K201 WeakPolarHBondContact O-CG 3.4Å; E197-K201 PolarHBondContact O-N 2.73Å; E197-K201 WeakPolarHBondContact OE1-CE 3.29Å; E197-K201 IonicContact OE1-NZ 3.95Å; E197-K201 PolarHBondContact OE1-NZ 2.6Å
198E87.8Confident88.6Confident110 Ų11099.9 Ų99.951%0.51449%0.488SS..Hα-helixtrans-64.5-41.9172.3-74.5175.3166.900111.2L194 T200 K201 L202L194-E198 WeakPolarHBondContact O-CG 3.27Å; L194-E198 PolarHBondContact O-N 3.45Å; E198-T200 PolarHBondContact O-N 2.84Å; E198-K201 PolarHBondContact O-N 3.5Å; E198-L202 WeakPolarHBondContact O-CB 3.15Å; E198-L202 WeakPolarHBondContact O-CG 3.49Å; E198-L202 PolarHBondContact O-N 3.41Å
199A93.3Very high89.5Confident51 Ų51101.4 Ų101.442%0.42150%0.496SS..Hα-helixtrans-62.7-40.1175.900000112.5R195 K196 L202 L203R195-A199 VanDerWaalsContact O-CB 3.29Å; R195-A199 WeakPolarHBondContact O-CB 3.44Å; R195-A199 PolarHBondContact O-N 2.85Å; K196-A199 PolarHBondContact O-N 3.42Å; A199-L202 PolarHBondContact O-N 2.82Å; A199-L203 PolarHBondContact O-N 3.33Å
200T91.2Very high90.3Very high78 Ų78100.1 Ų100.148%0.47949%0.491SS..Hα-helixtrans-69.1-38175.5550000112K196 E197 E198 L203 M204K196-T200 WeakPolarHBondContact O-CG2 3.24Å; K196-T200 PolarHBondContact O-N 3.39Å; K196-T200 PolarHBondContact O-OG1 3.1Å; E197-T200 WeakPolarHBondContact CA-OG1 3.37Å; E197-T200 PolarHBondContact O-N 2.71Å; E197-T200 PolarHBondContact O-OG1 3.17Å; E198-T200 PolarHBondContact O-N 2.84Å; T200-L203 PolarHBondContact O-N 2.88Å; T200-M204 WeakPolarHBondContact O-CG 3.38Å; T200-M204 PolarHBondContact O-N 3.35Å
201K93.1Very high90.8Very high99 Ų9998.4 Ų98.443%0.4349%0.486SS..Hα-helixtrans-61.2-43.5172.6-74.5171.5-174.5167.80111.9E197 E198 M204 L205E197-K201 WeakPolarHBondContact O-CB 3.39Å; E197-K201 VanDerWaalsContact O-CG 3.3Å; E197-K201 WeakPolarHBondContact O-CG 3.4Å; E197-K201 PolarHBondContact O-N 2.73Å; E197-K201 WeakPolarHBondContact OE1-CE 3.29Å; E197-K201 IonicContact OE1-NZ 3.95Å; E197-K201 PolarHBondContact OE1-NZ 2.6Å; E198-K201 PolarHBondContact O-N 3.5Å; K201-M204 PolarHBondContact O-N 2.8Å; K201-L205 WeakPolarHBondContact O-CG 3.38Å; K201-L205 PolarHBondContact O-N 2.86Å
202L91.6Very high91.1Very high114 Ų11496.8 Ų96.860%0.59749%0.488SS*.Hα-helixtrans-63.7-41.5176.3-74.3171.8000112.1E198 A199 L205 Q206E198-L202 WeakPolarHBondContact O-CB 3.15Å; E198-L202 WeakPolarHBondContact O-CG 3.49Å; E198-L202 PolarHBondContact O-N 3.41Å; A199-L202 PolarHBondContact O-N 2.82Å; L202-L205 PolarHBondContact O-N 3.32Å; L202-Q206 WeakPolarHBondContact O-CB 3.41Å; L202-Q206 PolarHBondContact O-N 2.84Å
203L94.3Very high91.4Very high97 Ų9794.6 Ų94.651%0.50849%0.488SS..Hα-helixtrans-59.8-46.8173.7-97.9158.6000112.1A199 T200 L205 Q206 D207A199-L203 PolarHBondContact O-N 3.33Å; T200-L203 PolarHBondContact O-N 2.88Å; L203-L205 VanDerWaalsContact C-N 3.33Å; L203-L205 PolarHBondContact O-N 2.81Å; L203-Q206 WeakPolarHBondContact O-CB 3.09Å; L203-Q206 PolarHBondContact O-N 3.43Å; L203-D207 PolarHBondContact O-N 2.81Å
204M92.6Very high91.7Very high116 Ų11696 Ų9657%0.57149%0.487SS*.Hα-helixtrans-62.4-39.7176.5-71-162.1-56.400112.5T200 K201 D207 Q208T200-M204 WeakPolarHBondContact O-CG 3.38Å; T200-M204 PolarHBondContact O-N 3.35Å; K201-M204 PolarHBondContact O-N 2.8Å; M204-D207 PolarHBondContact O-N 3.28Å; M204-Q208 WeakPolarHBondContact O-CG 3.26Å; M204-Q208 PolarHBondContact O-N 3.44Å
205L91.5Very high91.8Very high88 Ų8895.5 Ų95.546%0.46149%0.485SS..Hα-helixtrans-66.7-38.1175.8-75.1171.5000112K201 L202 L203 Q208 L209K201-L205 WeakPolarHBondContact O-CG 3.38Å; K201-L205 PolarHBondContact O-N 2.86Å; L202-L205 PolarHBondContact O-N 3.32Å; L203-L205 VanDerWaalsContact C-N 3.33Å; L203-L205 PolarHBondContact O-N 2.81Å; L205-Q208 PolarHBondContact O-N 3.18Å; L205-L209 WeakPolarHBondContact O-CB 3.33Å; L205-L209 PolarHBondContact O-N 3.25Å
206Q93Very high91.7Very high51 Ų5191.5 Ų91.524%0.23848%0.479CS..Hα-helixtrans-62.9-42.8175.2-170.5-178.77.300111.3L202 L203 L209 K210L202-Q206 WeakPolarHBondContact O-CB 3.41Å; L202-Q206 PolarHBondContact O-N 2.84Å; L203-Q206 WeakPolarHBondContact O-CB 3.09Å; L203-Q206 PolarHBondContact O-N 3.43Å; Q206-L209 PolarHBondContact O-N 2.95Å; Q206-K210 WeakPolarHBondContact O-CG 3.45Å; Q206-K210 PolarHBondContact O-N 3.31Å
207D93.8Very high91.6Very high82 Ų8289 Ų8944%0.43947%0.47SS..Hα-helixtrans-68.9-38.9176.9-75.2-16.9000112.3L203 M204 L209 K210 M211L203-D207 PolarHBondContact O-N 2.81Å; M204-D207 PolarHBondContact O-N 3.28Å; D207-L209 VanDerWaalsContact C-N 3.32Å; D207-L209 PolarHBondContact O-N 2.89Å; D207-K210 PolarHBondContact O-N 3.28Å; D207-K210 IonicContact OD1-NZ 3.8Å; D207-M211 WeakPolarHBondContact O-CG 3.43Å; D207-M211 PolarHBondContact O-N 3.43Å
208Q91.3Very high91.7Very high100 Ų10091.2 Ų91.247%0.46748%0.478SS..Hα-helixtrans-60-42.1171.2-76.3-178.820.800111.9M204 L205 M211 A212M204-Q208 WeakPolarHBondContact O-CG 3.26Å; M204-Q208 PolarHBondContact O-N 3.44Å; L205-Q208 PolarHBondContact O-N 3.18Å; Q208-M211 PolarHBondContact O-N 2.91Å; Q208-A212 WeakPolarHBondContact O-CB 3.39Å; Q208-A212 PolarHBondContact O-N 2.84Å
209L92.9Very high91.6Very high114 Ų11492 Ų9260%0.59748%0.482SS*.Hα-helixtrans-65.1-42.9177.7-176.964.6000111.5L205 Q206 D207 M211 A212 V213L205-L209 WeakPolarHBondContact O-CB 3.33Å; L205-L209 PolarHBondContact O-N 3.25Å; Q206-L209 PolarHBondContact O-N 2.95Å; D207-L209 VanDerWaalsContact C-N 3.32Å; D207-L209 PolarHBondContact O-N 2.89Å; L209-M211 VanDerWaalsContact C-N 3.34Å; L209-M211 PolarHBondContact O-N 3.44Å; L209-A212 PolarHBondContact O-N 2.9Å; L209-V213 WeakPolarHBondContact O-CG2 3.49Å; L209-V213 PolarHBondContact O-N 2.88Å
210K94.8Very high91.4Very high95 Ų9592.8 Ų92.841%0.41348%0.481SS..Hα-helixtrans-57.7-45.5174.5-75.6174.9-176.7168.30111.7Q206 D207 A212 V213 L214Q206-K210 WeakPolarHBondContact O-CG 3.45Å; Q206-K210 PolarHBondContact O-N 3.31Å; D207-K210 PolarHBondContact O-N 3.28Å; D207-K210 IonicContact OD1-NZ 3.8Å; K210-A212 PolarHBondContact O-N 3.38Å; K210-V213 PolarHBondContact O-N 2.83Å; K210-L214 WeakPolarHBondContact O-CG 3.21Å; K210-L214 PolarHBondContact O-N 3.28Å
211M89.8Confident91.2Very high116 Ų11691.6 Ų91.657%0.57148%0.479SS*.Hα-helixtrans-64.7-38.6177.2-70.4-59.7-70.300112.5D207 Q208 L209 L214 N215D207-M211 WeakPolarHBondContact O-CG 3.43Å; D207-M211 PolarHBondContact O-N 3.43Å; Q208-M211 PolarHBondContact O-N 2.91Å; L209-M211 VanDerWaalsContact C-N 3.34Å; L209-M211 PolarHBondContact O-N 3.44Å; M211-L214 PolarHBondContact O-N 2.87Å; M211-L214 HydrophobicContact SD-CD1 4.38Å; M211-N215 PolarHBondContact O-N 3.33Å
212A90.9Very high91.1Very high56 Ų5690.5 Ų90.546%0.46348%0.481SS..Hα-helixtrans-64.6-42.4175.900000112.2Q208 L209 K210 N215 S216Q208-A212 WeakPolarHBondContact O-CB 3.39Å; Q208-A212 PolarHBondContact O-N 2.84Å; L209-A212 PolarHBondContact O-N 2.9Å; K210-A212 PolarHBondContact O-N 3.38Å; A212-N215 PolarHBondContact O-N 3.48Å; A212-S216 WeakPolarHBondContact O-CB 3.3Å; A212-S216 PolarHBondContact O-N 3.23Å
213V93.5Very high90.8Very high72 Ų7289.3 Ų89.344%0.43647%0.474SS..Hα-helixtrans-64.1-43.7176.1171.90000111.1L209 K210 N215 S216 Q217L209-V213 WeakPolarHBondContact O-CG2 3.49Å; L209-V213 PolarHBondContact O-N 2.88Å; K210-V213 PolarHBondContact O-N 2.83Å; V213-N215 PolarHBondContact O-N 3.44Å; V213-S216 PolarHBondContact O-N 3.04Å; V213-Q217 WeakPolarHBondContact O-CG 3.26Å; V213-Q217 PolarHBondContact O-N 3.07Å
214L92.2Very high90.4Very high87 Ų8790.6 Ų90.646%0.45548%0.477SS..Hα-helixtrans-61.3-42.2175.6-77.9171.9000112.3K210 M211 Q217 K218K210-L214 WeakPolarHBondContact O-CG 3.21Å; K210-L214 PolarHBondContact O-N 3.28Å; M211-L214 PolarHBondContact O-N 2.87Å; M211-L214 HydrophobicContact SD-CD1 4.38Å; L214-Q217 PolarHBondContact O-N 3.36Å; L214-K218 WeakPolarHBondContact O-CG 3.42Å; L214-K218 PolarHBondContact O-N 2.87Å
215N88.7Confident90.1Very high85 Ų8590.9 Ų90.946%0.45548%0.477SS..Hα-helixtrans-66.9-40.1176-91.2-6.2000112.4M211 A212 V213 K218 Q219M211-N215 PolarHBondContact O-N 3.33Å; A212-N215 PolarHBondContact O-N 3.48Å; V213-N215 PolarHBondContact O-N 3.44Å; N215-K218 PolarHBondContact O-N 3.24Å; N215-Q219 WeakPolarHBondContact O-CG 3.2Å; N215-Q219 PolarHBondContact O-N 2.92Å
216S88Confident89.3Confident61 Ų6192 Ų9243%0.42748%0.482SS..Hα-helixtrans-61.9-43.8174.7178.40000111.4A212 V213 K218 Q219 T220A212-S216 WeakPolarHBondContact O-CB 3.3Å; A212-S216 PolarHBondContact O-N 3.23Å; V213-S216 PolarHBondContact O-N 3.04Å; S216-K218 VanDerWaalsContact C-N 3.33Å; S216-K218 PolarHBondContact O-N 3.25Å; S216-Q219 PolarHBondContact O-N 2.89Å; S216-T220 PolarHBondContact O-N 3.49Å; S216-T220 PolarHBondContact O-OG1 2.8Å
217Q90.8Very high88.8Confident106 Ų10693.9 Ų93.950%0.49549%0.49SS..Hα-helixtrans-60.9-40.3175.7-74.4178.816.300112.4V213 L214 T220 A221V213-Q217 WeakPolarHBondContact O-CG 3.26Å; V213-Q217 PolarHBondContact O-N 3.07Å; L214-Q217 PolarHBondContact O-N 3.36Å; Q217-T220 PolarHBondContact O-N 3.39Å; Q217-A221 WeakPolarHBondContact O-CB 3.37Å; Q217-A221 PolarHBondContact O-N 3.46Å
218K91.3Very high87.9Confident137 Ų13792.7 Ų92.760%0.59649%0.492SS*.Hα-helixtrans-61.2-43.9174.1-72.3174.2-177.2178.40111.8L214 N215 S216 A221 V222L214-K218 WeakPolarHBondContact O-CG 3.42Å; L214-K218 PolarHBondContact O-N 2.87Å; N215-K218 PolarHBondContact O-N 3.24Å; S216-K218 VanDerWaalsContact C-N 3.33Å; S216-K218 PolarHBondContact O-N 3.25Å; K218-A221 PolarHBondContact O-N 3.46Å; K218-V222 WeakPolarHBondContact O-CG2 3.47Å; K218-V222 PolarHBondContact O-N 3.45Å
219Q85.7Confident87Confident128 Ų12893.3 Ų93.360%0.59850%0.495SS*.Hα-helixtrans-63.2-44.6177.1-71.3175.8-7.900111.5N215 S216 A221 V222 I223N215-Q219 WeakPolarHBondContact O-CG 3.2Å; N215-Q219 PolarHBondContact O-N 2.92Å; S216-Q219 PolarHBondContact O-N 2.89Å; Q219-A221 PolarHBondContact O-N 2.87Å; Q219-V222 PolarHBondContact O-N 2.84Å; Q219-I223 VanDerWaalsContact O-CG1 3.29Å; Q219-I223 WeakPolarHBondContact O-CG1 3.27Å; Q219-I223 PolarHBondContact O-N 3.3Å
220T87.5Confident85.7Confident67 Ų6792.6 Ų92.641%0.41149%0.491SS..Hα-helixtrans-62.5-41.5176.9-47.10000111.7S216 Q217 V222 I223 E224S216-T220 PolarHBondContact O-N 3.49Å; S216-T220 PolarHBondContact O-OG1 2.8Å; Q217-T220 PolarHBondContact O-N 3.39Å; T220-V222 VanDerWaalsContact C-N 3.34Å; T220-V222 PolarHBondContact O-N 3.48Å; T220-I223 PolarHBondContact O-N 3.33Å; T220-E224 WeakPolarHBondContact O-CG 3.3Å; T220-E224 PolarHBondContact O-N 2.95Å
221A88.6Confident84.4Confident53 Ų5396.8 Ų96.844%0.43850%0.504SS..Hα-helixtrans-62.5-39.5176.600000112.5Q217 K218 Q219 E224 Q225Q217-A221 WeakPolarHBondContact O-CB 3.37Å; Q217-A221 PolarHBondContact O-N 3.46Å; K218-A221 PolarHBondContact O-N 3.46Å; Q219-A221 PolarHBondContact O-N 2.87Å; A221-E224 PolarHBondContact O-N 3.48Å; A221-Q225 WeakPolarHBondContact O-CB 3.34Å; A221-Q225 PolarHBondContact O-N 3.27Å
222V90.2Very high83.2Confident76 Ų7699.3 Ų99.346%0.46151%0.512SS..Hα-helixtrans-65.1-42.8174171.80000110.8K218 Q219 T220 Q225 M226K218-V222 WeakPolarHBondContact O-CG2 3.47Å; K218-V222 PolarHBondContact O-N 3.45Å; Q219-V222 PolarHBondContact O-N 2.84Å; T220-V222 VanDerWaalsContact C-N 3.34Å; T220-V222 PolarHBondContact O-N 3.48Å; V222-Q225 PolarHBondContact O-N 2.82Å; V222-M226 HydrophobicContact CG1-SD 4.35Å; V222-M226 WeakPolarHBondContact O-CG 3.3Å; V222-M226 PolarHBondContact O-N 3.35Å
223I85.1Confident81.5Confident89 Ų89103.2 Ų103.246%0.45652%0.521SS..Hα-helixtrans-62.9-44.9176.7-67.8165.3000110.7Q219 T220 Q225 M226 Q227Q219-I223 VanDerWaalsContact O-CG1 3.29Å; Q219-I223 WeakPolarHBondContact O-CG1 3.27Å; Q219-I223 PolarHBondContact O-N 3.3Å; T220-I223 PolarHBondContact O-N 3.33Å; I223-Q225 VanDerWaalsContact C-N 3.35Å; I223-Q225 PolarHBondContact O-N 2.9Å; I223-M226 PolarHBondContact O-N 2.93Å; I223-Q227 HydrophobicContact CG2-CG 4.33Å; I223-Q227 WeakPolarHBondContact O-CB 3.48Å; I223-Q227 VanDerWaalsContact O-CG 3.28Å; I223-Q227 WeakPolarHBondContact O-CG 3.47Å; I223-Q227 PolarHBondContact O-N 2.62Å
224E85.9Confident79.5Confident123 Ų123103.8 Ų103.858%0.57553%0.527SS*.Hα-helixtrans-62.5-40.2176.3-78.1-178.317000112T220 A221 Q227 A228T220-E224 WeakPolarHBondContact O-CG 3.3Å; T220-E224 PolarHBondContact O-N 2.95Å; A221-E224 PolarHBondContact O-N 3.48Å; E224-Q227 PolarHBondContact O-N 3Å; E224-A228 VanDerWaalsContact O-CB 3.29Å; E224-A228 WeakPolarHBondContact O-CB 3.26Å; E224-A228 PolarHBondContact O-N 2.97Å
225Q85.6Confident77.4Confident123 Ų123102.5 Ų102.558%0.57554%0.535SS*.Hα-helixtrans-62.1-45.2175.1-173.8-179.713.200111.5A221 V222 I223 A228 Q229A221-Q225 WeakPolarHBondContact O-CB 3.34Å; A221-Q225 PolarHBondContact O-N 3.27Å; V222-Q225 PolarHBondContact O-N 2.82Å; I223-Q225 VanDerWaalsContact C-N 3.35Å; I223-Q225 PolarHBondContact O-N 2.9Å; Q225-A228 PolarHBondContact O-N 2.79Å; Q225-Q229 WeakPolarHBondContact O-CG 3.48Å; Q225-Q229 PolarHBondContact O-N 3.21Å
226M76.7Confident75Confident111 Ų111105.3 Ų105.355%0.54755%0.55SS..Hα-helixtrans-64.6-42175.9-70.7-177.970.500111.6V222 I223 A228 Q229 L230V222-M226 HydrophobicContact CG1-SD 4.35Å; V222-M226 WeakPolarHBondContact O-CG 3.3Å; V222-M226 PolarHBondContact O-N 3.35Å; I223-M226 PolarHBondContact O-N 2.93Å; M226-A228 VanDerWaalsContact C-N 3.34Å; M226-A228 PolarHBondContact O-N 2.93Å; M226-Q229 PolarHBondContact O-N 3.44Å; M226-L230 WeakPolarHBondContact O-CG 3.16Å; M226-L230 PolarHBondContact O-N 2.88Å
227Q80.9Confident72.8Confident91 Ų91107.6 Ų107.643%0.42556%0.562SS.*Hα-helixtrans-65.2-36.8175.4-73.8178.41.500112.1I223 E224 L230 R231I223-Q227 HydrophobicContact CG2-CG 4.33Å; I223-Q227 WeakPolarHBondContact O-CB 3.48Å; I223-Q227 VanDerWaalsContact O-CG 3.28Å; I223-Q227 WeakPolarHBondContact O-CG 3.47Å; I223-Q227 PolarHBondContact O-N 2.62Å; E224-Q227 PolarHBondContact O-N 3Å; Q227-L230 PolarHBondContact O-N 3.39Å; Q227-R231 WeakPolarHBondContact O-CB 3.4Å; Q227-R231 VanDerWaalsContact O-CG 3.28Å; Q227-R231 WeakPolarHBondContact O-CG 3.4Å; Q227-R231 PolarHBondContact O-N 2.93Å
228A75.7Confident70.2Confident56 Ų56112.5 Ų112.546%0.46358%0.576SS.*Hα-helixtrans-66.8-40174.800000111.6E224 Q225 M226 R231 F232E224-A228 VanDerWaalsContact O-CB 3.29Å; E224-A228 WeakPolarHBondContact O-CB 3.26Å; E224-A228 PolarHBondContact O-N 2.97Å; Q225-A228 PolarHBondContact O-N 2.79Å; M226-A228 VanDerWaalsContact C-N 3.34Å; M226-A228 PolarHBondContact O-N 2.93Å; A228-R231 PolarHBondContact O-N 3.2Å; A228-F232 WeakPolarHBondContact O-CB 3.27Å; A228-F232 PolarHBondContact O-N 3.48Å
229Q72.4Confident67.5Low113 Ų113112 Ų11253%0.52859%0.587SS.*Hα-helixtrans-61.5-43.6172.2-76.4179.7-26.900111.7Q225 M226 F232 Q233Q225-Q229 WeakPolarHBondContact O-CG 3.48Å; Q225-Q229 PolarHBondContact O-N 3.21Å; M226-Q229 PolarHBondContact O-N 3.44Å; Q229-F232 PolarHBondContact O-N 2.89Å; Q229-Q233 WeakPolarHBondContact O-CG 3.24Å; Q229-Q233 PolarHBondContact O-N 2.98Å
230L65.1Low64.9Low100 Ų100113.3 Ų113.352%0.52459%0.594SS.*Hα-helixtrans-64.9-41.4174.7-71170.3000112M226 Q227 F232 Q233 C234M226-L230 WeakPolarHBondContact O-CG 3.16Å; M226-L230 PolarHBondContact O-N 2.88Å; Q227-L230 PolarHBondContact O-N 3.39Å; L230-F232 VanDerWaalsContact C-N 3.33Å; L230-F232 PolarHBondContact O-N 2.74Å; L230-Q233 PolarHBondContact O-N 3.31Å; L230-C234 WeakPolarHBondContact O-CB 3.36Å; L230-C234 PolarHBondContact O-N 2.9Å; L230-C234 PolarHBondContact O-SG 3.44Å
231R68.1Low62.1Low183 Ų183115.8 Ų115.869%0.69161%0.613SS**Hα-helixtrans-65.5-34.5175.1-75.8178.6-172.6179.35.3112.3Q227 A228 G235Q227-R231 WeakPolarHBondContact O-CB 3.4Å; Q227-R231 VanDerWaalsContact O-CG 3.28Å; Q227-R231 WeakPolarHBondContact O-CG 3.4Å; Q227-R231 PolarHBondContact O-N 2.93Å; A228-R231 PolarHBondContact O-N 3.2Å; R231-G235 WeakPolarHBondContact O-CA 3.48Å; R231-G235 PolarHBondContact O-N 3.44Å
232F63.6Low59.4Low169 Ų169123.4 Ų123.474%0.74163%0.632SS**Hα-helixtrans-68.7-38.8174.6-169.5-94.5000111.1A228 Q229 L230A228-F232 WeakPolarHBondContact O-CB 3.27Å; A228-F232 PolarHBondContact O-N 3.48Å; Q229-F232 PolarHBondContact O-N 2.89Å; L230-F232 VanDerWaalsContact C-N 3.33Å; L230-F232 PolarHBondContact O-N 2.74Å
233Q56.2Low56.8Low137 Ų137127 Ų12764%0.6465%0.654SS**Hα-helixtrans-64.5-44.6172.8-71174.227.800111.8Q229 L230Q229-Q233 WeakPolarHBondContact O-CG 3.24Å; Q229-Q233 PolarHBondContact O-N 2.98Å; L230-Q233 PolarHBondContact O-N 3.31Å
234C52.3Low54.3Low85 Ų85126 Ų12657%0.57467%0.665SS**Hα-helixtrans-74.5-34.5178.3-64.80000113L230 N236 T237L230-C234 WeakPolarHBondContact O-CB 3.36Å; L230-C234 PolarHBondContact O-N 2.9Å; L230-C234 PolarHBondContact O-SG 3.44Å; C234-N236 PolarHBondContact O-N 3.12Å; C234-T237 PolarHBondContact O-N 2.94Å; C234-T237 PolarHBondContact O-OG1 3.29Å
235G47.4Very low51.9Low60 Ų60129.3 Ų129.362%0.61968%0.68SS**Hα-helixtrans-69.8-14.2-176.500000113.9R231 T237R231-G235 WeakPolarHBondContact O-CA 3.48Å; R231-G235 PolarHBondContact O-N 3.44Å; G235-T237 PolarHBondContact O-N 3.22Å
236N38.8Very low49.8Very low143 Ų143132.5 Ų132.577%0.76570%0.696SS**THydrogen-bonded Turntrans-79.7-4.5170.1-135.831.2000113.1C234 R238C234-N236 PolarHBondContact O-N 3.12Å; N236-R238 PolarHBondContact O-N 3.47Å
237T39.9Very low48.1Very low110 Ų110132.4 Ų132.468%0.67571%0.706SS**  trans-91.380.6166.557.20000109.6C234 G235C234-T237 PolarHBondContact O-N 2.94Å; C234-T237 PolarHBondContact O-OG1 3.29Å; G235-T237 PolarHBondContact O-N 3.22Å
238R36.1Very low46.5Very low209 Ų209134.4 Ų134.479%0.78972%0.718SS**  trans-64.2128.1167-133175.5-172.5-175.11.8107.3N236 M240N236-R238 PolarHBondContact O-N 3.47Å; R238-M240 PolarHBondContact O-N 2.91Å
239P36.5Very low45.4Very low127 Ų127135.1 Ų135.183%0.82572%0.718SS**  trans-72.479.4-17928.3-32.6000109.2
240M29.7Very low44.6Very low155 Ų155133.6 Ų133.676%0.76472%0.724SS**  trans-91.3108.7175.3-88.8-65165.500109.3R238R238-M240 PolarHBondContact O-N 2.91Å
241C29.7Very low44.9Very low119 Ų119136 Ų13680%0.80473%0.733SS**  trans-47.8132.9168.1-166.30000110.5V243C241-V243 PolarHBondContact O-N 3.36Å
242Y31.3Very low44.7Very low213 Ų213132.9 Ų132.984%0.83573%0.726SS**  trans-45.5116.6177.4-86.3-105.6000113.2
243V34.8Very low44.8Very low151 Ų151132.1 Ų132.192%0.91572%0.723SS**  trans-148.4112138.9-1710000107.6C241C241-V243 PolarHBondContact O-N 3.36Å
244G33.6Very low45.8Very low67 Ų67131.1 Ų131.169%0.69172%0.718SS**SBendtrans106.697.8163.600000116
245E35.8Very low47.1Very low193 Ų193130.3 Ų130.390%0.90271%0.711SS**  trans32.487.9141.8-66176.716000118.6
246E42.1Very low48.6Very low191 Ų191131.7 Ų131.789%0.89371%0.707SS**  trans-16671.9140.1-104.6168.8-150.800106.5I248E246-I248 PolarHBondContact O-N 2.9Å; E246-I248 VanDerWaalsContact O-N 3.16Å
247S40.9Very low50.6Low109 Ų109126.4 Ų126.476%0.76268%0.681SS**PPolyproline II helixtrans-62.3117.3176-82.20000109.4
248I47.4Very low52.9Low133 Ų133126.3 Ų126.368%0.68267%0.673SS**PPolyproline II helixtrans-48.4123.2164.1-61.5163.8000106.8E246 A250 E252E246-I248 PolarHBondContact O-N 2.9Å; E246-I248 VanDerWaalsContact O-N 3.16Å; I248-A250 PolarHBondContact O-N 2.82Å; I248-E252 HydrophobicContact CG2-CB 4.45Å
249P51.8Low55.5Low71 Ų71121.2 Ų121.246%0.46166%0.658SS.*PPolyproline II helixtrans-53.4130.3-171.9-26.834.2000110.2E251 E252P249-E251 PolarHBondContact O-N 3.29Å; P249-E252 PolarHBondContact O-N 3.17Å
250A56.4Low57.8Low80 Ų80122.5 Ų122.566%0.66165%0.646SS**Hα-helixtrans-52-22.4177.800000112.8I248 Q254I248-A250 PolarHBondContact O-N 2.82Å; A250-Q254 WeakPolarHBondContact O-CB 3.38Å; A250-Q254 PolarHBondContact O-N 2.87Å
251E69.6Low60.5Low152 Ų152118.1 Ų118.171%0.7163%0.626SS**Hα-helixtrans-59.8-45.5171.8-89.6178.8151.900114.1P249 F253 Q254 T255P249-E251 PolarHBondContact O-N 3.29Å; E251-F253 PolarHBondContact O-N 3.3Å; E251-Q254 CarbonylContact O-C 3.58Å; E251-Q254 WeakPolarHBondContact O-CB 3.26Å; E251-Q254 PolarHBondContact O-N 3.42Å; E251-Q254 VanDerWaalsContact O-N 3.13Å; E251-T255 WeakPolarHBondContact O-CG2 3.36Å; E251-T255 PolarHBondContact O-N 2.83Å
252E65.8Low63.6Low116 Ų116116.8 Ų116.854%0.54261%0.61SS.*Hα-helixtrans-70.4-36.1-175.6-73.4-175.417200112.3I248 P249 Q254 T255 V256I248-E252 HydrophobicContact CG2-CB 4.45Å; P249-E252 PolarHBondContact O-N 3.17Å; E252-Q254 PolarHBondContact O-N 3.32Å; E252-T255 WeakPolarHBondContact CA-OG1 3.35Å; E252-T255 PolarHBondContact O-N 2.93Å; E252-T255 PolarHBondContact O-OG1 3.08Å; E252-V256 WeakPolarHBondContact O-CG2 3.42Å; E252-V256 PolarHBondContact O-N 3.2Å
253F64.7Low66.4Low153 Ų153114.4 Ų114.467%0.67160%0.601SS**Hα-helixtrans-65.4-35.3172.5-176.1-100.4000111.2E251 C257E251-F253 PolarHBondContact O-N 3.3Å; F253-C257 PolarHBondContact O-N 3.26Å; F253-C257 VanDerWaalsContact O-N 3.15Å; F253-C257 PolarHBondContact O-SG 2.99Å
254Q77.3Confident69Low116 Ų116115.9 Ų115.954%0.54259%0.59SS.*Hα-helixtrans-71.9-36179.2-169156.13.100112.2A250 E251 E252 C257 Q258A250-Q254 WeakPolarHBondContact O-CB 3.38Å; A250-Q254 PolarHBondContact O-N 2.87Å; E251-Q254 CarbonylContact O-C 3.58Å; E251-Q254 WeakPolarHBondContact O-CB 3.26Å; E251-Q254 PolarHBondContact O-N 3.42Å; E251-Q254 VanDerWaalsContact O-N 3.13Å; E252-Q254 PolarHBondContact O-N 3.32Å; Q254-C257 PolarHBondContact O-N 3.46Å; Q254-Q258 VanDerWaalsContact O-CG 3.27Å; Q254-Q258 WeakPolarHBondContact O-CG 3.3Å; Q254-Q258 PolarHBondContact O-N 2.91Å
255T80.4Confident71.8Confident68 Ų68120.1 Ų120.142%0.41759%0.585SS.*Hα-helixtrans-65-45.2174.355.60000111.7E251 E252 C257 Q258 E259E251-T255 WeakPolarHBondContact O-CG2 3.36Å; E251-T255 PolarHBondContact O-N 2.83Å; E252-T255 WeakPolarHBondContact CA-OG1 3.35Å; E252-T255 PolarHBondContact O-N 2.93Å; E252-T255 PolarHBondContact O-OG1 3.08Å; T255-C257 VanDerWaalsContact C-N 3.3Å; T255-C257 PolarHBondContact O-N 2.89Å; T255-Q258 WeakPolarHBondContact O-CB 3.44Å; T255-Q258 PolarHBondContact O-N 3.44Å; T255-Q258 VanDerWaalsContact O-N 3.08Å; T255-E259 PolarHBondContact O-N 3.5Å
256V78.2Confident74.6Confident89 Ų89115.3 Ų115.354%0.53957%0.566SS.*Hα-helixtrans-62.1-38.8177.6174.60000111.5E252 E259 R260E252-V256 WeakPolarHBondContact O-CG2 3.42Å; E252-V256 PolarHBondContact O-N 3.2Å; V256-E259 PolarHBondContact O-N 3.05Å; V256-R260 WeakPolarHBondContact O-CB 3.22Å; V256-R260 PolarHBondContact O-N 2.98Å
257C81.4Confident77Confident32 Ų32114.3 Ų114.322%0.21656%0.555CS.*Hα-helixtrans-64-40.8174.4-70.40000112F253 Q254 T255 D261F253-C257 PolarHBondContact O-N 3.26Å; F253-C257 VanDerWaalsContact O-N 3.15Å; F253-C257 PolarHBondContact O-SG 2.99Å; Q254-C257 PolarHBondContact O-N 3.46Å; T255-C257 VanDerWaalsContact C-N 3.3Å; T255-C257 PolarHBondContact O-N 2.89Å; C257-D261 VanDerWaalsContact O-CG 3.24Å; C257-D261 PolarHBondContact O-N 3.46Å; C257-D261 VanDerWaalsContact O-N 3.13Å
258Q88.2Confident79.5Confident108 Ų108114 Ų11451%0.50554%0.543SS..Hα-helixtrans-65.4-43.1176.1-71.4172.322.300112.1Q254 T255 D261 L262Q254-Q258 VanDerWaalsContact O-CG 3.27Å; Q254-Q258 WeakPolarHBondContact O-CG 3.3Å; Q254-Q258 PolarHBondContact O-N 2.91Å; T255-Q258 WeakPolarHBondContact O-CB 3.44Å; T255-Q258 PolarHBondContact O-N 3.44Å; T255-Q258 VanDerWaalsContact O-N 3.08Å; Q258-D261 PolarHBondContact O-N 3.23Å; Q258-L262 WeakPolarHBondContact O-CG 3.27Å; Q258-L262 PolarHBondContact O-N 2.96Å
259E89.7Confident81.8Confident102 Ų102112.6 Ų112.648%0.47754%0.536SS..Hα-helixtrans-61.8-45.8176.8-76-176.9166.700111.8T255 V256 D261 L262 Y263T255-E259 PolarHBondContact O-N 3.5Å; V256-E259 PolarHBondContact O-N 3.05Å; E259-D261 PolarHBondContact O-N 3.37Å; E259-L262 WeakPolarHBondContact O-CB 3.46Å; E259-L262 PolarHBondContact O-N 3.04Å; E259-L262 VanDerWaalsContact O-N 3.1Å; E259-Y263 HydrophobicContact CB-CD2 4.49Å; E259-Y263 HydrophobicContact CB-CE2 4.28Å; E259-Y263 WeakPolarHBondContact O-CD2 3.47Å; E259-Y263 PolarHBondContact O-N 2.82Å
260R84.4Confident83.7Confident154 Ų154112 Ų11258%0.58153%0.533SS*.Hα-helixtrans-57.1-41175-174-166.867.1-168.9-5.9111.5V256 R264V256-R260 WeakPolarHBondContact O-CB 3.22Å; V256-R260 PolarHBondContact O-N 2.98Å; R260-R264 WeakPolarHBondContact O-CB 3.43Å; R260-R264 PolarHBondContact O-N 3.02Å
261D88Confident85.4Confident63 Ų63109.6 Ų109.634%0.33751%0.514SS..Hα-helixtrans-72.3-30.3179.2-67.6-11.3000112.1C257 Q258 E259 R265C257-D261 VanDerWaalsContact O-CG 3.24Å; C257-D261 PolarHBondContact O-N 3.46Å; C257-D261 VanDerWaalsContact O-N 3.13Å; Q258-D261 PolarHBondContact O-N 3.23Å; E259-D261 PolarHBondContact O-N 3.37Å; D261-R265 WeakPolarHBondContact O-CG 3.35Å; D261-R265 PolarHBondContact O-N 3.03Å; D261-R265 VanDerWaalsContact O-N 3.16Å
262L93.2Very high86.7Confident91 Ų91107 Ų10748%0.47650%0.502SS..Hα-helixtrans-67.3-51170.6-72.1171.2000111.8Q258 E259 R264 R265 D266Q258-L262 WeakPolarHBondContact O-CG 3.27Å; Q258-L262 PolarHBondContact O-N 2.96Å; E259-L262 WeakPolarHBondContact O-CB 3.46Å; E259-L262 PolarHBondContact O-N 3.04Å; E259-L262 VanDerWaalsContact O-N 3.1Å; L262-R264 PolarHBondContact O-N 3.46Å; L262-R265 WeakPolarHBondContact O-CA 3.43Å; L262-R265 WeakPolarHBondContact O-CB 3.34Å; L262-R265 PolarHBondContact O-N 3.49Å; L262-D266 PolarHBondContact O-N 3.3Å
263Y90.6Very high88Confident164 Ų164103.8 Ų103.864%0.64350%0.495SS*.Hα-helixtrans-57.6-36.2176.1-73.2-58.7000112.1E259 D266 Y267E259-Y263 HydrophobicContact CB-CD2 4.49Å; E259-Y263 HydrophobicContact CB-CE2 4.28Å; E259-Y263 WeakPolarHBondContact O-CD2 3.47Å; E259-Y263 PolarHBondContact O-N 2.82Å; Y263-D266 PolarHBondContact O-N 3.24Å; Y263-Y267 VanDerWaalsContact O-CB 3.28Å; Y263-Y267 WeakPolarHBondContact O-CB 3.49Å; Y263-Y267 PolarHBondContact O-N 2.85Å
264R90.3Very high89.4Confident182 Ų182100.9 Ų100.969%0.68749%0.485SS*.Hα-helixtrans-65.5-38.1174.9-168175.8-172.2154.63.4112.3R260 L262 M268R260-R264 WeakPolarHBondContact O-CB 3.43Å; R260-R264 PolarHBondContact O-N 3.02Å; L262-R264 PolarHBondContact O-N 3.46Å; R264-M268 VanDerWaalsContact O-CG 3.25Å; R264-M268 WeakPolarHBondContact O-CG 3.47Å; R264-M268 PolarHBondContact O-N 3.37Å; R264-M268 VanDerWaalsContact O-N 3.13Å
265R92.4Very high90.2Very high155 Ų155102.1 Ų102.159%0.58549%0.489SS*.Hα-helixtrans-68.9-43174.8-73.9-175.3-167112.91.5111.9D261 L262 Y267 M268 L269D261-R265 WeakPolarHBondContact O-CG 3.35Å; D261-R265 PolarHBondContact O-N 3.03Å; D261-R265 VanDerWaalsContact O-N 3.16Å; L262-R265 WeakPolarHBondContact O-CA 3.43Å; L262-R265 WeakPolarHBondContact O-CB 3.34Å; L262-R265 PolarHBondContact O-N 3.49Å; R265-Y267 VanDerWaalsContact C-N 3.33Å; R265-Y267 PolarHBondContact O-N 2.95Å; R265-M268 WeakPolarHBondContact O-CB 3.48Å; R265-M268 PolarHBondContact O-N 2.79Å; R265-M268 VanDerWaalsContact O-N 3.15Å; R265-L269 WeakPolarHBondContact O-CG 3.44Å; R265-L269 PolarHBondContact O-N 3.39Å
266D94.1Very high90.9Very high93 Ų93104.9 Ų104.950%0.49750%0.497SS..Hα-helixtrans-66.2-37.4178.9-69.3-14.6000111.9L262 Y263 M268 L269 S270L262-D266 PolarHBondContact O-N 3.3Å; Y263-D266 PolarHBondContact O-N 3.24Å; D266-M268 VanDerWaalsContact C-N 3.34Å; D266-M268 PolarHBondContact O-N 3.03Å; D266-L269 PolarHBondContact O-N 3.4Å; D266-S270 WeakPolarHBondContact O-CB 3.43Å; D266-S270 PolarHBondContact O-N 3.48Å; D266-S270 PolarHBondContact O-OG 2.94Å
267Y91.7Very high91.7Very high169 Ų169105.6 Ų105.666%0.66350%0.497SS*.Hα-helixtrans-61.3-42.5171.4-178.6-96.9000111.9Y263 R265 S270 A271Y263-Y267 VanDerWaalsContact O-CB 3.28Å; Y263-Y267 WeakPolarHBondContact O-CB 3.49Å; Y263-Y267 PolarHBondContact O-N 2.85Å; R265-Y267 VanDerWaalsContact C-N 3.33Å; R265-Y267 PolarHBondContact O-N 2.95Å; Y267-S270 WeakPolarHBondContact CA-OG 3.42Å; Y267-S270 PolarHBondContact O-OG 3.32Å; Y267-A271 VanDerWaalsContact O-CB 3.3Å; Y267-A271 WeakPolarHBondContact O-CB 3.41Å; Y267-A271 PolarHBondContact O-N 2.91Å
268M94.4Very high92.2Very high102 Ų102109.8 Ų109.850%0.50251%0.514SS..Hα-helixtrans-63.2-45.1175.7-75.7-70.8-48.300112.1R264 R265 D266 A271 E272R264-M268 VanDerWaalsContact O-CG 3.25Å; R264-M268 WeakPolarHBondContact O-CG 3.47Å; R264-M268 PolarHBondContact O-N 3.37Å; R264-M268 VanDerWaalsContact O-N 3.13Å; R265-M268 WeakPolarHBondContact O-CB 3.48Å; R265-M268 PolarHBondContact O-N 2.79Å; R265-M268 VanDerWaalsContact O-N 3.15Å; D266-M268 VanDerWaalsContact C-N 3.34Å; D266-M268 PolarHBondContact O-N 3.03Å; M268-A271 PolarHBondContact O-N 3.15Å; M268-E272 PolarHBondContact O-N 2.97Å
269L94.8Very high92.6Very high105 Ų105111.1 Ų111.155%0.5552%0.518SS..Hα-helixtrans-65.2-43.1179-71.9171.8000112.3R265 D266 E272 A273R265-L269 WeakPolarHBondContact O-CG 3.44Å; R265-L269 PolarHBondContact O-N 3.39Å; D266-L269 PolarHBondContact O-N 3.4Å; L269-E272 PolarHBondContact O-N 3.45Å; L269-A273 PolarHBondContact O-N 2.88Å
270S91.4Very high92.9Very high57 Ų57111.7 Ų111.740%0.39952%0.521SS..Hα-helixtrans-65.7-38.6176.3550000112D266 Y267 E272 A273 I274D266-S270 WeakPolarHBondContact O-CB 3.43Å; D266-S270 PolarHBondContact O-N 3.48Å; D266-S270 PolarHBondContact O-OG 2.94Å; Y267-S270 WeakPolarHBondContact CA-OG 3.42Å; Y267-S270 PolarHBondContact O-OG 3.32Å; S270-E272 VanDerWaalsContact C-N 3.34Å; S270-E272 PolarHBondContact O-N 3.28Å; S270-A273 PolarHBondContact O-N 3.25Å; S270-I274 VanDerWaalsContact O-CG1 3.31Å; S270-I274 WeakPolarHBondContact O-CG1 3.31Å; S270-I274 PolarHBondContact O-N 3.24Å
271A93.7Very high93.4Very high30 Ų30109 Ų10925%0.24852%0.517CS..Hα-helixtrans-63.6-37.6173.900000112.7Y267 M268 K275Y267-A271 VanDerWaalsContact O-CB 3.3Å; Y267-A271 WeakPolarHBondContact O-CB 3.41Å; Y267-A271 PolarHBondContact O-N 2.91Å; M268-A271 PolarHBondContact O-N 3.15Å; A271-K275 WeakPolarHBondContact O-CG 3.47Å; A271-K275 PolarHBondContact O-N 2.9Å
272E95.1Very high93.7Very high99 Ų99110.1 Ų110.146%0.46352%0.52SS..Hα-helixtrans-68.4-40173.2-75178.1-17700112.4M268 L269 S270 K275 Q276M268-E272 PolarHBondContact O-N 2.97Å; L269-E272 PolarHBondContact O-N 3.45Å; S270-E272 VanDerWaalsContact C-N 3.34Å; S270-E272 PolarHBondContact O-N 3.28Å; E272-K275 PolarHBondContact O-N 2.85Å; E272-Q276 WeakPolarHBondContact O-CG 3.48Å; E272-Q276 PolarHBondContact O-N 3.44Å
273A94.9Very high93.9Very high47 Ų47109.2 Ų109.239%0.38852%0.516SS..Hα-helixtrans-63-41175.700000112.3L269 S270 Q276 L277L269-A273 PolarHBondContact O-N 2.88Å; S270-A273 PolarHBondContact O-N 3.25Å; A273-Q276 PolarHBondContact O-N 2.93Å; A273-L277 PolarHBondContact O-N 3.02Å
274I92.5Very high94Very high92 Ų92107.6 Ų107.647%0.47252%0.515SS..Hα-helixtrans-61.5-47175.1-69.3166.1000110.4S270 Q276 L277 E278S270-I274 VanDerWaalsContact O-CG1 3.31Å; S270-I274 WeakPolarHBondContact O-CG1 3.31Å; S270-I274 PolarHBondContact O-N 3.24Å; I274-Q276 VanDerWaalsContact C-N 3.26Å; I274-Q276 PolarHBondContact O-N 3.33Å; I274-L277 PolarHBondContact O-N 3.41Å; I274-L277 VanDerWaalsContact O-N 3.11Å; I274-E278 HydrophobicContact CG2-CG 4.32Å; I274-E278 WeakPolarHBondContact O-CG 3.37Å; I274-E278 PolarHBondContact O-N 3.4Å
275K93.8Very high94.3Very high142 Ų142106.4 Ų106.462%0.61751%0.51SS*.Hα-helixtrans-58.6-36.9176.7-74.2175.6-178.3175.30112.8A271 E272 F279A271-K275 WeakPolarHBondContact O-CG 3.47Å; A271-K275 PolarHBondContact O-N 2.9Å; E272-K275 PolarHBondContact O-N 2.85Å; K275-F279 PolarHBondContact O-N 3.37Å; K275-F279 VanDerWaalsContact O-N 3.08Å
276Q95.7Very high94.4Very high127 Ų127102.8 Ų102.859%0.59350%0.5SS*.Hα-helixtrans-67.2-42.3175.5-71.4178.612.900112.1E272 A273 I274 F279 Q280E272-Q276 WeakPolarHBondContact O-CG 3.48Å; E272-Q276 PolarHBondContact O-N 3.44Å; A273-Q276 PolarHBondContact O-N 2.93Å; I274-Q276 VanDerWaalsContact C-N 3.26Å; I274-Q276 PolarHBondContact O-N 3.33Å; Q276-F279 PolarHBondContact O-N 3.34Å; Q276-Q280 WeakPolarHBondContact O-CG 3.36Å; Q276-Q280 PolarHBondContact O-N 3.42Å
277L94.6Very high94.4Very high103 Ų103100.8 Ų100.854%0.53949%0.493SS..Hα-helixtrans-65.3-39.4176.1-71.5173.3000112.1A273 I274 Q280 L281A273-L277 PolarHBondContact O-N 3.02Å; I274-L277 PolarHBondContact O-N 3.41Å; I274-L277 VanDerWaalsContact O-N 3.11Å; L277-Q280 PolarHBondContact O-N 2.91Å; L277-L281 WeakPolarHBondContact O-CB 3.45Å; L277-L281 PolarHBondContact O-N 3.41Å
278E93.8Very high94.4Very high121 Ų12197.3 Ų97.357%0.56549%0.485SS*.Hα-helixtrans-60.5-45174.2-72.5174.9159.200111.5I274 Q280 L281 E282I274-E278 HydrophobicContact CG2-CG 4.32Å; I274-E278 WeakPolarHBondContact O-CG 3.37Å; I274-E278 PolarHBondContact O-N 3.4Å; E278-Q280 PolarHBondContact O-N 2.8Å; E278-L281 PolarHBondContact O-N 2.79Å; E278-E282 WeakPolarHBondContact O-CB 3.25Å; E278-E282 PolarHBondContact O-N 3.11Å
279F95.6Very high94.4Very high136 Ų13697.5 Ų97.560%0.59649%0.488SS*.Hα-helixtrans-63.7-38.2175.2-179.1-103.3000112.7K275 Q276 E282 N283K275-F279 PolarHBondContact O-N 3.37Å; K275-F279 VanDerWaalsContact O-N 3.08Å; Q276-F279 PolarHBondContact O-N 3.34Å; F279-E282 PolarHBondContact O-N 3.31Å; F279-N283 WeakPolarHBondContact CE1-ND2 3.4Å; F279-N283 WeakPolarHBondContact CZ-ND2 3.37Å; F279-N283 PolarHBondContact O-N 3.41Å; F279-N283 PolarHBondContact O-ND2 2.81Å
280Q96.7Very high94.3Very high114 Ų114100.4 Ų100.453%0.53349%0.492SS..Hα-helixtrans-66.4-42.7175.1-73.7-178.66.400112.4Q276 L277 E278 E282 N283 Q284Q276-Q280 WeakPolarHBondContact O-CG 3.36Å; Q276-Q280 PolarHBondContact O-N 3.42Å; L277-Q280 PolarHBondContact O-N 2.91Å; E278-Q280 PolarHBondContact O-N 2.8Å; Q280-E282 VanDerWaalsContact C-N 3.32Å; Q280-E282 PolarHBondContact O-N 3.46Å; Q280-N283 PolarHBondContact O-N 3.1Å; Q280-Q284 PolarHBondContact O-N 2.86Å
281L93.1Very high94.3Very high97 Ų97103.4 Ų103.451%0.50850%0.498SS..Hα-helixtrans-61.5-41.3175.3-89.4166000111.6L277 E278 Q284 R285L277-L281 WeakPolarHBondContact O-CB 3.45Å; L277-L281 PolarHBondContact O-N 3.41Å; E278-L281 PolarHBondContact O-N 2.79Å; L281-Q284 PolarHBondContact O-N 3.11Å; L281-R285 WeakPolarHBondContact O-CG 3.21Å; L281-R285 PolarHBondContact O-N 3.06Å
282E96.1Very high94.3Very high86 Ų86106.8 Ų106.840%0.40251%0.511SS..Hα-helixtrans-64.5-41.5176.4-172.853.1-145.600111.7E278 F279 Q280 Q284 R285 Q286E278-E282 WeakPolarHBondContact O-CB 3.25Å; E278-E282 PolarHBondContact O-N 3.11Å; F279-E282 PolarHBondContact O-N 3.31Å; Q280-E282 VanDerWaalsContact C-N 3.32Å; Q280-E282 PolarHBondContact O-N 3.46Å; E282-Q284 PolarHBondContact O-N 3.16Å; E282-R285 PolarHBondContact O-N 3.32Å; E282-Q286 WeakPolarHBondContact O-CG 3.25Å; E282-Q286 PolarHBondContact O-N 2.95Å; E282-Q286 PolarHBondContact OE1-NE2 2.91Å
283N95.7Very high94.2Very high73 Ų73107.6 Ų107.639%0.3952%0.515SS..Hα-helixtrans-62.7-40173-80.1-32.9000112.9F279 Q280 Q286 S287F279-N283 WeakPolarHBondContact CE1-ND2 3.4Å; F279-N283 WeakPolarHBondContact CZ-ND2 3.37Å; F279-N283 PolarHBondContact O-N 3.41Å; F279-N283 PolarHBondContact O-ND2 2.81Å; Q280-N283 PolarHBondContact O-N 3.1Å; N283-Q286 PolarHBondContact O-N 3.41Å; N283-S287 PolarHBondContact O-N 2.76Å
284Q94.6Very high94Very high130 Ų130107.2 Ų107.261%0.60751%0.51SS*.Hα-helixtrans-65.9-40.8175.6-74.7-164.8-12.500111.9Q280 L281 E282 Q286 S287 L288Q280-Q284 PolarHBondContact O-N 2.86Å; L281-Q284 PolarHBondContact O-N 3.11Å; E282-Q284 PolarHBondContact O-N 3.16Å; Q284-Q286 PolarHBondContact O-N 2.84Å; Q284-S287 WeakPolarHBondContact O-CB 3.35Å; Q284-S287 PolarHBondContact O-N 3.37Å; Q284-L288 WeakPolarHBondContact O-CG 3.39Å; Q284-L288 PolarHBondContact O-N 3.04Å
285R94.7Very high93.8Very high156 Ų156106.4 Ų106.459%0.58951%0.509SS*.Hα-helixtrans-59.2-46.1173.8-77.3176.4172.5166.9-1.3111.7L281 E282 S287 L288 L289L281-R285 WeakPolarHBondContact O-CG 3.21Å; L281-R285 PolarHBondContact O-N 3.06Å; E282-R285 PolarHBondContact O-N 3.32Å; R285-S287 VanDerWaalsContact C-N 3.32Å; R285-S287 PolarHBondContact O-N 3.48Å; R285-L288 PolarHBondContact O-N 3.37Å; R285-L289 WeakPolarHBondContact O-CG 3.48Å; R285-L289 PolarHBondContact O-N 3.04Å
286Q95Very high93.5Very high79 Ų79105.9 Ų105.937%0.36951%0.506SS..Hα-helixtrans-63.4-36.8174.9-69-178.719.500112.4E282 N283 Q284 R290E282-Q286 WeakPolarHBondContact O-CG 3.25Å; E282-Q286 PolarHBondContact O-N 2.95Å; E282-Q286 PolarHBondContact OE1-NE2 2.91Å; N283-Q286 PolarHBondContact O-N 3.41Å; Q284-Q286 PolarHBondContact O-N 2.84Å; Q286-R290 WeakPolarHBondContact O-CG 3.42Å; Q286-R290 PolarHBondContact O-N 3.44Å
287S94.4Very high93Very high52 Ų52106.8 Ų106.836%0.36451%0.505SS..Hα-helixtrans-65.8-37.7173.9179.80000112.7N283 Q284 R285 K291N283-S287 PolarHBondContact O-N 2.76Å; Q284-S287 WeakPolarHBondContact O-CB 3.35Å; Q284-S287 PolarHBondContact O-N 3.37Å; R285-S287 VanDerWaalsContact C-N 3.32Å; R285-S287 PolarHBondContact O-N 3.48Å; S287-K291 WeakPolarHBondContact O-CG 3.4Å; S287-K291 PolarHBondContact O-N 3.1Å; S287-K291 VanDerWaalsContact O-N 3.12Å
288L91.9Very high92.4Very high95 Ų95107.2 Ų107.250%0.49751%0.507SS..Hα-helixtrans-68.7-44176.7-73171.2000110.7Q284 R285 R290 K291 D292Q284-L288 WeakPolarHBondContact O-CG 3.39Å; Q284-L288 PolarHBondContact O-N 3.04Å; R285-L288 PolarHBondContact O-N 3.37Å; L288-R290 VanDerWaalsContact C-N 3.33Å; L288-R290 PolarHBondContact O-N 2.87Å; L288-K291 CarbonylContact O-C 3.6Å; L288-K291 WeakPolarHBondContact O-CA 3.33Å; L288-K291 WeakPolarHBondContact O-CB 3.47Å; L288-K291 PolarHBondContact O-N 2.81Å; L288-D292 PolarHBondContact O-N 2.87Å
289L93.5Very high91.7Very high106 Ų106106 Ų10656%0.55550%0.503SS*.Hα-helixtrans-56.8-44.2174.2-76.1167.8000112.4R285 K291 D292 E293R285-L289 WeakPolarHBondContact O-CG 3.48Å; R285-L289 PolarHBondContact O-N 3.04Å; L289-K291 VanDerWaalsContact C-N 3.31Å; L289-K291 PolarHBondContact O-N 3.48Å; L289-D292 PolarHBondContact O-N 3.26Å; L289-E293 WeakPolarHBondContact O-CG 3.31Å; L289-E293 PolarHBondContact O-N 3.44Å
290R92.8Very high90.8Very high167 Ų167104.4 Ų104.463%0.6350%0.498SS*.Hα-helixtrans-63.7-35.3174.3-71.1-176.5-163.5155.57.7112.9Q286 L288 S294Q286-R290 WeakPolarHBondContact O-CG 3.42Å; Q286-R290 PolarHBondContact O-N 3.44Å; L288-R290 VanDerWaalsContact C-N 3.33Å; L288-R290 PolarHBondContact O-N 2.87Å; R290-S294 PolarHBondContact O-N 2.89Å
291K91.9Very high89.8Confident120 Ų120101.1 Ų101.152%0.52249%0.491SS..Hα-helixtrans-67.6-45.1175.4-75.8175.6-179.9-179.30110.3S287 L288 L289 E293 S294 V295S287-K291 WeakPolarHBondContact O-CG 3.4Å; S287-K291 PolarHBondContact O-N 3.1Å; S287-K291 VanDerWaalsContact O-N 3.12Å; L288-K291 CarbonylContact O-C 3.6Å; L288-K291 WeakPolarHBondContact O-CA 3.33Å; L288-K291 WeakPolarHBondContact O-CB 3.47Å; L288-K291 PolarHBondContact O-N 2.81Å; L289-K291 VanDerWaalsContact C-N 3.31Å; L289-K291 PolarHBondContact O-N 3.48Å; K291-E293 VanDerWaalsContact C-N 3.35Å; K291-E293 PolarHBondContact O-N 3.38Å; K291-S294 CarbonylContact O-C 3.53Å; K291-S294 WeakPolarHBondContact O-CA 3.34Å; K291-S294 WeakPolarHBondContact O-CB 3.32Å; K291-S294 PolarHBondContact O-N 3.44Å; K291-S294 PolarHBondContact O-OG 2.96Å; K291-V295 WeakPolarHBondContact O-CG2 3.48Å; K291-V295 PolarHBondContact O-N 2.81Å
292D94.9Very high88.7Confident101 Ų101104.7 Ų104.754%0.5450%0.502SS..Hα-helixtrans-61.4-42176.2-69.1-26000111.4L288 L289 S294 V295 K296L288-D292 PolarHBondContact O-N 2.87Å; L289-D292 PolarHBondContact O-N 3.26Å; D292-S294 VanDerWaalsContact C-N 3.3Å; D292-S294 PolarHBondContact O-N 2.95Å; D292-V295 PolarHBondContact O-N 2.85Å; D292-K296 VanDerWaalsContact O-CB 3.32Å; D292-K296 WeakPolarHBondContact O-CB 3.42Å; D292-K296 PolarHBondContact O-N 3.48Å
293E92.4Very high87.3Confident115 Ų115107.8 Ų107.854%0.53752%0.517SS..Hα-helixtrans-62.1-35.8171.4-75177.7175.300112.5L289 K291 R297L289-E293 WeakPolarHBondContact O-CG 3.31Å; L289-E293 PolarHBondContact O-N 3.44Å; K291-E293 VanDerWaalsContact C-N 3.35Å; K291-E293 PolarHBondContact O-N 3.38Å; E293-R297 WeakPolarHBondContact O-CB 3.36Å; E293-R297 WeakPolarHBondContact O-CG 3.42Å; E293-R297 PolarHBondContact O-N 3.1Å; E293-R297 PolarHBondContact O-NE 3.02Å
294S90.1Very high85.5Confident40 Ų40108.9 Ų108.928%0.2853%0.53SS..Hα-helixtrans-70-40.2175.688.50000112.1R290 K291 D292 K296 R297 L298R290-S294 PolarHBondContact O-N 2.89Å; K291-S294 CarbonylContact O-C 3.53Å; K291-S294 WeakPolarHBondContact O-CA 3.34Å; K291-S294 WeakPolarHBondContact O-CB 3.32Å; K291-S294 PolarHBondContact O-N 3.44Å; K291-S294 PolarHBondContact O-OG 2.96Å; D292-S294 VanDerWaalsContact C-N 3.3Å; D292-S294 PolarHBondContact O-N 2.95Å; S294-K296 VanDerWaalsContact C-N 3.34Å; S294-R297 PolarHBondContact O-N 3.26Å; S294-L298 WeakPolarHBondContact O-CB 3.39Å; S294-L298 WeakPolarHBondContact O-CG 3.43Å; S294-L298 PolarHBondContact O-N 3.39Å
295V88.3Confident83.1Confident74 Ų74111 Ų11145%0.44854%0.537SS..Hα-helixtrans-64.4-44.5175.2171.20000109K291 D292 R297 L298 L299K291-V295 WeakPolarHBondContact O-CG2 3.48Å; K291-V295 PolarHBondContact O-N 2.81Å; D292-V295 PolarHBondContact O-N 2.85Å; V295-R297 PolarHBondContact O-N 3.33Å; V295-L298 WeakPolarHBondContact O-CB 3.48Å; V295-L298 PolarHBondContact O-N 3.26Å; V295-L298 VanDerWaalsContact O-N 3.16Å; V295-L299 HydrophobicContact CG1-CD1 4.01Å; V295-L299 HydrophobicContact CG1-CG 4.4Å; V295-L299 WeakPolarHBondContact O-CB 3.47Å; V295-L299 VanDerWaalsContact O-CG 3.29Å; V295-L299 WeakPolarHBondContact O-CG 3.33Å; V295-L299 PolarHBondContact O-N 2.68Å
296K87.5Confident80.6Confident131 Ų131106.2 Ų106.257%0.5754%0.537SS*.Hα-helixtrans-59.7-44.5175-167.7177.9179.4-177.20111.8D292 S294 L298 L299 E300D292-K296 VanDerWaalsContact O-CB 3.32Å; D292-K296 WeakPolarHBondContact O-CB 3.42Å; D292-K296 PolarHBondContact O-N 3.48Å; S294-K296 VanDerWaalsContact C-N 3.34Å; K296-L298 PolarHBondContact O-N 2.84Å; K296-L299 PolarHBondContact O-N 2.9Å; K296-E300 VanDerWaalsContact CE-OE1 3.32Å; K296-E300 WeakPolarHBondContact CE-OE1 3.43Å; K296-E300 WeakPolarHBondContact O-CB 3.31Å; K296-E300 WeakPolarHBondContact O-CG 3.4Å; K296-E300 PolarHBondContact O-N 3.4Å
297R84.7Confident77.9Confident147 Ų147109 Ų10956%0.55556%0.558SS**Hα-helixtrans-63.9-37.1174-80.5-177.6-81.4114.4-6113.2E293 S294 V295 A301E293-R297 WeakPolarHBondContact O-CB 3.36Å; E293-R297 WeakPolarHBondContact O-CG 3.42Å; E293-R297 PolarHBondContact O-N 3.1Å; E293-R297 PolarHBondContact O-NE 3.02Å; S294-R297 PolarHBondContact O-N 3.26Å; V295-R297 PolarHBondContact O-N 3.33Å; R297-A301 WeakPolarHBondContact O-CB 3.41Å; R297-A301 PolarHBondContact O-N 3.34Å
298L83.2Confident75.3Confident112 Ų112111.9 Ų111.959%0.58658%0.576SS**Hα-helixtrans-66.9-41.4174.4-78.1168.8000111.3S294 V295 K296 A301 F302S294-L298 WeakPolarHBondContact O-CB 3.39Å; S294-L298 WeakPolarHBondContact O-CG 3.43Å; S294-L298 PolarHBondContact O-N 3.39Å; V295-L298 WeakPolarHBondContact O-CB 3.48Å; V295-L298 PolarHBondContact O-N 3.26Å; V295-L298 VanDerWaalsContact O-N 3.16Å; K296-L298 PolarHBondContact O-N 2.84Å; L298-A301 PolarHBondContact O-N 2.94Å; L298-F302 WeakPolarHBondContact O-CB 3.39Å; L298-F302 PolarHBondContact O-N 3.31Å
299L77.8Confident72.8Confident94 Ų94111.8 Ų111.849%0.49258%0.584SS.*Hα-helixtrans-63.8-47.9173.6-69171.4000110.3V295 K296 A301 F302 H303V295-L299 HydrophobicContact CG1-CD1 4.01Å; V295-L299 HydrophobicContact CG1-CG 4.4Å; V295-L299 WeakPolarHBondContact O-CB 3.47Å; V295-L299 VanDerWaalsContact O-CG 3.29Å; V295-L299 WeakPolarHBondContact O-CG 3.33Å; V295-L299 PolarHBondContact O-N 2.68Å; K296-L299 PolarHBondContact O-N 2.9Å; L299-A301 VanDerWaalsContact C-N 3.32Å; L299-A301 PolarHBondContact O-N 3.33Å; L299-F302 CarbonylContact O-C 3.6Å; L299-F302 WeakPolarHBondContact O-CA 3.46Å; L299-F302 VanDerWaalsContact O-CB 3.27Å; L299-F302 WeakPolarHBondContact O-CB 3.47Å; L299-F302 PolarHBondContact O-N 2.97Å; L299-F302 VanDerWaalsContact O-N 3.09Å; L299-H303 PolarHBondContact O-N 2.89Å; L299-H303 PolarHBondContact O-ND1 3.27Å
300E77.6Confident70.2Confident103 Ų103109.6 Ų109.648%0.48159%0.587SS.*Hα-helixtrans-62.3-36.2175.3-76.5171.8-171.400112.2K296 F302 H303 S304K296-E300 VanDerWaalsContact CE-OE1 3.32Å; K296-E300 WeakPolarHBondContact CE-OE1 3.43Å; K296-E300 WeakPolarHBondContact O-CB 3.31Å; K296-E300 WeakPolarHBondContact O-CG 3.4Å; K296-E300 PolarHBondContact O-N 3.4Å; E300-F302 VanDerWaalsContact C-N 3.33Å; E300-H303 PolarHBondContact O-N 2.97Å; E300-S304 WeakPolarHBondContact O-CA 3.48Å; E300-S304 WeakPolarHBondContact O-CB 3.39Å; E300-S304 PolarHBondContact O-N 2.96Å; E300-S304 PolarHBondContact O-OG 2.87Å
301A76.7Confident67.8Low46 Ų46111.2 Ų111.238%0.3859%0.593SS.*Hα-helixtrans-65.9-36.1172.400000112.1R297 L298 L299 S304 K305R297-A301 WeakPolarHBondContact O-CB 3.41Å; R297-A301 PolarHBondContact O-N 3.34Å; L298-A301 PolarHBondContact O-N 2.94Å; L299-A301 VanDerWaalsContact C-N 3.32Å; L299-A301 PolarHBondContact O-N 3.33Å; A301-S304 WeakPolarHBondContact CA-OG 3.41Å; A301-S304 PolarHBondContact O-OG 2.93Å; A301-K305 PolarHBondContact O-N 3.26Å; A301-K305 VanDerWaalsContact O-N 3.15Å
302F69Low65.6Low172 Ų172110 Ų11075%0.75460%0.599SS**Hα-helixtrans-65.9-39.9172.5-111.5-86.5000112.2L298 L299 E300L298-F302 WeakPolarHBondContact O-CB 3.39Å; L298-F302 PolarHBondContact O-N 3.31Å; L299-F302 CarbonylContact O-C 3.6Å; L299-F302 WeakPolarHBondContact O-CA 3.46Å; L299-F302 VanDerWaalsContact O-CB 3.27Å; L299-F302 WeakPolarHBondContact O-CB 3.47Å; L299-F302 PolarHBondContact O-N 2.97Å; L299-F302 VanDerWaalsContact O-N 3.09Å; E300-F302 VanDerWaalsContact C-N 3.33Å
303H65.9Low63.3Low151 Ų151111.5 Ų111.570%0.69961%0.606SS**Hα-helixtrans-79.7-35179.5-6892.3000112.5L299 E300L299-H303 PolarHBondContact O-N 2.89Å; L299-H303 PolarHBondContact O-ND1 3.27Å; E300-H303 PolarHBondContact O-N 2.97Å
304S58.7Low61.4Low95 Ų95108.7 Ų108.766%0.66460%0.6SS**Hα-helixtrans-79-23.5-177.759.20000113.3E300 A301 G306E300-S304 WeakPolarHBondContact O-CA 3.48Å; E300-S304 WeakPolarHBondContact O-CB 3.39Å; E300-S304 PolarHBondContact O-N 2.96Å; E300-S304 PolarHBondContact O-OG 2.87Å; A301-S304 WeakPolarHBondContact CA-OG 3.41Å; A301-S304 PolarHBondContact O-OG 2.93Å; S304-G306 PolarHBondContact O-N 3.14Å
305K44Very low60.2Low174 Ų174110.5 Ų110.576%0.75761%0.609SS**SBendtrans-80.269.8161.7-68-167.8178.9-176.60109.2A301 V307A301-K305 PolarHBondContact O-N 3.26Å; A301-K305 VanDerWaalsContact O-N 3.15Å; K305-V307 PolarHBondContact O-N 3.21Å
306G42.6Very low59.1Low57 Ų57113 Ų11359%0.58862%0.615SS**  trans-47.4114.6168.300000109.4S304 P308S304-G306 PolarHBondContact O-N 3.14Å; G306-P308 WeakPolarHBondContact O-CD 3.45Å
307V37.8Very low58.3Low136 Ų136111.9 Ų111.982%0.82462%0.615SS**  trans-20.2119.3176.9-1770000113.4K305K305-V307 PolarHBondContact O-N 3.21Å
308P40.8Very low57.9Low114 Ų114110.4 Ų110.474%0.7462%0.615SS**  -130138.6128.226.6-8.4000110.7G306G306-P308 WeakPolarHBondContact O-CD 3.45Å
309S38Very low57.7Low93 Ų93110 Ų11065%0.6561%0.612SS**  trans75.583.6164.9-104.30000116.9R311S309-R311 PolarHBondContact O-N 3.47Å
310G38.7Very low57.7Low60 Ų60107.9 Ų107.962%0.61961%0.608SS**THydrogen-bonded Turntrans-64.468.1155.600000112.4S314G310-S314 WeakPolarHBondContact O-CB 3.46Å
311R43.4Very low57.9Low201 Ų201108.3 Ų108.376%0.75861%0.61SS**THydrogen-bonded Turntrans-99.3-36165.3-74-173.2-178.1177.91.3112.3S309 V315S309-R311 PolarHBondContact O-N 3.47Å; R311-V315 VanDerWaalsContact O-CG2 3.28Å; R311-V315 WeakPolarHBondContact O-CG2 3.49Å; R311-V315 PolarHBondContact O-N 2.93Å
312S46.2Very low58.3Low95 Ų95109 Ų10966%0.66461%0.612SS**Hα-helixtrans-77.1-44.8-177.6-1470000113.1S314 V315 E316S312-S314 VanDerWaalsContact C-N 3.31Å; S312-V315 PolarHBondContact O-N 2.91Å; S312-E316 PolarHBondContact O-N 3.5Å
313L46.7Very low59.2Low131 Ų131108.7 Ų108.769%0.68661%0.606SS**Hα-helixtrans-72.8-25.6174.7-69.7172.9000112.3V315 E316 L317L313-V315 VanDerWaalsContact C-N 3.31Å; L313-E316 PolarHBondContact O-N 3.18Å; L313-L317 WeakPolarHBondContact O-CB 3.47Å; L313-L317 PolarHBondContact O-N 3.49Å
314S51.5Low60.4Low57 Ų57105.1 Ų105.140%0.39960%0.595SS.*Hα-helixtrans-63.1-41170.3-173.40000110.4G310 S312 L317 E318G310-S314 WeakPolarHBondContact O-CB 3.46Å; S312-S314 VanDerWaalsContact C-N 3.31Å; S314-L317 PolarHBondContact O-N 2.9Å; S314-E318 WeakPolarHBondContact O-CB 3.41Å; S314-E318 PolarHBondContact O-N 2.8Å
315V65.2Low61.8Low77 Ų77105.9 Ų105.947%0.46759%0.591SS.*Hα-helixtrans-66.8-44.7177.9171.80000111.3R311 S312 L313 E318 I319R311-V315 VanDerWaalsContact O-CG2 3.28Å; R311-V315 WeakPolarHBondContact O-CG2 3.49Å; R311-V315 PolarHBondContact O-N 2.93Å; S312-V315 PolarHBondContact O-N 2.91Å; L313-V315 VanDerWaalsContact C-N 3.31Å; V315-E318 PolarHBondContact O-N 3.31Å; V315-I319 HydrophobicContact CG1-CD1 3.71Å; V315-I319 HydrophobicContact CG1-CG1 4.33Å; V315-I319 WeakPolarHBondContact O-CB 3.49Å; V315-I319 WeakPolarHBondContact O-CD1 3.23Å; V315-I319 WeakPolarHBondContact O-CG1 3.41Å; V315-I319 PolarHBondContact O-N 3.15Å
316E64.4Low64Low126 Ų126102.2 Ų102.259%0.58958%0.579SS**Hα-helixtrans-66.7-38.2177.6-74.3-176.4178.500112.6S312 L313 I319 A320S312-E316 PolarHBondContact O-N 3.5Å; L313-E316 PolarHBondContact O-N 3.18Å; E316-I319 PolarHBondContact O-N 3.35Å; E316-A320 WeakPolarHBondContact O-CB 3.33Å; E316-A320 PolarHBondContact O-N 2.79Å
317L72.3Confident66.2Low108 Ų108103.5 Ų103.557%0.56557%0.573SS**Hα-helixtrans-68.1-38.2174.7-163.284000111.5L313 S314 A320 Q321L313-L317 WeakPolarHBondContact O-CB 3.47Å; L313-L317 PolarHBondContact O-N 3.49Å; S314-L317 PolarHBondContact O-N 2.9Å; L317-A320 PolarHBondContact O-N 3.01Å; L317-Q321 WeakPolarHBondContact O-CB 3.38Å; L317-Q321 VanDerWaalsContact O-CG 3.25Å; L317-Q321 WeakPolarHBondContact O-CG 3.46Å; L317-Q321 PolarHBondContact O-N 3.48Å
318E76Confident68.7Low117 Ų117102 Ų10255%0.54756%0.556SS.*Hα-helixtrans-69.8-36.1176.6-171.5169.3-157.800111.2S314 V315 Q321 S322S314-E318 WeakPolarHBondContact O-CB 3.41Å; S314-E318 PolarHBondContact O-N 2.8Å; V315-E318 PolarHBondContact O-N 3.31Å; E318-Q321 PolarHBondContact O-N 2.8Å; E318-S322 VanDerWaalsContact O-CB 3.25Å; E318-S322 WeakPolarHBondContact O-CB 3.45Å; E318-S322 PolarHBondContact O-N 3.32Å
319I79.4Confident71.1Confident102 Ų10298.6 Ų98.652%0.52354%0.538SS..Hα-helixtrans-64.6-43.8169.7-70.2164.2000110.5V315 E316 S322 R323V315-I319 HydrophobicContact CG1-CD1 3.71Å; V315-I319 HydrophobicContact CG1-CG1 4.33Å; V315-I319 WeakPolarHBondContact O-CB 3.49Å; V315-I319 WeakPolarHBondContact O-CD1 3.23Å; V315-I319 WeakPolarHBondContact O-CG1 3.41Å; V315-I319 PolarHBondContact O-N 3.15Å; E316-I319 PolarHBondContact O-N 3.35Å; I319-S322 PolarHBondContact O-N 2.96Å; I319-R323 WeakPolarHBondContact O-CB 3.46Å; I319-R323 PolarHBondContact O-N 2.89Å
320A77.5Confident73.7Confident51 Ų51101.3 Ų101.342%0.42153%0.534SS..Hα-helixtrans-65.5-41.8177.300000111.7E316 L317 R323 V324E316-A320 WeakPolarHBondContact O-CB 3.33Å; E316-A320 PolarHBondContact O-N 2.79Å; L317-A320 PolarHBondContact O-N 3.01Å; A320-R323 WeakPolarHBondContact O-CB 3.33Å; A320-R323 PolarHBondContact O-N 2.78Å; A320-V324 WeakPolarHBondContact O-CG2 3.43Å; A320-V324 PolarHBondContact O-N 3.3Å
321Q81.7Confident76.1Confident112 Ų112101.8 Ų101.852%0.52353%0.527SS..Hα-helixtrans-65.2-41.8174.8-75.7175-300111.9L317 E318 R323 V324 L325L317-Q321 WeakPolarHBondContact O-CB 3.38Å; L317-Q321 VanDerWaalsContact O-CG 3.25Å; L317-Q321 WeakPolarHBondContact O-CG 3.46Å; L317-Q321 PolarHBondContact O-N 3.48Å; E318-Q321 PolarHBondContact O-N 2.8Å; Q321-R323 VanDerWaalsContact C-N 3.3Å; Q321-R323 PolarHBondContact O-N 3.44Å; Q321-V324 PolarHBondContact O-N 2.97Å; Q321-L325 PolarHBondContact O-N 3.48Å
322S83.7Confident78.3Confident60 Ų6097 Ų9742%0.4252%0.517SS..Hα-helixtrans-61.3-39.9172.5-172.70000111.3E318 I319 L325 D326E318-S322 VanDerWaalsContact O-CB 3.25Å; E318-S322 WeakPolarHBondContact O-CB 3.45Å; E318-S322 PolarHBondContact O-N 3.32Å; I319-S322 PolarHBondContact O-N 2.96Å; S322-L325 PolarHBondContact O-N 3.15Å; S322-D326 WeakPolarHBondContact O-CB 3.49Å; S322-D326 VanDerWaalsContact O-CG 3.29Å; S322-D326 PolarHBondContact O-N 2.9Å
323R89.9Confident80.5Confident165 Ų16598.9 Ų98.962%0.62352%0.515SS*.Hα-helixtrans-66-38.2177-177.666.475.8146.58.1112I319 A320 Q321 L327I319-R323 WeakPolarHBondContact O-CB 3.46Å; I319-R323 PolarHBondContact O-N 2.89Å; A320-R323 WeakPolarHBondContact O-CB 3.33Å; A320-R323 PolarHBondContact O-N 2.78Å; Q321-R323 VanDerWaalsContact C-N 3.3Å; Q321-R323 PolarHBondContact O-N 3.44Å; R323-L327 HydrophobicContact CG-CD1 4.32Å; R323-L327 WeakPolarHBondContact O-CB 3.47Å; R323-L327 VanDerWaalsContact O-CG 3.29Å; R323-L327 WeakPolarHBondContact O-CG 3.25Å; R323-L327 PolarHBondContact O-N 3Å
324V89.5Confident82.6Confident76 Ų7697.5 Ų97.546%0.46151%0.507SS..Hα-helixtrans-65.4-46.7175171.10000110.2A320 Q321 D326 L327 E328A320-V324 WeakPolarHBondContact O-CG2 3.43Å; A320-V324 PolarHBondContact O-N 3.3Å; Q321-V324 PolarHBondContact O-N 2.97Å; V324-D326 VanDerWaalsContact C-N 3.34Å; V324-D326 PolarHBondContact O-N 3.14Å; V324-L327 PolarHBondContact O-N 3.25Å; V324-L327 VanDerWaalsContact O-N 3.15Å; V324-E328 HydrophobicContact CG1-CG 4.39Å; V324-E328 WeakPolarHBondContact O-CG 3.48Å; V324-E328 PolarHBondContact O-N 2.93Å
325L89.2Confident84.4Confident111 Ų111101 Ų10158%0.58152%0.517SS*.Hα-helixtrans-60.4-39.6175.6-76.6168.3000112.8Q321 S322 E328 A329Q321-L325 PolarHBondContact O-N 3.48Å; S322-L325 PolarHBondContact O-N 3.15Å; L325-E328 PolarHBondContact O-N 2.92Å; L325-A329 WeakPolarHBondContact O-CB 3.36Å; L325-A329 PolarHBondContact O-N 3.37Å
326D90.7Very high85.5Confident97 Ų97100.2 Ų100.252%0.51952%0.516SS..Hα-helixtrans-64.7-39.4175.1-76.5-22.2000112.1S322 V324 R330S322-D326 WeakPolarHBondContact O-CB 3.49Å; S322-D326 VanDerWaalsContact O-CG 3.29Å; S322-D326 PolarHBondContact O-N 2.9Å; V324-D326 VanDerWaalsContact C-N 3.34Å; V324-D326 PolarHBondContact O-N 3.14Å; D326-R330 WeakPolarHBondContact O-CB 3.43Å; D326-R330 PolarHBondContact O-N 2.95Å
327L88.7Confident86.8Confident85 Ų8599.2 Ų99.245%0.44551%0.511SS..Hα-helixtrans-70.4-40.7177.1-73.9172.9000111.5R323 V324 R330 C331R323-L327 HydrophobicContact CG-CD1 4.32Å; R323-L327 WeakPolarHBondContact O-CB 3.47Å; R323-L327 VanDerWaalsContact O-CG 3.29Å; R323-L327 WeakPolarHBondContact O-CG 3.25Å; R323-L327 PolarHBondContact O-N 3Å; V324-L327 PolarHBondContact O-N 3.25Å; V324-L327 VanDerWaalsContact O-N 3.15Å; L327-R330 PolarHBondContact O-N 3.47Å; L327-C331 PolarHBondContact O-N 2.83Å; L327-C331 PolarHBondContact O-SG 3.03Å; L327-C331 VanDerWaalsContact O-SG 3.4Å
328E90.3Very high87.4Confident103 Ų10397.3 Ų97.348%0.48151%0.506SS..Hα-helixtrans-62.2-43.5173.1-73.8176.5172.200111.3V324 L325 R330 C331 N332V324-E328 HydrophobicContact CG1-CG 4.39Å; V324-E328 WeakPolarHBondContact O-CG 3.48Å; V324-E328 PolarHBondContact O-N 2.93Å; L325-E328 PolarHBondContact O-N 2.92Å; E328-R330 VanDerWaalsContact C-N 3.33Å; E328-R330 PolarHBondContact O-N 3.17Å; E328-C331 PolarHBondContact O-N 3Å; E328-N332 WeakPolarHBondContact O-CB 3.32Å; E328-N332 VanDerWaalsContact O-CG 3.24Å; E328-N332 PolarHBondContact O-N 3.12Å; E328-N332 PolarHBondContact O-ND2 3.28Å
329A91Very high88Confident43 Ų4394.3 Ų94.336%0.35550%0.501SS..Hα-helixtrans-62.1-39.4174.200000112.2L325 N332 Q333L325-A329 WeakPolarHBondContact O-CB 3.36Å; L325-A329 PolarHBondContact O-N 3.37Å; A329-N332 PolarHBondContact O-N 3.12Å; A329-Q333 WeakPolarHBondContact O-CB 3.38Å; A329-Q333 WeakPolarHBondContact O-CG 3.41Å; A329-Q333 PolarHBondContact O-N 2.94Å
330R92.6Very high88.3Confident151 Ų15195.4 Ų95.457%0.5750%0.504SS*.Hα-helixtrans-66.3-41.7173.9-104.8175.275.4-1604.6112.6D326 L327 E328 Q333 L334D326-R330 WeakPolarHBondContact O-CB 3.43Å; D326-R330 PolarHBondContact O-N 2.95Å; L327-R330 PolarHBondContact O-N 3.47Å; E328-R330 VanDerWaalsContact C-N 3.33Å; E328-R330 PolarHBondContact O-N 3.17Å; R330-Q333 PolarHBondContact O-N 2.87Å; R330-L334 WeakPolarHBondContact O-CB 3.41Å; R330-L334 WeakPolarHBondContact O-CG 3.5Å; R330-L334 PolarHBondContact O-N 2.81Å
331C88Confident88.4Confident69 Ų6997.3 Ų97.347%0.46651%0.506SS..Hα-helixtrans-61-47.3174.9-74.40000110.4L327 E328 Q333 L334 E335L327-C331 PolarHBondContact O-N 2.83Å; L327-C331 PolarHBondContact O-SG 3.03Å; L327-C331 VanDerWaalsContact O-SG 3.4Å; E328-C331 PolarHBondContact O-N 3Å; C331-Q333 VanDerWaalsContact C-N 3.34Å; C331-Q333 PolarHBondContact O-N 3.42Å; C331-L334 PolarHBondContact O-N 3.03Å; C331-L334 VanDerWaalsContact O-N 3.17Å; C331-E335 WeakPolarHBondContact O-CB 3.45Å; C331-E335 WeakPolarHBondContact O-CG 3.15Å; C331-E335 PolarHBondContact O-N 3.34Å
332N90.5Very high88.4Confident102 Ų10298.6 Ų98.655%0.54551%0.512SS..Hα-helixtrans-61.4-38.9176.8-68.7-26.5000112.6E328 A329 S336E328-N332 WeakPolarHBondContact O-CB 3.32Å; E328-N332 VanDerWaalsContact O-CG 3.24Å; E328-N332 PolarHBondContact O-N 3.12Å; E328-N332 PolarHBondContact O-ND2 3.28Å; A329-N332 PolarHBondContact O-N 3.12Å; N332-S336 WeakPolarHBondContact O-CB 3.36Å; N332-S336 PolarHBondContact O-N 3.21Å
333Q91.7Very high88.1Confident133 Ų13398.5 Ų98.562%0.62152%0.515SS*.Hα-helixtrans-65.9-42.3174.2-77.8175.87.400112.3A329 R330 C331 S336 H337A329-Q333 WeakPolarHBondContact O-CB 3.38Å; A329-Q333 WeakPolarHBondContact O-CG 3.41Å; A329-Q333 PolarHBondContact O-N 2.94Å; R330-Q333 PolarHBondContact O-N 2.87Å; C331-Q333 VanDerWaalsContact C-N 3.34Å; C331-Q333 PolarHBondContact O-N 3.42Å; Q333-S336 PolarHBondContact O-N 3.39Å; Q333-H337 WeakPolarHBondContact O-CB 3.47Å; Q333-H337 PolarHBondContact O-N 3.28Å
334L90Very high87.5Confident102 Ų10292.8 Ų92.853%0.53450%0.504SS..Hα-helixtrans-66.7-41177.4-75.8169.5000111.4R330 C331 H337 C338R330-L334 WeakPolarHBondContact O-CB 3.41Å; R330-L334 WeakPolarHBondContact O-CG 3.5Å; R330-L334 PolarHBondContact O-N 2.81Å; C331-L334 PolarHBondContact O-N 3.03Å; C331-L334 VanDerWaalsContact O-N 3.17Å; L334-H337 PolarHBondContact O-N 2.84Å; L334-C338 WeakPolarHBondContact O-CB 3.25Å; L334-C338 PolarHBondContact O-N 2.77Å; L334-C338 PolarHBondContact O-SG 3.05Å
335E90.3Very high86.6Confident130 Ų13094.9 Ų94.961%0.60751%0.511SS*.Hα-helixtrans-62.5-44.3173.8-74.5179.1-174.700111.4C331 H337 C338 A339C331-E335 WeakPolarHBondContact O-CB 3.45Å; C331-E335 WeakPolarHBondContact O-CG 3.15Å; C331-E335 PolarHBondContact O-N 3.34Å; E335-H337 VanDerWaalsContact C-N 3.34Å; E335-H337 PolarHBondContact O-N 2.91Å; E335-C338 PolarHBondContact O-N 2.87Å; E335-A339 WeakPolarHBondContact O-CB 3.41Å; E335-A339 PolarHBondContact O-N 3.49Å
336S88.8Confident85.7Confident62 Ų6292.8 Ų92.843%0.43451%0.51SS..Hα-helixtrans-61.4-41.5173.7-169.70000112N332 Q333 A339 E340N332-S336 WeakPolarHBondContact O-CB 3.36Å; N332-S336 PolarHBondContact O-N 3.21Å; Q333-S336 PolarHBondContact O-N 3.39Å; S336-A339 PolarHBondContact O-N 3.27Å; S336-E340 WeakPolarHBondContact O-CB 3.29Å; S336-E340 WeakPolarHBondContact O-CG 3.4Å; S336-E340 PolarHBondContact O-N 3.24Å
337H90.3Very high84.5Confident105 Ų10595.3 Ų95.349%0.48652%0.517SS..Hα-helixtrans-67.8-38.7177.7-172.7-66.8000111.9Q333 L334 E335 E340 L341Q333-H337 WeakPolarHBondContact O-CB 3.47Å; Q333-H337 PolarHBondContact O-N 3.28Å; L334-H337 PolarHBondContact O-N 2.84Å; E335-H337 VanDerWaalsContact C-N 3.34Å; E335-H337 PolarHBondContact O-N 2.91Å; H337-E340 PolarHBondContact O-N 3.19Å; H337-L341 VanDerWaalsContact CE1-CD1 3.48Å; H337-L341 WeakPolarHBondContact CE1-CD1 3.44Å; H337-L341 WeakPolarHBondContact ND1-CD1 2.98Å; H337-L341 WeakPolarHBondContact O-CB 3.24Å; H337-L341 WeakPolarHBondContact O-CG 3.43Å; H337-L341 PolarHBondContact O-N 3.23Å
338C86.3Confident83.2Confident67 Ų6798.7 Ų98.745%0.45353%0.528SS..Hα-helixtrans-63.2-45172.6-73.70000110.8L334 E335 E340 L341 E342L334-C338 WeakPolarHBondContact O-CB 3.25Å; L334-C338 PolarHBondContact O-N 2.77Å; L334-C338 PolarHBondContact O-SG 3.05Å; E335-C338 PolarHBondContact O-N 2.87Å; C338-E340 PolarHBondContact O-N 3.44Å; C338-L341 PolarHBondContact O-N 2.92Å; C338-E342 WeakPolarHBondContact O-CB 3.48Å; C338-E342 WeakPolarHBondContact O-CG 3.39Å; C338-E342 PolarHBondContact O-N 3.22Å
339A87.8Confident81.7Confident54 Ų5495.9 Ų95.945%0.44653%0.527SS..Hα-helixtrans-63-39.2176.300000112.5E335 S336 E342 A343E335-A339 WeakPolarHBondContact O-CB 3.41Å; E335-A339 PolarHBondContact O-N 3.49Å; S336-A339 PolarHBondContact O-N 3.27Å; A339-E342 PolarHBondContact O-N 3.39Å; A339-A343 VanDerWaalsContact O-CB 3.31Å; A339-A343 WeakPolarHBondContact O-CB 3.27Å; A339-A343 PolarHBondContact O-N 2.87Å
340E85.4Confident79.8Confident126 Ų126103.4 Ų103.459%0.58955%0.547SS*.Hα-helixtrans-65-42.2173.2-79.8179-171.200112.3S336 H337 C338 A343 A344S336-E340 WeakPolarHBondContact O-CB 3.29Å; S336-E340 WeakPolarHBondContact O-CG 3.4Å; S336-E340 PolarHBondContact O-N 3.24Å; H337-E340 PolarHBondContact O-N 3.19Å; C338-E340 PolarHBondContact O-N 3.44Å; E340-A343 PolarHBondContact O-N 2.95Å; E340-A344 VanDerWaalsContact O-CB 3.24Å; E340-A344 WeakPolarHBondContact O-CB 3.4Å; E340-A344 PolarHBondContact O-N 3.44Å
341L80.8Confident77.9Confident90 Ų90104.6 Ų104.647%0.47155%0.553SS.*Hα-helixtrans-63.3-43.3174.7-82.6175.3000111.5H337 C338 A344 L345H337-L341 VanDerWaalsContact CE1-CD1 3.48Å; H337-L341 WeakPolarHBondContact CE1-CD1 3.44Å; H337-L341 WeakPolarHBondContact ND1-CD1 2.98Å; H337-L341 WeakPolarHBondContact O-CB 3.24Å; H337-L341 WeakPolarHBondContact O-CG 3.43Å; H337-L341 PolarHBondContact O-N 3.23Å; C338-L341 PolarHBondContact O-N 2.92Å; L341-A344 PolarHBondContact O-N 3.39Å; L341-L345 WeakPolarHBondContact O-CB 3.46Å; L341-L345 VanDerWaalsContact O-CG 3.27Å; L341-L345 WeakPolarHBondContact O-CG 3.48Å; L341-L345 PolarHBondContact O-N 3.24Å
342E79.9Confident76.2Confident139 Ų139102.6 Ų102.665%0.6554%0.544SS*.Hα-helixtrans-62.5-44.1175.3-75.7178.8-179.100111.3C338 A339 A344 L345 A346C338-E342 WeakPolarHBondContact O-CB 3.48Å; C338-E342 WeakPolarHBondContact O-CG 3.39Å; C338-E342 PolarHBondContact O-N 3.22Å; A339-E342 PolarHBondContact O-N 3.39Å; E342-A344 PolarHBondContact O-N 3.49Å; E342-L345 PolarHBondContact O-N 3.37Å; E342-A346 WeakPolarHBondContact O-CB 3.33Å; E342-A346 PolarHBondContact O-N 2.93Å
343A79Confident74.3Confident58 Ų58103.1 Ų103.148%0.47954%0.543SS..Hα-helixtrans-64.8-37.617500000112.4A339 E340 A346 K347A339-A343 VanDerWaalsContact O-CB 3.31Å; A339-A343 WeakPolarHBondContact O-CB 3.27Å; A339-A343 PolarHBondContact O-N 2.87Å; E340-A343 PolarHBondContact O-N 2.95Å; A343-A346 PolarHBondContact O-N 3.23Å; A343-K347 WeakPolarHBondContact O-CB 3.28Å; A343-K347 PolarHBondContact O-N 2.99Å
344A77.2Confident72.6Confident46 Ų46100.3 Ų100.338%0.3854%0.539SS..Hα-helixtrans-68.4-39175.300000111.8E340 L341 E342 K347 K348E340-A344 VanDerWaalsContact O-CB 3.24Å; E340-A344 WeakPolarHBondContact O-CB 3.4Å; E340-A344 PolarHBondContact O-N 3.44Å; L341-A344 PolarHBondContact O-N 3.39Å; E342-A344 PolarHBondContact O-N 3.49Å; A344-K347 PolarHBondContact O-N 2.96Å; A344-K348 WeakPolarHBondContact O-CB 3.37Å; A344-K348 PolarHBondContact O-N 3.45Å
345L70.9Confident71.2Confident119 Ų119100.7 Ų100.762%0.62354%0.541SS*.Hα-helixtrans-66.5-40.7172.9-74.6172.9000111.2L341 E342 K348 G349L341-L345 WeakPolarHBondContact O-CB 3.46Å; L341-L345 VanDerWaalsContact O-CG 3.27Å; L341-L345 WeakPolarHBondContact O-CG 3.48Å; L341-L345 PolarHBondContact O-N 3.24Å; E342-L345 PolarHBondContact O-N 3.37Å; L345-K348 PolarHBondContact O-N 3.3Å; L345-G349 PolarHBondContact O-N 3.4Å
346A69.6Low69.8Low68 Ų68100.7 Ų100.756%0.56254%0.539SS*.Hα-helixtrans-62.9-42.5173.600000111.8E342 A343 G349 Y350E342-A346 WeakPolarHBondContact O-CB 3.33Å; E342-A346 PolarHBondContact O-N 2.93Å; A343-A346 PolarHBondContact O-N 3.23Å; A346-G349 PolarHBondContact O-N 3.3Å; A346-Y350 PolarHBondContact O-N 2.97Å
347K65.4Low68.6Low150 Ų150101.6 Ų101.665%0.65254%0.539SS*.Hα-helixtrans-62.5-43.6172.1-101.9-178.6177.3174.80112.2A343 A344 G349 Y350 Y351A343-K347 WeakPolarHBondContact O-CB 3.28Å; A343-K347 PolarHBondContact O-N 2.99Å; A344-K347 PolarHBondContact O-N 2.96Å; K347-G349 VanDerWaalsContact C-N 3.27Å; K347-G349 PolarHBondContact O-N 2.91Å; K347-Y350 WeakPolarHBondContact O-CB 3Å; K347-Y350 PolarHBondContact O-N 3.18Å; K347-Y350 VanDerWaalsContact O-N 3.07Å; K347-Y351 WeakPolarHBondContact O-CD2 3.25Å; K347-Y351 PolarHBondContact O-N 3.4Å; K347-Y351 VanDerWaalsContact O-N 3.11Å
348K61.5Low67.7Low156 Ų15699 Ų9968%0.67854%0.535SS*.Hα-helixtrans-64-33.1175.1-83.7-173.7175.5-179.50112A344 L345 Y350 Y351 G352A344-K348 WeakPolarHBondContact O-CB 3.37Å; A344-K348 PolarHBondContact O-N 3.45Å; L345-K348 PolarHBondContact O-N 3.3Å; K348-Y350 VanDerWaalsContact C-N 3.27Å; K348-Y350 PolarHBondContact O-N 3.09Å; K348-Y351 PolarHBondContact O-N 3.29Å; K348-G352 PolarHBondContact O-N 2.96Å
349G57.7Low67.1Low44 Ų4499.6 Ų99.645%0.45454%0.537SS..Hα-helixtrans-59.4-38.2170.300000112.3L345 A346 K347 Q353L345-G349 PolarHBondContact O-N 3.4Å; A346-G349 PolarHBondContact O-N 3.3Å; K347-G349 VanDerWaalsContact C-N 3.27Å; K347-G349 PolarHBondContact O-N 2.91Å; G349-Q353 PolarHBondContact O-N 2.91Å; G349-Q353 VanDerWaalsContact O-N 3.16Å
350Y53Low66.4Low201 Ų201100.7 Ų100.779%0.78853%0.534SS*.Hα-helixtrans-72.6-41.8178.4-137.1-92.1000113.1A346 K347 K348A346-Y350 PolarHBondContact O-N 2.97Å; K347-Y350 WeakPolarHBondContact O-CB 3Å; K347-Y350 PolarHBondContact O-N 3.18Å; K347-Y350 VanDerWaalsContact O-N 3.07Å; K348-Y350 VanDerWaalsContact C-N 3.27Å; K348-Y350 PolarHBondContact O-N 3.09Å
351Y51.4Low66Low175 Ų175101 Ų10169%0.68654%0.536SS*.Hα-helixtrans-70.4-34.7174.3-75.4-77.6000112.4K347 K348 Q353 S354 D355K347-Y351 WeakPolarHBondContact O-CD2 3.25Å; K347-Y351 PolarHBondContact O-N 3.4Å; K347-Y351 VanDerWaalsContact O-N 3.11Å; K348-Y351 PolarHBondContact O-N 3.29Å; Y351-Q353 VanDerWaalsContact C-N 3.31Å; Y351-Q353 PolarHBondContact O-N 3.28Å; Y351-S354 PolarHBondContact O-N 2.96Å; Y351-D355 PolarHBondContact O-N 3.38Å
352G52.2Low66.1Low28 Ų28103.7 Ų103.729%0.28954%0.544SS..Hα-helixtrans-66.8-28.4176.700000113.7K348 K356K348-G352 PolarHBondContact O-N 2.96Å; G352-K356 VanDerWaalsContact O-CB 3.27Å; G352-K356 WeakPolarHBondContact O-CB 3.35Å; G352-K356 WeakPolarHBondContact O-CG 3.36Å; G352-K356 PolarHBondContact O-N 2.74Å
353Q50.2Low66Low112 Ų112101.9 Ų101.952%0.52354%0.538SS..Hα-helixtrans-73.7-35.8175.9-15378.74.800111.7G349 Y351 N357G349-Q353 PolarHBondContact O-N 2.91Å; G349-Q353 VanDerWaalsContact O-N 3.16Å; Y351-Q353 VanDerWaalsContact C-N 3.31Å; Y351-Q353 PolarHBondContact O-N 3.28Å; Q353-N357 VanDerWaalsContact O-CB 3.3Å; Q353-N357 WeakPolarHBondContact O-CB 3.45Å; Q353-N357 PolarHBondContact O-N 2.86Å; Q353-N357 PolarHBondContact O-ND2 3.5Å; Q353-N357 PolarHBondContact O-OD1 3.29Å
354S57.9Low66.1Low75 Ų75104.7 Ų104.752%0.52454%0.541SS..Hα-helixtrans-67.2-43.4175.3-176.60000111.7Y351 N357 A358Y351-S354 PolarHBondContact O-N 2.96Å; S354-N357 PolarHBondContact O-N 3.48Å; S354-A358 WeakPolarHBondContact O-CB 3.42Å; S354-A358 PolarHBondContact O-N 2.9Å
355D59.2Low66.3Low109 Ų109105.3 Ų105.358%0.58355%0.546SS*.Hα-helixtrans-69.4-37.9176.3-79.8-19.5000111.7Y351 N357 A358 V359Y351-D355 PolarHBondContact O-N 3.38Å; D355-N357 VanDerWaalsContact C-N 3.34Å; D355-N357 PolarHBondContact O-N 3.16Å; D355-A358 PolarHBondContact O-N 3.09Å; D355-V359 VanDerWaalsContact O-CB 3.29Å; D355-V359 WeakPolarHBondContact O-CB 3.16Å; D355-V359 WeakPolarHBondContact O-CG2 3.16Å; D355-V359 PolarHBondContact O-N 3.15Å
356K60.9Low66.9Low131 Ų131102.5 Ų102.557%0.5753%0.532SS*.Hα-helixtrans-61.3-43.1170.8-79.1177.1-178.6-177.90111.5G352 A358 V359 I360G352-K356 VanDerWaalsContact O-CB 3.27Å; G352-K356 WeakPolarHBondContact O-CB 3.35Å; G352-K356 WeakPolarHBondContact O-CG 3.36Å; G352-K356 PolarHBondContact O-N 2.74Å; K356-A358 VanDerWaalsContact C-N 3.35Å; K356-V359 CarbonylContact O-C 3.54Å; K356-V359 PolarHBondContact O-N 3.46Å; K356-I360 VanDerWaalsContact O-CB 3.26Å; K356-I360 WeakPolarHBondContact O-CB 3.36Å; K356-I360 WeakPolarHBondContact O-CD1 3.38Å; K356-I360 WeakPolarHBondContact O-CG1 3.48Å; K356-I360 PolarHBondContact O-N 3.41Å
357N63.6Low67.4Low81 Ų81102.8 Ų102.843%0.43353%0.526SS..Hα-helixtrans-67.5-35.7177.4-71-10.7000111.9Q353 S354 D355 Q361Q353-N357 VanDerWaalsContact O-CB 3.3Å; Q353-N357 WeakPolarHBondContact O-CB 3.45Å; Q353-N357 PolarHBondContact O-N 2.86Å; Q353-N357 PolarHBondContact O-ND2 3.5Å; Q353-N357 PolarHBondContact O-OD1 3.29Å; S354-N357 PolarHBondContact O-N 3.48Å; D355-N357 VanDerWaalsContact C-N 3.34Å; D355-N357 PolarHBondContact O-N 3.16Å; N357-Q361 WeakPolarHBondContact O-CB 3.34Å; N357-Q361 WeakPolarHBondContact O-CG 3.47Å; N357-Q361 PolarHBondContact O-N 3.32Å
358A71.6Confident68.1Low49 Ų4998.1 Ų98.141%0.40552%0.516SS..Hα-helixtrans-68.9-39.9173.600000111.8S354 D355 K356 Q361 K362S354-A358 WeakPolarHBondContact O-CB 3.42Å; S354-A358 PolarHBondContact O-N 2.9Å; D355-A358 PolarHBondContact O-N 3.09Å; K356-A358 VanDerWaalsContact C-N 3.35Å; A358-Q361 PolarHBondContact O-N 3.38Å; A358-K362 WeakPolarHBondContact O-CB 3.42Å; A358-K362 PolarHBondContact O-N 3.28Å
359V74.7Confident69.1Low80 Ų8099.4 Ų99.449%0.48552%0.516SS..Hα-helixtrans-67.2-41.5173.9170.10000110.5D355 K356 K362 L363D355-V359 VanDerWaalsContact O-CB 3.29Å; D355-V359 WeakPolarHBondContact O-CB 3.16Å; D355-V359 WeakPolarHBondContact O-CG2 3.16Å; D355-V359 PolarHBondContact O-N 3.15Å; K356-V359 CarbonylContact O-C 3.54Å; K356-V359 PolarHBondContact O-N 3.46Å; V359-K362 CarbonylContact O-C 3.56Å; V359-K362 WeakPolarHBondContact O-CB 3.45Å; V359-K362 PolarHBondContact O-N 2.86Å; V359-L363 HydrophobicContact CG1-CD1 3.83Å; V359-L363 HydrophobicContact CG1-CG 4.23Å; V359-L363 WeakPolarHBondContact O-CB 3.45Å; V359-L363 WeakPolarHBondContact O-CG 3.49Å; V359-L363 PolarHBondContact O-N 3.39Å
360I72.2Confident70.1Confident77 Ų77104.8 Ų104.840%0.39552%0.524SS..Hα-helixtrans-62.6-47.1174.2-71.3162.4000109.3K356 K362 L363 E364K356-I360 VanDerWaalsContact O-CB 3.26Å; K356-I360 WeakPolarHBondContact O-CB 3.36Å; K356-I360 WeakPolarHBondContact O-CD1 3.38Å; K356-I360 WeakPolarHBondContact O-CG1 3.48Å; K356-I360 PolarHBondContact O-N 3.41Å; I360-K362 VanDerWaalsContact C-N 3.3Å; I360-K362 PolarHBondContact O-N 3.38Å; I360-L363 CarbonylContact O-C 3.59Å; I360-L363 PolarHBondContact O-N 2.87Å; I360-E364 HydrophobicContact CG2-CG 4.1Å; I360-E364 WeakPolarHBondContact CG2-OE1 3.34Å; I360-E364 VanDerWaalsContact O-CB 3.29Å; I360-E364 WeakPolarHBondContact O-CB 3.37Å; I360-E364 WeakPolarHBondContact O-CG 3.49Å; I360-E364 PolarHBondContact O-N 3.19Å
361Q77Confident71.2Confident133 Ų133100.8 Ų100.862%0.62151%0.512SS*.Hα-helixtrans-61.4-36.8173.9-82-1797.800112.8N357 A358 A365N357-Q361 WeakPolarHBondContact O-CB 3.34Å; N357-Q361 WeakPolarHBondContact O-CG 3.47Å; N357-Q361 PolarHBondContact O-N 3.32Å; A358-Q361 PolarHBondContact O-N 3.38Å; Q361-A365 WeakPolarHBondContact O-CB 3.46Å; Q361-A365 PolarHBondContact O-N 2.93Å
362K82.2Confident72.4Confident147 Ų14799.3 Ų99.364%0.63951%0.512SS*.Hα-helixtrans-66-44.6174.7-129.3177.3-177.4-177.40111.1A358 V359 I360 A365 D366A358-K362 WeakPolarHBondContact O-CB 3.42Å; A358-K362 PolarHBondContact O-N 3.28Å; V359-K362 CarbonylContact O-C 3.56Å; V359-K362 WeakPolarHBondContact O-CB 3.45Å; V359-K362 PolarHBondContact O-N 2.86Å; I360-K362 VanDerWaalsContact C-N 3.3Å; I360-K362 PolarHBondContact O-N 3.38Å; K362-A365 PolarHBondContact O-N 3.25Å; K362-D366 VanDerWaalsContact O-CB 3.27Å; K362-D366 WeakPolarHBondContact O-CB 3.3Å; K362-D366 PolarHBondContact O-N 2.9Å
363L78.4Confident73.4Confident101 Ų101102.1 Ų102.153%0.52952%0.518SS..Hα-helixtrans-66.9-38176.5-71.9172000111.2V359 I360 D366 V367V359-L363 HydrophobicContact CG1-CD1 3.83Å; V359-L363 HydrophobicContact CG1-CG 4.23Å; V359-L363 WeakPolarHBondContact O-CB 3.45Å; V359-L363 WeakPolarHBondContact O-CG 3.49Å; V359-L363 PolarHBondContact O-N 3.39Å; I360-L363 CarbonylContact O-C 3.59Å; I360-L363 PolarHBondContact O-N 2.87Å; L363-D366 PolarHBondContact O-N 2.87Å; L363-V367 VanDerWaalsContact O-CB 3.24Å; L363-V367 WeakPolarHBondContact O-CB 3.46Å; L363-V367 WeakPolarHBondContact O-CG2 3.42Å; L363-V367 PolarHBondContact O-N 2.68Å
364E80.5Confident74.1Confident117 Ų117101.8 Ų101.855%0.54752%0.519SS..Hα-helixtrans-67.1-41174.1-74.7171.3169.100111I360 A368I360-E364 HydrophobicContact CG2-CG 4.1Å; I360-E364 WeakPolarHBondContact CG2-OE1 3.34Å; I360-E364 VanDerWaalsContact O-CB 3.29Å; I360-E364 WeakPolarHBondContact O-CB 3.37Å; I360-E364 WeakPolarHBondContact O-CG 3.49Å; I360-E364 PolarHBondContact O-N 3.19Å; E364-A368 VanDerWaalsContact O-CB 3.28Å; E364-A368 WeakPolarHBondContact O-CB 3.39Å; E364-A368 PolarHBondContact O-N 3.43Å
365A81.3Confident74.7Confident58 Ų58105.4 Ų105.448%0.47953%0.525SS..Hα-helixtrans-67.7-40.6174.100000112Q361 K362 A368 R369Q361-A365 WeakPolarHBondContact O-CB 3.46Å; Q361-A365 PolarHBondContact O-N 2.93Å; K362-A365 PolarHBondContact O-N 3.25Å; A365-A368 PolarHBondContact O-N 3.46Å; A365-R369 VanDerWaalsContact O-CB 3.25Å; A365-R369 WeakPolarHBondContact O-CB 3.49Å; A365-R369 PolarHBondContact O-N 3.05Å
366D85.2Confident75Confident60 Ų60106.3 Ų106.332%0.32152%0.52SS..Hα-helixtrans-65.9-44.5175.1-75.5-22.9000110.2K362 L363 R369 Y370K362-D366 VanDerWaalsContact O-CB 3.27Å; K362-D366 WeakPolarHBondContact O-CB 3.3Å; K362-D366 PolarHBondContact O-N 2.9Å; L363-D366 PolarHBondContact O-N 2.87Å; D366-R369 CarbonylContact O-C 3.56Å; D366-R369 WeakPolarHBondContact O-CB 3.48Å; D366-R369 PolarHBondContact O-N 3.19Å; D366-Y370 HydrophobicContact CB-CD2 4.32Å; D366-Y370 HydrophobicContact CB-CE2 4.03Å; D366-Y370 WeakPolarHBondContact O-CB 3.4Å; D366-Y370 WeakPolarHBondContact O-CD2 3.41Å; D366-Y370 VanDerWaalsContact O-CG 3.32Å; D366-Y370 PolarHBondContact O-N 2.94Å
367V79Confident74.6Confident75 Ų75104.6 Ų104.646%0.45552%0.515SS..Hα-helixtrans-60.3-47.3173.91680000110.5L363 R369 Y370 E371L363-V367 VanDerWaalsContact O-CB 3.24Å; L363-V367 WeakPolarHBondContact O-CB 3.46Å; L363-V367 WeakPolarHBondContact O-CG2 3.42Å; L363-V367 PolarHBondContact O-N 2.68Å; V367-R369 VanDerWaalsContact C-N 3.27Å; V367-R369 PolarHBondContact O-N 3.11Å; V367-Y370 CarbonylContact O-C 3.58Å; V367-Y370 PolarHBondContact O-N 3.34Å; V367-Y370 VanDerWaalsContact O-N 3.15Å; V367-E371 HydrophobicContact CG1-CG 4.31Å; V367-E371 WeakPolarHBondContact O-CB 3.48Å; V367-E371 VanDerWaalsContact O-CG 3.31Å; V367-E371 WeakPolarHBondContact O-CG 3.28Å; V367-E371 PolarHBondContact O-N 3.5Å
368A81Confident74.2Confident51 Ų51106 Ų10642%0.42152%0.519SS..Hα-helixtrans-60.8-37.7176.200000112.2E364 A365 E371 Q372E364-A368 VanDerWaalsContact O-CB 3.28Å; E364-A368 WeakPolarHBondContact O-CB 3.39Å; E364-A368 PolarHBondContact O-N 3.43Å; A365-A368 PolarHBondContact O-N 3.46Å; A368-E371 PolarHBondContact O-N 3.2Å; A368-Q372 WeakPolarHBondContact O-CB 3.35Å; A368-Q372 PolarHBondContact O-N 3.01Å
369R82.9Confident73.5Confident183 Ų183108 Ų10869%0.69153%0.53SS*.Hα-helixtrans-68.6-41.3175.2-167.5-178.3175.6-151.7-3.1111.6A365 D366 V367 Q372 E373A365-R369 VanDerWaalsContact O-CB 3.25Å; A365-R369 WeakPolarHBondContact O-CB 3.49Å; A365-R369 PolarHBondContact O-N 3.05Å; D366-R369 CarbonylContact O-C 3.56Å; D366-R369 WeakPolarHBondContact O-CB 3.48Å; D366-R369 PolarHBondContact O-N 3.19Å; V367-R369 VanDerWaalsContact C-N 3.27Å; V367-R369 PolarHBondContact O-N 3.11Å; R369-Q372 PolarHBondContact O-N 3.44Å; R369-E373 WeakPolarHBondContact O-CB 3.31Å; R369-E373 PolarHBondContact O-N 3.02Å
370Y78.8Confident72.1Confident157 Ų157108 Ų10862%0.61653%0.527SS*.Hα-helixtrans-66-37.9174.2-72-54.3000111.7D366 V367 E373 L374D366-Y370 HydrophobicContact CB-CD2 4.32Å; D366-Y370 HydrophobicContact CB-CE2 4.03Å; D366-Y370 WeakPolarHBondContact O-CB 3.4Å; D366-Y370 WeakPolarHBondContact O-CD2 3.41Å; D366-Y370 VanDerWaalsContact O-CG 3.32Å; D366-Y370 PolarHBondContact O-N 2.94Å; V367-Y370 CarbonylContact O-C 3.58Å; V367-Y370 PolarHBondContact O-N 3.34Å; V367-Y370 VanDerWaalsContact O-N 3.15Å; Y370-E373 PolarHBondContact O-N 2.94Å; Y370-L374 VanDerWaalsContact O-CB 3.29Å; Y370-L374 WeakPolarHBondContact O-CB 3.49Å; Y370-L374 PolarHBondContact O-N 3.29Å
371E75.6Confident70.7Confident117 Ų117111.4 Ų111.455%0.54754%0.542SS..Hα-helixtrans-65.1-38.9173.9-75.2178.717400112V367 A368 L374 K375V367-E371 HydrophobicContact CG1-CG 4.31Å; V367-E371 WeakPolarHBondContact O-CB 3.48Å; V367-E371 VanDerWaalsContact O-CG 3.31Å; V367-E371 WeakPolarHBondContact O-CG 3.28Å; V367-E371 PolarHBondContact O-N 3.5Å; A368-E371 PolarHBondContact O-N 3.2Å; E371-L374 PolarHBondContact O-N 3.11Å; E371-K375 PolarHBondContact O-N 3.37Å
372Q76.3Confident69.4Low145 Ų145116.4 Ų116.468%0.67856%0.555SS**Hα-helixtrans-68.9-40.2175.7-158.417729.900111.6A368 R369 K375 R376A368-Q372 WeakPolarHBondContact O-CB 3.35Å; A368-Q372 PolarHBondContact O-N 3.01Å; R369-Q372 PolarHBondContact O-N 3.44Å; Q372-K375 PolarHBondContact O-N 2.98Å; Q372-R376 PolarHBondContact O-N 3.27Å
373E72.7Confident67.5Low87 Ų87116.2 Ų116.241%0.40756%0.561SS.*Hα-helixtrans-68.1-37.3173.8-165.561.9-155.300111.4R369 Y370 R376 M377R369-E373 WeakPolarHBondContact O-CB 3.31Å; R369-E373 PolarHBondContact O-N 3.02Å; Y370-E373 PolarHBondContact O-N 2.94Å; E373-R376 CarbonylContact O-C 3.58Å; E373-R376 WeakPolarHBondContact O-CB 3.47Å; E373-R376 PolarHBondContact O-N 3.43Å; E373-R376 VanDerWaalsContact O-N 3.14Å; E373-R376 IonicContact OE1-CZ 3.39Å; E373-R376 VanDerWaalsContact OE1-CZ 3.27Å; E373-R376 IonicContact OE1-NE 3.2Å; E373-R376 PolarHBondContact OE1-NE 2.71Å; E373-R376 IonicContact OE1-NH2 3.55Å; E373-R376 PolarHBondContact OE1-NH2 3.3Å; E373-R376 IonicContact OE2-NE 3.27Å; E373-R376 PolarHBondContact OE2-NE 2.93Å; E373-M377 WeakPolarHBondContact O-CB 3.17Å; E373-M377 VanDerWaalsContact O-CG 3.28Å; E373-M377 WeakPolarHBondContact O-CG 3.35Å; E373-M377 PolarHBondContact O-N 3.03Å
374L64.6Low66Low105 Ų105116.4 Ų116.455%0.5556%0.558SS.*Hα-helixtrans-60.5-43.9172.2-108.1152.4000111.6Y370 E371 R376 M377 Q378Y370-L374 VanDerWaalsContact O-CB 3.29Å; Y370-L374 WeakPolarHBondContact O-CB 3.49Å; Y370-L374 PolarHBondContact O-N 3.29Å; E371-L374 PolarHBondContact O-N 3.11Å; L374-R376 VanDerWaalsContact C-N 3.31Å; L374-R376 PolarHBondContact O-N 3.05Å; L374-M377 PolarHBondContact O-N 3.3Å; L374-Q378 WeakPolarHBondContact O-CB 3.22Å; L374-Q378 WeakPolarHBondContact O-CG 3.46Å; L374-Q378 PolarHBondContact O-N 2.89Å
375K70.2Confident64.3Low151 Ų151115.8 Ų115.866%0.65757%0.573SS**Hα-helixtrans-61.9-38.3172.7-83177.1177.4169.10112.3E371 Q372 Q378 S379E371-K375 PolarHBondContact O-N 3.37Å; Q372-K375 PolarHBondContact O-N 2.98Å; K375-Q378 PolarHBondContact O-N 3.36Å; K375-S379 PolarHBondContact O-N 3.49Å; K375-S379 VanDerWaalsContact O-N 3.09Å
376R65.4Low62.6Low127 Ų127121 Ų12148%0.47959%0.593SS.*Hα-helixtrans-66.2-40.6176-153.3-176.572.377.44.5111.4Q372 E373 L374 S379 N380Q372-R376 PolarHBondContact O-N 3.27Å; E373-R376 CarbonylContact O-C 3.58Å; E373-R376 WeakPolarHBondContact O-CB 3.47Å; E373-R376 PolarHBondContact O-N 3.43Å; E373-R376 VanDerWaalsContact O-N 3.14Å; E373-R376 IonicContact OE1-CZ 3.39Å; E373-R376 VanDerWaalsContact OE1-CZ 3.27Å; E373-R376 IonicContact OE1-NE 3.2Å; E373-R376 PolarHBondContact OE1-NE 2.71Å; E373-R376 IonicContact OE1-NH2 3.55Å; E373-R376 PolarHBondContact OE1-NH2 3.3Å; E373-R376 IonicContact OE2-NE 3.27Å; E373-R376 PolarHBondContact OE2-NE 2.93Å; L374-R376 VanDerWaalsContact C-N 3.31Å; L374-R376 PolarHBondContact O-N 3.05Å; R376-S379 PolarHBondContact O-N 3.37Å; R376-S379 PolarHBondContact O-OG 2.94Å; R376-N380 PolarHBondContact O-N 3.26Å
377M52.9Low60.8Low95 Ų95122.9 Ų122.947%0.46860%0.598SS.*Hα-helixtrans-69.3-39.4176.1-69.9-65-69.400112.2E373 L374 S379 N380E373-M377 WeakPolarHBondContact O-CB 3.17Å; E373-M377 VanDerWaalsContact O-CG 3.28Å; E373-M377 WeakPolarHBondContact O-CG 3.35Å; E373-M377 PolarHBondContact O-N 3.03Å; L374-M377 PolarHBondContact O-N 3.3Å; M377-S379 VanDerWaalsContact C-N 3.27Å; M377-S379 PolarHBondContact O-N 3.47Å; M377-N380 WeakPolarHBondContact O-CA 3.4Å; M377-N380 PolarHBondContact O-N 3.48Å
378Q55.7Low59.4Low110 Ų110121.2 Ų121.251%0.51460%0.595SS.*Hα-helixtrans-61.2-35172.4-78.9178.9-20.700112L374 K375 N380 E381L374-Q378 WeakPolarHBondContact O-CB 3.22Å; L374-Q378 WeakPolarHBondContact O-CG 3.46Å; L374-Q378 PolarHBondContact O-N 2.89Å; K375-Q378 PolarHBondContact O-N 3.36Å; Q378-N380 PolarHBondContact O-N 2.93Å; Q378-E381 WeakPolarHBondContact O-CB 3.3Å; Q378-E381 WeakPolarHBondContact O-CG 3.4Å; Q378-E381 PolarHBondContact O-N 3.17Å
379S56.5Low58.2Low91 Ų91122.4 Ų122.464%0.63661%0.606SS**THydrogen-bonded Turntrans-71.7-13173.969.70000114.6K375 R376 M377K375-S379 PolarHBondContact O-N 3.49Å; K375-S379 VanDerWaalsContact O-N 3.09Å; R376-S379 PolarHBondContact O-N 3.37Å; R376-S379 PolarHBondContact O-OG 2.94Å; M377-S379 VanDerWaalsContact C-N 3.27Å; M377-S379 PolarHBondContact O-N 3.47Å
380N46.3Very low57Low80 Ų80117.2 Ų117.243%0.42859%0.594SS.*THydrogen-bonded Turntrans-101.712.9177.3-85.9-2.1000113.4R376 M377 Q378 R382R376-N380 PolarHBondContact O-N 3.26Å; M377-N380 WeakPolarHBondContact O-CA 3.4Å; M377-N380 PolarHBondContact O-N 3.48Å; Q378-N380 PolarHBondContact O-N 2.93Å; N380-R382 PolarHBondContact O-N 3.43Å
381E43.2Very low56Low150 Ų150113.4 Ų113.470%0.70159%0.587SS**THydrogen-bonded Turntrans-65.53-178.2-83.2179.1178.400115.6Q378Q378-E381 WeakPolarHBondContact O-CB 3.3Å; Q378-E381 WeakPolarHBondContact O-CG 3.4Å; Q378-E381 PolarHBondContact O-N 3.17Å
382R48.6Very low55.5Low238 Ų238112.6 Ų112.690%0.89859%0.586SS**THydrogen-bonded Turntrans-86.5-12.3178.7-75-172.5-175.8179.62.7115.9N380N380-R382 PolarHBondContact O-N 3.43Å
383D43.4Very low55.3Low142 Ų142111.5 Ų111.576%0.75958%0.581SS**SBendtrans-124.720.7-169.1-64.8-29.8000116.2
384F45.4Very low55.3Low105 Ų105112.4 Ų112.446%0.46159%0.585SS.*  trans-115.144.2177.4-74.1-64.3000114.7D386 K387F384-D386 PolarHBondContact O-N 3.43Å; F384-K387 HydrophobicContact CD1-CB 4.28Å; F384-K387 HydrophobicContact CD1-CD 3.4Å; F384-K387 HydrophobicContact CD1-CG 3.74Å; F384-K387 HydrophobicContact CE1-CD 3.58Å; F384-K387 HydrophobicContact CE1-CG 4.27Å; F384-K387 HydrophobicContact CG-CD 4.34Å
385A44.7Very low55.8Low104 Ų104114.3 Ų114.386%0.8659%0.586SS**THydrogen-bonded Turntrans-71.5-11.4167.200000113.5
386D47.4Very low56.2Low169 Ų169112.9 Ų112.990%0.90458%0.582SS**THydrogen-bonded Turntrans-108.19-175.9-136.310.7000114.1F384F384-D386 PolarHBondContact O-N 3.43Å
387K46.5Very low56.9Low99 Ų99114.5 Ų114.543%0.4359%0.588SS.*  trans-107.37.2172.3-74.2-169.6-177.4169.10113.9F384 A389 V390 V391F384-K387 HydrophobicContact CD1-CB 4.28Å; F384-K387 HydrophobicContact CD1-CD 3.4Å; F384-K387 HydrophobicContact CD1-CG 3.74Å; F384-K387 HydrophobicContact CE1-CD 3.58Å; F384-K387 HydrophobicContact CE1-CG 4.27Å; F384-K387 HydrophobicContact CG-CD 4.34Å; K387-A389 PolarHBondContact O-N 3.5Å; K387-A389 VanDerWaalsContact O-N 3.07Å; K387-V390 PolarHBondContact O-N 2.92Å; K387-V391 HydrophobicContact CB-CG2 4.13Å; K387-V391 WeakPolarHBondContact O-CG2 3.43Å; K387-V391 PolarHBondContact O-N 2.96Å
388G50Low58.3Low39 Ų39114.7 Ų114.740%0.40260%0.595SS.*Hα-helixtrans-49.6-38.7-177.800000113.8D392G388-D392 VanDerWaalsContact O-CB 3.23Å; G388-D392 WeakPolarHBondContact O-CB 3.39Å; G388-D392 PolarHBondContact O-N 3.06Å
389A55.6Low59.8Low77 Ų77116 Ų11664%0.63660%0.595SS**Hα-helixtrans-71.9-33177.200000114.2K387 Q393K387-A389 PolarHBondContact O-N 3.5Å; K387-A389 VanDerWaalsContact O-N 3.07Å; A389-Q393 WeakPolarHBondContact O-CG 3.5Å; A389-Q393 PolarHBondContact O-N 3.3Å; A389-Q393 VanDerWaalsContact O-N 3.15Å
390V56.5Low61.2Low74 Ų74117 Ų11745%0.44859%0.592SS.*Hα-helixtrans-77.9-40.1176.5-1780000110.2K387 Q393 E394K387-V390 PolarHBondContact O-N 2.92Å; V390-Q393 PolarHBondContact O-N 3.46Å; V390-E394 WeakPolarHBondContact O-CB 3.21Å; V390-E394 PolarHBondContact O-N 3.35Å
391V58.5Low63.3Low77 Ų77119 Ų11947%0.46760%0.599SS.*Hα-helixtrans-64.8-41175.2175.70000110.7K387 E394 Y395K387-V391 HydrophobicContact CB-CG2 4.13Å; K387-V391 WeakPolarHBondContact O-CG2 3.43Å; K387-V391 PolarHBondContact O-N 2.96Å; V391-E394 PolarHBondContact O-N 2.94Å; V391-Y395 WeakPolarHBondContact O-CB 3.37Å; V391-Y395 PolarHBondContact O-N 3.28Å
392D65.7Low65.4Low99 Ų99114 Ų11453%0.52958%0.583SS.*Hα-helixtrans-64.4-39.8173.2-84.2-15000111.6G388 Q396G388-D392 VanDerWaalsContact O-CB 3.23Å; G388-D392 WeakPolarHBondContact O-CB 3.39Å; G388-D392 PolarHBondContact O-N 3.06Å; D392-Q396 WeakPolarHBondContact O-CB 3.41Å; D392-Q396 VanDerWaalsContact O-CG 3.28Å; D392-Q396 WeakPolarHBondContact O-CG 3.32Å; D392-Q396 PolarHBondContact O-N 2.89Å
393Q72.8Confident67.3Low123 Ų123106.1 Ų106.158%0.57556%0.557SS**Hα-helixtrans-65.1-43174.4-81.3-175.61.400112.3A389 V390 R397A389-Q393 WeakPolarHBondContact O-CG 3.5Å; A389-Q393 PolarHBondContact O-N 3.3Å; A389-Q393 VanDerWaalsContact O-N 3.15Å; V390-Q393 PolarHBondContact O-N 3.46Å; Q393-R397 WeakPolarHBondContact O-CB 3.49Å; Q393-R397 PolarHBondContact O-N 3.46Å
394E71.7Confident69.6Low105 Ų105105.3 Ų105.349%0.49155%0.547SS..Hα-helixtrans-67.1-42.4176-79.7177.2159.300111.6V390 V391 R397 V398V390-E394 WeakPolarHBondContact O-CB 3.21Å; V390-E394 PolarHBondContact O-N 3.35Å; V391-E394 PolarHBondContact O-N 2.94Å; E394-R397 WeakPolarHBondContact O-CB 3.2Å; E394-R397 PolarHBondContact O-N 2.89Å; E394-R397 VanDerWaalsContact O-N 3.13Å; E394-V398 WeakPolarHBondContact O-CG2 3.38Å; E394-V398 PolarHBondContact O-N 2.91Å
395Y74.9Confident71.8Confident145 Ų145105.1 Ų105.157%0.56955%0.55SS*.Hα-helixtrans-59.7-46.7174.3176.5-98.6000111V391 R397 V398 R399V391-Y395 WeakPolarHBondContact O-CB 3.37Å; V391-Y395 PolarHBondContact O-N 3.28Å; Y395-R397 VanDerWaalsContact C-N 3.31Å; Y395-R397 PolarHBondContact O-N 3.2Å; Y395-V398 PolarHBondContact O-N 2.89Å; Y395-R399 WeakPolarHBondContact O-CB 3.44Å; Y395-R399 PolarHBondContact O-N 3.21Å
396Q79.1Confident74.1Confident121 Ų121106.6 Ų106.657%0.56554%0.539SS*.Hα-helixtrans-61.8-40173.9-76.4-171.112.800111.7D392 R399 L400D392-Q396 WeakPolarHBondContact O-CB 3.41Å; D392-Q396 VanDerWaalsContact O-CG 3.28Å; D392-Q396 WeakPolarHBondContact O-CG 3.32Å; D392-Q396 PolarHBondContact O-N 2.89Å; Q396-R399 PolarHBondContact O-N 3.12Å; Q396-L400 VanDerWaalsContact O-CB 3.3Å; Q396-L400 WeakPolarHBondContact O-CB 3.47Å; Q396-L400 WeakPolarHBondContact O-CG 3.47Å; Q396-L400 PolarHBondContact O-N 2.9Å
397R80.2Confident76.2Confident161 Ų161104.2 Ų104.261%0.60853%0.525SS*.Hα-helixtrans-64.7-43.8178.6-152.3-173.7-71.5164.9-2.5111.6Q393 E394 Y395 Q401Q393-R397 WeakPolarHBondContact O-CB 3.49Å; Q393-R397 PolarHBondContact O-N 3.46Å; E394-R397 WeakPolarHBondContact O-CB 3.2Å; E394-R397 PolarHBondContact O-N 2.89Å; E394-R397 VanDerWaalsContact O-N 3.13Å; Y395-R397 VanDerWaalsContact C-N 3.31Å; Y395-R397 PolarHBondContact O-N 3.2Å; R397-Q401 WeakPolarHBondContact O-CB 3.36Å; R397-Q401 PolarHBondContact O-N 3.35Å
398V82.5Confident78.4Confident100 Ų100103.2 Ų103.261%0.60652%0.522SS*.Hα-helixtrans-67.8-42.8176.2172.50000111.2E394 Y395 Q401 A402E394-V398 WeakPolarHBondContact O-CG2 3.38Å; E394-V398 PolarHBondContact O-N 2.91Å; Y395-V398 PolarHBondContact O-N 2.89Å; V398-Q401 CarbonylContact O-C 3.58Å; V398-Q401 WeakPolarHBondContact O-CB 3.44Å; V398-Q401 PolarHBondContact O-N 2.91Å; V398-Q401 VanDerWaalsContact O-N 3.13Å; V398-A402 PolarHBondContact O-N 3.41Å
399R86.4Confident80.4Confident137 Ų137107.2 Ų107.252%0.51753%0.534SS..Hα-helixtrans-60.8-47.9176.4-180-179.5168174.30.5111.4Y395 Q396 Q401 A402 E403Y395-R399 WeakPolarHBondContact O-CB 3.44Å; Y395-R399 PolarHBondContact O-N 3.21Å; Q396-R399 PolarHBondContact O-N 3.12Å; R399-Q401 PolarHBondContact O-N 3.39Å; R399-A402 PolarHBondContact O-N 3.43Å; R399-A402 VanDerWaalsContact O-N 3.17Å; R399-E403 HydrophobicContact CG-CG 4.47Å; R399-E403 IonicContact CZ-OE1 3.27Å; R399-E403 IonicContact NE-OE1 2.94Å; R399-E403 PolarHBondContact NE-OE1 2.91Å; R399-E403 IonicContact NH2-OE1 2.99Å; R399-E403 PolarHBondContact NH2-OE1 3.41Å; R399-E403 WeakPolarHBondContact O-CB 3.44Å; R399-E403 WeakPolarHBondContact O-CG 3.42Å; R399-E403 PolarHBondContact O-N 3.36Å
400L85.4Confident82.2Confident112 Ų112105.1 Ų105.159%0.58652%0.519SS*.Hα-helixtrans-59.9-35.2174.4-74.3169000111.7Q396 K404Q396-L400 VanDerWaalsContact O-CB 3.3Å; Q396-L400 WeakPolarHBondContact O-CB 3.47Å; Q396-L400 WeakPolarHBondContact O-CG 3.47Å; Q396-L400 PolarHBondContact O-N 2.9Å; L400-K404 VanDerWaalsContact O-CB 3.27Å; L400-K404 WeakPolarHBondContact O-CB 3.11Å; L400-K404 PolarHBondContact O-N 3.47Å
401Q91.1Very high83.9Confident123 Ų123107 Ų10758%0.57552%0.523SS*.Hα-helixtrans-72.7-35.8175.9-171.5155.8-1300112.9R397 V398 R399 K404 L405R397-Q401 WeakPolarHBondContact O-CB 3.36Å; R397-Q401 PolarHBondContact O-N 3.35Å; V398-Q401 CarbonylContact O-C 3.58Å; V398-Q401 WeakPolarHBondContact O-CB 3.44Å; V398-Q401 PolarHBondContact O-N 2.91Å; V398-Q401 VanDerWaalsContact O-N 3.13Å; R399-Q401 PolarHBondContact O-N 3.39Å; Q401-K404 WeakPolarHBondContact O-CB 3.39Å; Q401-K404 PolarHBondContact O-N 2.88Å; Q401-L405 WeakPolarHBondContact O-CG 3.41Å; Q401-L405 PolarHBondContact O-N 2.84Å
402A86.4Confident85.6Confident44 Ų44108.8 Ų108.836%0.36453%0.525SS..Hα-helixtrans-67.2-47.317300000111V398 R399 K404 L405 E406V398-A402 PolarHBondContact O-N 3.41Å; R399-A402 PolarHBondContact O-N 3.43Å; R399-A402 VanDerWaalsContact O-N 3.17Å; A402-K404 PolarHBondContact O-N 3.3Å; A402-L405 PolarHBondContact O-N 3.41Å; A402-L405 VanDerWaalsContact O-N 3.1Å; A402-E406 WeakPolarHBondContact O-CG 3.46Å; A402-E406 PolarHBondContact O-N 3.02Å
403E88.6Confident87Confident73 Ų73106.8 Ų106.834%0.34152%0.518SS..Hα-helixtrans-57.9-38.4173.5-72.5173.6-173.600110.9R399 E406 L407R399-E403 HydrophobicContact CG-CG 4.47Å; R399-E403 IonicContact CZ-OE1 3.27Å; R399-E403 IonicContact NE-OE1 2.94Å; R399-E403 PolarHBondContact NE-OE1 2.91Å; R399-E403 IonicContact NH2-OE1 2.99Å; R399-E403 PolarHBondContact NH2-OE1 3.41Å; R399-E403 WeakPolarHBondContact O-CB 3.44Å; R399-E403 WeakPolarHBondContact O-CG 3.42Å; R399-E403 PolarHBondContact O-N 3.36Å; E403-E406 PolarHBondContact O-N 3Å; E403-L407 WeakPolarHBondContact O-CB 3.28Å; E403-L407 VanDerWaalsContact O-CG 3.3Å; E403-L407 WeakPolarHBondContact O-CG 3.49Å; E403-L407 PolarHBondContact O-N 3.45Å
404K92.6Very high88Confident125 Ų125106.3 Ų106.354%0.54352%0.519SS..Hα-helixtrans-64.1-46.2173.3-175.4-176.2177.6-164.50112.5L400 Q401 A402 E406 L407 E408L400-K404 VanDerWaalsContact O-CB 3.27Å; L400-K404 WeakPolarHBondContact O-CB 3.11Å; L400-K404 PolarHBondContact O-N 3.47Å; Q401-K404 WeakPolarHBondContact O-CB 3.39Å; Q401-K404 PolarHBondContact O-N 2.88Å; A402-K404 PolarHBondContact O-N 3.3Å; K404-E406 VanDerWaalsContact C-N 3.33Å; K404-L407 PolarHBondContact O-N 2.82Å; K404-E408 WeakPolarHBondContact CE-OE1 3.48Å; K404-E408 IonicContact NZ-OE1 2.9Å; K404-E408 WeakPolarHBondContact O-CG 3.33Å; K404-E408 PolarHBondContact O-N 2.83Å
405L91.9Very high89.1Confident100 Ų100105.9 Ų105.952%0.52452%0.517SS..Hα-helixtrans-66.1-35.5177.8-72.9174.1000112Q401 A402 E408 L409Q401-L405 WeakPolarHBondContact O-CG 3.41Å; Q401-L405 PolarHBondContact O-N 2.84Å; A402-L405 PolarHBondContact O-N 3.41Å; A402-L405 VanDerWaalsContact O-N 3.1Å; L405-E408 PolarHBondContact O-N 3.26Å; L405-L409 VanDerWaalsContact O-CB 3.26Å; L405-L409 WeakPolarHBondContact O-CB 3.49Å; L405-L409 PolarHBondContact O-N 2.99Å
406E92.8Very high90.1Very high136 Ų136103.3 Ų103.364%0.63651%0.512SS*.Hα-helixtrans-64.4-42.5173.1-74.4177.1174.900111.5A402 E403 K404 L409 G410A402-E406 WeakPolarHBondContact O-CG 3.46Å; A402-E406 PolarHBondContact O-N 3.02Å; E403-E406 PolarHBondContact O-N 3Å; K404-E406 VanDerWaalsContact C-N 3.33Å; E406-L409 PolarHBondContact O-N 3.27Å; E406-G410 PolarHBondContact O-N 2.92Å
407L91.2Very high90.8Very high118 Ų118103.9 Ų103.962%0.61851%0.514SS*.Hα-helixtrans-62.9-43.8172.8-73.8171.7000111.8E403 K404 G410 Q411E403-L407 WeakPolarHBondContact O-CB 3.28Å; E403-L407 VanDerWaalsContact O-CG 3.3Å; E403-L407 WeakPolarHBondContact O-CG 3.49Å; E403-L407 PolarHBondContact O-N 3.45Å; K404-L407 PolarHBondContact O-N 2.82Å; L407-G410 PolarHBondContact O-N 2.8Å; L407-Q411 WeakPolarHBondContact O-CB 3.36Å; L407-Q411 VanDerWaalsContact O-CG 3.26Å; L407-Q411 WeakPolarHBondContact O-CG 3.33Å; L407-Q411 PolarHBondContact O-N 3.32Å
408E93.2Very high91.5Very high79 Ų7998.2 Ų98.237%0.36950%0.502SS..Hα-helixtrans-63.1-40.6175-74176-171.600111.5K404 L405 Q411 K412K404-E408 WeakPolarHBondContact CE-OE1 3.48Å; K404-E408 IonicContact NZ-OE1 2.9Å; K404-E408 WeakPolarHBondContact O-CG 3.33Å; K404-E408 PolarHBondContact O-N 2.83Å; L405-E408 PolarHBondContact O-N 3.26Å; E408-Q411 PolarHBondContact O-N 2.7Å; E408-K412 WeakPolarHBondContact O-CB 3.42Å; E408-K412 WeakPolarHBondContact O-CG 3.45Å; E408-K412 PolarHBondContact O-N 2.88Å
409L91Very high92.1Very high123 Ų12398.5 Ų98.564%0.64450%0.5SS*.Hα-helixtrans-66.1-39.6176.3-163.8106.3000111.6L405 E406 K412 S413L405-L409 VanDerWaalsContact O-CB 3.26Å; L405-L409 WeakPolarHBondContact O-CB 3.49Å; L405-L409 PolarHBondContact O-N 2.99Å; E406-L409 PolarHBondContact O-N 3.27Å; L409-K412 PolarHBondContact O-N 2.69Å; L409-S413 WeakPolarHBondContact O-CB 3.45Å; L409-S413 PolarHBondContact O-N 3.26Å; L409-S413 PolarHBondContact O-OG 3.4Å
410G92.8Very high92.5Very high32 Ų3299.7 Ų99.733%0.3351%0.505SS..Hα-helixtrans-62.3-45.9172.700000111.7E406 L407 K412 S413 I414E406-G410 PolarHBondContact O-N 2.92Å; L407-G410 PolarHBondContact O-N 2.8Å; G410-K412 PolarHBondContact O-N 2.95Å; G410-S413 WeakPolarHBondContact O-CB 3.44Å; G410-S413 PolarHBondContact O-N 2.79Å; G410-I414 WeakPolarHBondContact O-CG1 3.4Å; G410-I414 PolarHBondContact O-N 3.17Å
411Q93.9Very high92.9Very high114 Ų11498.8 Ų98.853%0.53350%0.504SS..Hα-helixtrans-60.5-44.9174.3-73.2170.78.700111.7L407 E408 S413 I414 E415L407-Q411 WeakPolarHBondContact O-CB 3.36Å; L407-Q411 VanDerWaalsContact O-CG 3.26Å; L407-Q411 WeakPolarHBondContact O-CG 3.33Å; L407-Q411 PolarHBondContact O-N 3.32Å; E408-Q411 PolarHBondContact O-N 2.7Å; Q411-S413 VanDerWaalsContact C-N 3.32Å; Q411-S413 PolarHBondContact O-N 2.74Å; Q411-I414 PolarHBondContact O-N 2.78Å; Q411-E415 WeakPolarHBondContact O-CG 3.44Å; Q411-E415 PolarHBondContact O-N 2.93Å
412K94.2Very high93.1Very high114 Ų114101.1 Ų101.150%0.49651%0.508SS..Hα-helixtrans-63.3-37.5176.2-69.6-73.6160.9-151.30112.1E408 L409 G410 I414 E415 I416E408-K412 WeakPolarHBondContact O-CB 3.42Å; E408-K412 WeakPolarHBondContact O-CG 3.45Å; E408-K412 PolarHBondContact O-N 2.88Å; L409-K412 PolarHBondContact O-N 2.69Å; G410-K412 PolarHBondContact O-N 2.95Å; K412-I414 VanDerWaalsContact C-N 3.35Å; K412-E415 WeakPolarHBondContact CD-OE2 3.39Å; K412-E415 IonicContact NZ-OE1 3.55Å; K412-E415 IonicContact NZ-OE2 3.32Å; K412-E415 PolarHBondContact NZ-OE2 2.9Å; K412-E415 PolarHBondContact O-N 3.29Å; K412-I416 WeakPolarHBondContact O-CB 3.38Å; K412-I416 VanDerWaalsContact O-CG1 3.27Å; K412-I416 WeakPolarHBondContact O-CG1 3.4Å; K412-I416 PolarHBondContact O-N 3.25Å
413S95Very high93.6Very high57 Ų57103.4 Ų103.440%0.39951%0.514SS..Hα-helixtrans-63.2-41.4175-60.70000111.7L409 G410 Q411 I416 Q417L409-S413 WeakPolarHBondContact O-CB 3.45Å; L409-S413 PolarHBondContact O-N 3.26Å; L409-S413 PolarHBondContact O-OG 3.4Å; G410-S413 WeakPolarHBondContact O-CB 3.44Å; G410-S413 PolarHBondContact O-N 2.79Å; Q411-S413 VanDerWaalsContact C-N 3.32Å; Q411-S413 PolarHBondContact O-N 2.74Å; S413-I416 PolarHBondContact O-N 3.01Å; S413-Q417 WeakPolarHBondContact O-CG 3.5Å; S413-Q417 PolarHBondContact O-N 3.36Å
414I93.6Very high93.9Very high113 Ų113103.2 Ų103.258%0.57952%0.521SS*.Hα-helixtrans-67.4-42.2174.9-63.8163.9000110.8G410 Q411 K412 I416 Q417 A418G410-I414 WeakPolarHBondContact O-CG1 3.4Å; G410-I414 PolarHBondContact O-N 3.17Å; Q411-I414 PolarHBondContact O-N 2.78Å; K412-I414 VanDerWaalsContact C-N 3.35Å; I414-I416 PolarHBondContact O-N 3.41Å; I414-Q417 PolarHBondContact O-N 3.06Å; I414-A418 WeakPolarHBondContact O-CB 3.32Å; I414-A418 PolarHBondContact O-N 2.89Å
415E94.8Very high94Very high97 Ų97101 Ų10145%0.45352%0.517SS..Hα-helixtrans-59.8-43.5175.3-76.8176.5-172.600112Q411 K412 A418 L419Q411-E415 WeakPolarHBondContact O-CG 3.44Å; Q411-E415 PolarHBondContact O-N 2.93Å; K412-E415 WeakPolarHBondContact CD-OE2 3.39Å; K412-E415 IonicContact NZ-OE1 3.55Å; K412-E415 IonicContact NZ-OE2 3.32Å; K412-E415 PolarHBondContact NZ-OE2 2.9Å; K412-E415 PolarHBondContact O-N 3.29Å; E415-A418 PolarHBondContact O-N 3.49Å; E415-L419 WeakPolarHBondContact O-CG 3.49Å; E415-L419 PolarHBondContact O-N 3.03Å
416I94.3Very high94.1Very high91 Ų9198.7 Ų98.747%0.46751%0.513SS..Hα-helixtrans-62.5-45.8176.3-71.9166.6000110.3K412 S413 I414 A418 L419 Y420K412-I416 WeakPolarHBondContact O-CB 3.38Å; K412-I416 VanDerWaalsContact O-CG1 3.27Å; K412-I416 WeakPolarHBondContact O-CG1 3.4Å; K412-I416 PolarHBondContact O-N 3.25Å; S413-I416 PolarHBondContact O-N 3.01Å; I414-I416 PolarHBondContact O-N 3.41Å; I416-A418 VanDerWaalsContact C-N 3.33Å; I416-A418 PolarHBondContact O-N 2.94Å; I416-L419 PolarHBondContact O-N 3.13Å; I416-Y420 HydrophobicContact CG2-CD2 3.73Å; I416-Y420 HydrophobicContact CG2-CE2 3.74Å; I416-Y420 WeakPolarHBondContact O-CD2 3.15Å; I416-Y420 PolarHBondContact O-N 3.24Å
417Q94.4Very high94.2Very high132 Ų13297.8 Ų97.862%0.61751%0.509SS*.Hα-helixtrans-60-42.7175.6-74.4178.4-0.900112S413 I414 L419 Y420 T421S413-Q417 WeakPolarHBondContact O-CG 3.5Å; S413-Q417 PolarHBondContact O-N 3.36Å; I414-Q417 PolarHBondContact O-N 3.06Å; Q417-L419 VanDerWaalsContact C-N 3.34Å; Q417-L419 PolarHBondContact O-N 3.23Å; Q417-Y420 WeakPolarHBondContact O-CB 3.43Å; Q417-Y420 PolarHBondContact O-N 3.13Å; Q417-T421 PolarHBondContact O-N 3.22Å; Q417-T421 PolarHBondContact O-OG1 3.43Å; Q417-T421 VanDerWaalsContact O-OG1 3.12Å
418A94.8Very high94.4Very high42 Ų4298.1 Ų98.135%0.34751%0.507SS..Hα-helixtrans-62.9-37.9175.900000112.5I414 E415 I416 T421 R422I414-A418 WeakPolarHBondContact O-CB 3.32Å; I414-A418 PolarHBondContact O-N 2.89Å; E415-A418 PolarHBondContact O-N 3.49Å; I416-A418 VanDerWaalsContact C-N 3.33Å; I416-A418 PolarHBondContact O-N 2.94Å; A418-T421 PolarHBondContact O-N 2.9Å; A418-R422 WeakPolarHBondContact O-CG 3.29Å; A418-R422 PolarHBondContact O-N 3.08Å
419L95.3Very high94.3Very high106 Ų10696.8 Ų96.856%0.55551%0.506SS*.Hα-helixtrans-67.1-39.5173.4-73174.5000112.2E415 I416 Q417 R422 L423E415-L419 WeakPolarHBondContact O-CG 3.49Å; E415-L419 PolarHBondContact O-N 3.03Å; I416-L419 PolarHBondContact O-N 3.13Å; Q417-L419 VanDerWaalsContact C-N 3.34Å; Q417-L419 PolarHBondContact O-N 3.23Å; L419-R422 PolarHBondContact O-N 2.82Å; L419-L423 WeakPolarHBondContact O-CB 3.45Å; L419-L423 PolarHBondContact O-N 3.3Å
420Y95.4Very high94.5Very high163 Ų16393.6 Ų93.664%0.63950%0.498SS*.Hα-helixtrans-61.3-44.2173.1-92.9-75000111.9I416 Q417 L423 S424I416-Y420 HydrophobicContact CG2-CD2 3.73Å; I416-Y420 HydrophobicContact CG2-CE2 3.74Å; I416-Y420 WeakPolarHBondContact O-CD2 3.15Å; I416-Y420 PolarHBondContact O-N 3.24Å; Q417-Y420 WeakPolarHBondContact O-CB 3.43Å; Q417-Y420 PolarHBondContact O-N 3.13Å; Y420-L423 PolarHBondContact O-N 3.21Å; Y420-S424 WeakPolarHBondContact O-CB 3.42Å; Y420-S424 PolarHBondContact O-N 3.35Å
421T93.5Very high94.6Very high92 Ų9294.7 Ų94.756%0.56450%0.5SS*.Hα-helixtrans-62.3-43.7175-52.50000111.2Q417 A418 L423 S424 T425Q417-T421 PolarHBondContact O-N 3.22Å; Q417-T421 PolarHBondContact O-OG1 3.43Å; Q417-T421 VanDerWaalsContact O-OG1 3.12Å; A418-T421 PolarHBondContact O-N 2.9Å; T421-L423 PolarHBondContact O-N 3.02Å; T421-S424 PolarHBondContact O-N 2.86Å; T421-T425 WeakPolarHBondContact O-CG2 3.5Å; T421-T425 PolarHBondContact O-N 3.45Å; T421-T425 PolarHBondContact O-OG1 3.43Å
422R95.7Very high94.6Very high172 Ų17292.2 Ų92.265%0.64949%0.491SS*.Hα-helixtrans-62-43176.3-76175.3-179.4165.41.7112.6A418 L419 T425 A426A418-R422 WeakPolarHBondContact O-CG 3.29Å; A418-R422 PolarHBondContact O-N 3.08Å; L419-R422 PolarHBondContact O-N 2.82Å; R422-T425 WeakPolarHBondContact CA-OG1 3.42Å; R422-T425 PolarHBondContact O-N 3.16Å; R422-T425 PolarHBondContact O-OG1 3.1Å; R422-A426 WeakPolarHBondContact O-CB 3.27Å; R422-A426 PolarHBondContact O-N 2.89Å
423L95.7Very high94.6Very high93 Ų9393.8 Ų93.849%0.48750%0.498SS..Hα-helixtrans-61.6-47.8175.8-178.566.3000110.6L419 Y420 T421 T425 A426 E427L419-L423 WeakPolarHBondContact O-CB 3.45Å; L419-L423 PolarHBondContact O-N 3.3Å; Y420-L423 PolarHBondContact O-N 3.21Å; T421-L423 PolarHBondContact O-N 3.02Å; L423-T425 VanDerWaalsContact C-N 3.33Å; L423-T425 PolarHBondContact O-N 2.94Å; L423-A426 PolarHBondContact O-N 3.15Å; L423-A426 VanDerWaalsContact O-N 3.1Å; L423-E427 HydrophobicContact CD1-CG 4.44Å; L423-E427 HydrophobicContact CG-CG 4.47Å; L423-E427 WeakPolarHBondContact O-CG 3.39Å; L423-E427 PolarHBondContact O-N 3.21Å
424S96.1Very high94.7Very high69 Ų6997.3 Ų97.348%0.48351%0.506SS..Hα-helixtrans-57.7-44.2176.9-172.90000111.9Y420 T421 A426 E427 E428Y420-S424 WeakPolarHBondContact O-CB 3.42Å; Y420-S424 PolarHBondContact O-N 3.35Å; T421-S424 PolarHBondContact O-N 2.86Å; S424-A426 VanDerWaalsContact C-N 3.33Å; S424-A426 PolarHBondContact O-N 3.46Å; S424-E427 PolarHBondContact O-N 2.88Å; S424-E428 WeakPolarHBondContact O-CB 3.35Å; S424-E428 PolarHBondContact O-N 3.46Å
425T94.2Very high94.8Very high78 Ų7897 Ų9748%0.47950%0.501SS..Hα-helixtrans-67.3-33.7177.254.80000112.7T421 R422 L423 S429T421-T425 WeakPolarHBondContact O-CG2 3.5Å; T421-T425 PolarHBondContact O-N 3.45Å; T421-T425 PolarHBondContact O-OG1 3.43Å; R422-T425 WeakPolarHBondContact CA-OG1 3.42Å; R422-T425 PolarHBondContact O-N 3.16Å; R422-T425 PolarHBondContact O-OG1 3.1Å; L423-T425 VanDerWaalsContact C-N 3.33Å; L423-T425 PolarHBondContact O-N 2.94Å; T425-S429 PolarHBondContact O-N 3.47Å
426A93.4Very high94.9Very high51 Ų5197.7 Ų97.742%0.42150%0.503SS..Hα-helixtrans-70.6-41.4176.700000111.5R422 L423 S424 S429 A430R422-A426 WeakPolarHBondContact O-CB 3.27Å; R422-A426 PolarHBondContact O-N 2.89Å; L423-A426 PolarHBondContact O-N 3.15Å; L423-A426 VanDerWaalsContact O-N 3.1Å; S424-A426 VanDerWaalsContact C-N 3.33Å; S424-A426 PolarHBondContact O-N 3.46Å; A426-S429 PolarHBondContact O-N 2.92Å; A426-S429 PolarHBondContact O-OG 2.95Å; A426-A430 WeakPolarHBondContact O-CB 3.47Å; A426-A430 PolarHBondContact O-N 3.13Å
427E95.5Very high94.9Very high118 Ų11898 Ų9855%0.55151%0.505SS*.Hα-helixtrans-62.8-41.6174.8-73.1177.4166.100112.1L423 S424 A430 S431L423-E427 HydrophobicContact CD1-CG 4.44Å; L423-E427 HydrophobicContact CG-CG 4.47Å; L423-E427 WeakPolarHBondContact O-CG 3.39Å; L423-E427 PolarHBondContact O-N 3.21Å; S424-E427 PolarHBondContact O-N 2.88Å; E427-A430 PolarHBondContact O-N 3.45Å; E427-S431 WeakPolarHBondContact O-CB 3.48Å; E427-S431 PolarHBondContact O-N 3.37Å
428E95.1Very high95Very high125 Ų12596.7 Ų96.758%0.58450%0.499SS*.Hα-helixtrans-62.1-48.2174.4-172.9169.3-159.700111.1S424 A430 S431 D432S424-E428 WeakPolarHBondContact O-CB 3.35Å; S424-E428 PolarHBondContact O-N 3.46Å; E428-A430 VanDerWaalsContact C-N 3.31Å; E428-A430 PolarHBondContact O-N 3.24Å; E428-S431 WeakPolarHBondContact O-CB 3.44Å; E428-S431 PolarHBondContact O-N 2.93Å; E428-S431 VanDerWaalsContact O-N 3.14Å; E428-D432 PolarHBondContact O-N 3.31Å
429S92.7Very high95Very high51 Ų5199.8 Ų99.836%0.35751%0.509SS..Hα-helixtrans-60.6-38.3175.975.50000112.8T425 A426 D432 F433T425-S429 PolarHBondContact O-N 3.47Å; A426-S429 PolarHBondContact O-N 2.92Å; A426-S429 PolarHBondContact O-OG 2.95Å; S429-D432 PolarHBondContact O-N 3.01Å; S429-F433 WeakPolarHBondContact O-CD2 3.27Å; S429-F433 WeakPolarHBondContact O-CG 3.48Å; S429-F433 PolarHBondContact O-N 2.97Å
430A93.9Very high95.1Very high56 Ų5699.3 Ų99.346%0.46351%0.51SS..Hα-helixtrans-67.3-37176.400000112.3A426 E427 E428 K434A426-A430 WeakPolarHBondContact O-CB 3.47Å; A426-A430 PolarHBondContact O-N 3.13Å; E427-A430 PolarHBondContact O-N 3.45Å; E428-A430 VanDerWaalsContact C-N 3.31Å; E428-A430 PolarHBondContact O-N 3.24Å; A430-K434 WeakPolarHBondContact O-CB 3.34Å; A430-K434 PolarHBondContact O-N 2.98Å
431S94.8Very high95.2Very high55 Ų5597.7 Ų97.739%0.38551%0.507SS..Hα-helixtrans-62.7-42.9172.4-1750000111.3E427 E428 K434 K435E427-S431 WeakPolarHBondContact O-CB 3.48Å; E427-S431 PolarHBondContact O-N 3.37Å; E428-S431 WeakPolarHBondContact O-CB 3.44Å; E428-S431 PolarHBondContact O-N 2.93Å; E428-S431 VanDerWaalsContact O-N 3.14Å; S431-K434 WeakPolarHBondContact O-CB 3.44Å; S431-K434 PolarHBondContact O-N 2.99Å; S431-K435 WeakPolarHBondContact O-CG 3.48Å; S431-K435 PolarHBondContact O-N 3.38Å
432D94.2Very high95.2Very high61 Ų6199 Ų9933%0.32651%0.506SS..Hα-helixtrans-68.4-43178-69.3-20000112.2E428 S429 K434 K435 H436E428-D432 PolarHBondContact O-N 3.31Å; S429-D432 PolarHBondContact O-N 3.01Å; D432-K434 PolarHBondContact O-N 2.88Å; D432-K435 PolarHBondContact O-N 3.02Å; D432-K435 VanDerWaalsContact O-N 3.17Å; D432-K435 IonicContact OD1-NZ 3.69Å; D432-K435 PolarHBondContact OD1-NZ 2.98Å; D432-H436 PolarHBondContact O-CD2 2.95Å; D432-H436 PolarHBondContact O-N 3.38Å
433F94.4Very high95.2Very high148 Ų14893.3 Ų93.365%0.64949%0.493SS*.Hα-helixtrans-57.8-37171.5-71.4-54.5000112.5S429 H436 L437S429-F433 WeakPolarHBondContact O-CD2 3.27Å; S429-F433 WeakPolarHBondContact O-CG 3.48Å; S429-F433 PolarHBondContact O-N 2.97Å; F433-H436 PolarHBondContact O-N 2.91Å; F433-L437 WeakPolarHBondContact O-CB 3.45Å; F433-L437 PolarHBondContact O-N 3.5Å
434K96.3Very high95.1Very high131 Ų13192.9 Ų92.957%0.5749%0.491SS*.Hα-helixtrans-65.5-45.7175.3-174-177176-173.80111.9A430 S431 D432 H436 L437 E438A430-K434 WeakPolarHBondContact O-CB 3.34Å; A430-K434 PolarHBondContact O-N 2.98Å; S431-K434 WeakPolarHBondContact O-CB 3.44Å; S431-K434 PolarHBondContact O-N 2.99Å; D432-K434 PolarHBondContact O-N 2.88Å; K434-H436 VanDerWaalsContact C-N 3.34Å; K434-H436 PolarHBondContact O-N 2.99Å; K434-L437 WeakPolarHBondContact O-CB 3.09Å; K434-L437 PolarHBondContact O-N 3.48Å; K434-E438 WeakPolarHBondContact CE-OE1 3.47Å; K434-E438 WeakPolarHBondContact O-CG 3.45Å; K434-E438 PolarHBondContact O-N 2.9Å
435K97.2Very high95.1Very high107 Ų10791.5 Ų91.547%0.46548%0.484SS..Hα-helixtrans-60.5-43.8174.8-65.7170-160.6155.90111.2S431 D432 L437 E438 L439S431-K435 WeakPolarHBondContact O-CG 3.48Å; S431-K435 PolarHBondContact O-N 3.38Å; D432-K435 PolarHBondContact O-N 3.02Å; D432-K435 VanDerWaalsContact O-N 3.17Å; D432-K435 IonicContact OD1-NZ 3.69Å; D432-K435 PolarHBondContact OD1-NZ 2.98Å; K435-L437 VanDerWaalsContact C-N 3.33Å; K435-L437 PolarHBondContact O-N 3.2Å; K435-E438 PolarHBondContact O-N 3.19Å; K435-L439 WeakPolarHBondContact O-CG 3.42Å; K435-L439 PolarHBondContact O-N 3Å
436H95.8Very high95.2Very high111 Ų11191.2 Ų91.251%0.51448%0.48SS..Hα-helixtrans-61.2-40.7175.8-71.2-55.5000112.1D432 F433 K434 L439 V440D432-H436 PolarHBondContact O-CD2 2.95Å; D432-H436 PolarHBondContact O-N 3.38Å; F433-H436 PolarHBondContact O-N 2.91Å; K434-H436 VanDerWaalsContact C-N 3.34Å; K434-H436 PolarHBondContact O-N 2.99Å; H436-L439 PolarHBondContact O-N 3.06Å; H436-V440 VanDerWaalsContact O-CG2 3.3Å; H436-V440 WeakPolarHBondContact O-CG2 3.48Å; H436-V440 PolarHBondContact O-N 3.32Å
437L95.2Very high95.2Very high96 Ų9694.4 Ų94.450%0.50348%0.484SS..Hα-helixtrans-63.9-40.1175.4-17666.5000112.1F433 K434 K435 V440 K441F433-L437 WeakPolarHBondContact O-CB 3.45Å; F433-L437 PolarHBondContact O-N 3.5Å; K434-L437 WeakPolarHBondContact O-CB 3.09Å; K434-L437 PolarHBondContact O-N 3.48Å; K435-L437 VanDerWaalsContact C-N 3.33Å; K435-L437 PolarHBondContact O-N 3.2Å; L437-V440 PolarHBondContact O-N 3.28Å; L437-K441 HydrophobicContact CG-CD 4.48Å; L437-K441 WeakPolarHBondContact O-CB 3.25Å; L437-K441 VanDerWaalsContact O-CG 3.28Å; L437-K441 WeakPolarHBondContact O-CG 3.39Å; L437-K441 PolarHBondContact O-N 3.08Å
438E95.9Very high95.2Very high106 Ų10693.8 Ų93.850%0.49548%0.481SS..Hα-helixtrans-64-45175-73.4171.5-17100111.6K434 K435 V440 K441 E442K434-E438 WeakPolarHBondContact CE-OE1 3.47Å; K434-E438 WeakPolarHBondContact O-CG 3.45Å; K434-E438 PolarHBondContact O-N 2.9Å; K435-E438 PolarHBondContact O-N 3.19Å; E438-V440 VanDerWaalsContact C-N 3.35Å; E438-V440 PolarHBondContact O-N 3.36Å; E438-K441 WeakPolarHBondContact O-CB 3.28Å; E438-K441 PolarHBondContact O-N 3.33Å; E438-E442 PolarHBondContact O-N 3.04Å
439L94.9Very high95.2Very high106 Ų10693.5 Ų93.556%0.55548%0.48SS*.Hα-helixtrans-61-40.9174.5-72.7172.6000112.5K435 H436 E442 S443K435-L439 WeakPolarHBondContact O-CG 3.42Å; K435-L439 PolarHBondContact O-N 3Å; H436-L439 PolarHBondContact O-N 3.06Å; L439-E442 PolarHBondContact O-N 2.97Å; L439-S443 VanDerWaalsContact O-CB 3.32Å; L439-S443 WeakPolarHBondContact O-CB 3.48Å; L439-S443 PolarHBondContact O-N 3.3Å
440V96.9Very high95.4Very high96 Ų9696.9 Ų96.958%0.58249%0.49SS*.Hα-helixtrans-66.7-39.3176169.90000111.1H436 L437 E438 S443 N444H436-V440 VanDerWaalsContact O-CG2 3.3Å; H436-V440 WeakPolarHBondContact O-CG2 3.48Å; H436-V440 PolarHBondContact O-N 3.32Å; L437-V440 PolarHBondContact O-N 3.28Å; E438-V440 VanDerWaalsContact C-N 3.35Å; E438-V440 PolarHBondContact O-N 3.36Å; V440-S443 PolarHBondContact O-N 2.95Å; V440-N444 WeakPolarHBondContact O-CB 3.3Å; V440-N444 PolarHBondContact O-N 3.49Å
441K97Very high95.4Very high130 Ų13099.6 Ų99.657%0.56550%0.496SS*.Hα-helixtrans-63.5-44.1175-76.8173177.8179.70111.9L437 E438 N444 A445L437-K441 HydrophobicContact CG-CD 4.48Å; L437-K441 WeakPolarHBondContact O-CB 3.25Å; L437-K441 VanDerWaalsContact O-CG 3.28Å; L437-K441 WeakPolarHBondContact O-CG 3.39Å; L437-K441 PolarHBondContact O-N 3.08Å; E438-K441 WeakPolarHBondContact O-CB 3.28Å; E438-K441 PolarHBondContact O-N 3.33Å; K441-N444 PolarHBondContact O-N 3.32Å; K441-A445 WeakPolarHBondContact O-CB 3.49Å; K441-A445 PolarHBondContact O-N 2.74Å
442E94.9Very high95.4Very high118 Ų118102.3 Ų102.355%0.55151%0.506SS*.Hα-helixtrans-64.1-43.1175.6-172.3177.8-175.300111.2E438 L439 N444 A445 N446E438-E442 PolarHBondContact O-N 3.04Å; L439-E442 PolarHBondContact O-N 2.97Å; E442-N444 VanDerWaalsContact C-N 3.3Å; E442-N444 PolarHBondContact O-N 2.91Å; E442-A445 PolarHBondContact O-N 3.3Å; E442-N446 WeakPolarHBondContact O-CB 3.4Å; E442-N446 VanDerWaalsContact O-CG 3.31Å; E442-N446 PolarHBondContact O-N 3.46Å; E442-N446 PolarHBondContact O-ND2 3.47Å
443S94.7Very high95.3Very high54 Ų54105 Ų10538%0.37852%0.52SS..Hα-helixtrans-58.4-41.1172.9-173.80000112.1L439 V440 K447L439-S443 VanDerWaalsContact O-CB 3.32Å; L439-S443 WeakPolarHBondContact O-CB 3.48Å; L439-S443 PolarHBondContact O-N 3.3Å; V440-S443 PolarHBondContact O-N 2.95Å; S443-K447 WeakPolarHBondContact O-CG 3.46Å; S443-K447 PolarHBondContact O-N 2.92Å
444N94.3Very high95.4Very high83 Ų83102.6 Ų102.644%0.44451%0.514SS..Hα-helixtrans-68.8-42.7177.4-16661.6000112V440 K441 E442 N446 K447 E448V440-N444 WeakPolarHBondContact O-CB 3.3Å; V440-N444 PolarHBondContact O-N 3.49Å; K441-N444 PolarHBondContact O-N 3.32Å; E442-N444 VanDerWaalsContact C-N 3.3Å; E442-N444 PolarHBondContact O-N 2.91Å; N444-N446 VanDerWaalsContact C-N 3.32Å; N444-N446 PolarHBondContact O-N 3.34Å; N444-K447 PolarHBondContact O-N 2.97Å; N444-E448 PolarHBondContact ND2-OE1 3.27Å; N444-E448 WeakPolarHBondContact O-CG 3.42Å; N444-E448 PolarHBondContact O-N 2.83Å
445A95.8Very high95.3Very high40 Ų40100.6 Ų100.633%0.33151%0.506SS..Hα-helixtrans-60.6-40.3175.300000112K441 E442 E448 Q449K441-A445 WeakPolarHBondContact O-CB 3.49Å; K441-A445 PolarHBondContact O-N 2.74Å; E442-A445 PolarHBondContact O-N 3.3Å; A445-E448 PolarHBondContact O-N 3.39Å; A445-Q449 WeakPolarHBondContact O-CG 3.42Å; A445-Q449 PolarHBondContact O-N 3.07Å
446N95.8Very high95.1Very high72 Ų7298.2 Ų98.239%0.38551%0.506SS..Hα-helixtrans-65.1-40.2174.9-72.5-29.4000112.1E442 N444 Q449 Q450E442-N446 WeakPolarHBondContact O-CB 3.4Å; E442-N446 VanDerWaalsContact O-CG 3.31Å; E442-N446 PolarHBondContact O-N 3.46Å; E442-N446 PolarHBondContact O-ND2 3.47Å; N444-N446 VanDerWaalsContact C-N 3.32Å; N444-N446 PolarHBondContact O-N 3.34Å; N446-Q449 PolarHBondContact O-N 3.29Å; N446-Q450 WeakPolarHBondContact O-CG 3.41Å; N446-Q450 PolarHBondContact O-N 2.91Å
447K94.8Very high95.1Very high119 Ų11997.6 Ų97.652%0.51751%0.507SS..Hα-helixtrans-65.2-39174.6-73.2173.2-175.1172.60112.1S443 N444 Q450 L451S443-K447 WeakPolarHBondContact O-CG 3.46Å; S443-K447 PolarHBondContact O-N 2.92Å; N444-K447 PolarHBondContact O-N 2.97Å; K447-Q450 PolarHBondContact O-N 3.49Å; K447-L451 WeakPolarHBondContact O-CG 3.45Å; K447-L451 PolarHBondContact O-N 3.03Å
448E95.3Very high95.1Very high104 Ų10496.6 Ų96.649%0.48650%0.501SS..Hα-helixtrans-63.8-41.4174.6-75.2172.3-170.800111.9N444 A445 Q450 L451 N452N444-E448 PolarHBondContact ND2-OE1 3.27Å; N444-E448 WeakPolarHBondContact O-CG 3.42Å; N444-E448 PolarHBondContact O-N 2.83Å; A445-E448 PolarHBondContact O-N 3.39Å; E448-Q450 PolarHBondContact O-N 3.3Å; E448-L451 PolarHBondContact O-N 3.21Å; E448-N452 VanDerWaalsContact O-CG 3.22Å; E448-N452 PolarHBondContact O-N 3.22Å; E448-N452 PolarHBondContact O-ND2 3.29Å
449Q95Very high95Very high119 Ų11995 Ų9556%0.55650%0.496SS*.Hα-helixtrans-61.9-41.9173.2-71.3176.82.300112.2A445 N446 N452 L453A445-Q449 WeakPolarHBondContact O-CG 3.42Å; A445-Q449 PolarHBondContact O-N 3.07Å; N446-Q449 PolarHBondContact O-N 3.29Å; Q449-N452 PolarHBondContact O-N 3.15Å; Q449-L453 WeakPolarHBondContact O-CG 3.5Å; Q449-L453 PolarHBondContact O-N 3.01Å
450Q95.8Very high95Very high122 Ų12292.4 Ų92.457%0.5749%0.49SS*.Hα-helixtrans-62.5-43.1174.6-71.8176.36.700111.9N446 K447 E448 N452 L453 L454N446-Q450 WeakPolarHBondContact O-CG 3.41Å; N446-Q450 PolarHBondContact O-N 2.91Å; K447-Q450 PolarHBondContact O-N 3.49Å; E448-Q450 PolarHBondContact O-N 3.3Å; Q450-N452 VanDerWaalsContact C-N 3.32Å; Q450-N452 PolarHBondContact O-N 3.04Å; Q450-L453 PolarHBondContact O-N 3.4Å; Q450-L454 WeakPolarHBondContact O-CG 3.41Å; Q450-L454 PolarHBondContact O-N 3.32Å
451L94.9Very high94.8Very high113 Ų11393.1 Ų93.159%0.59249%0.49SS*.Hα-helixtrans-61.9-39.4175.1-74171.9000111.9K447 E448 L454 Q455K447-L451 WeakPolarHBondContact O-CG 3.45Å; K447-L451 PolarHBondContact O-N 3.03Å; E448-L451 PolarHBondContact O-N 3.21Å; L451-L454 PolarHBondContact O-N 3.4Å; L451-Q455 VanDerWaalsContact O-CB 3.29Å; L451-Q455 WeakPolarHBondContact O-CB 3.31Å; L451-Q455 PolarHBondContact O-N 3.16Å
452N94.2Very high94.7Very high112 Ų11293.6 Ų93.660%0.59949%0.488SS*.Hα-helixtrans-66-39.7176.7-70.5-28.7000112.5E448 Q449 Q450 Q455 A456E448-N452 VanDerWaalsContact O-CG 3.22Å; E448-N452 PolarHBondContact O-N 3.22Å; E448-N452 PolarHBondContact O-ND2 3.29Å; Q449-N452 PolarHBondContact O-N 3.15Å; Q450-N452 VanDerWaalsContact C-N 3.32Å; Q450-N452 PolarHBondContact O-N 3.04Å; N452-Q455 PolarHBondContact O-N 3.32Å; N452-A456 WeakPolarHBondContact O-CB 3.38Å; N452-A456 PolarHBondContact O-N 2.89Å
453L92.5Very high94.6Very high117 Ų11789.6 Ų89.661%0.61348%0.479SS*.Hα-helixtrans-64.5-45.5174.2-72.3171.5000111.3Q449 Q450 Q455 A456 D457Q449-L453 WeakPolarHBondContact O-CG 3.5Å; Q449-L453 PolarHBondContact O-N 3.01Å; Q450-L453 PolarHBondContact O-N 3.4Å; L453-Q455 VanDerWaalsContact C-N 3.31Å; L453-Q455 PolarHBondContact O-N 3.47Å; L453-A456 PolarHBondContact O-N 3.4Å; L453-D457 PolarHBondContact O-N 3.41Å
454L95.2Very high94.6Very high99 Ų9993.8 Ų93.852%0.51849%0.49SS..Hα-helixtrans-63.1-37.4175.8-69.9173.7000112.2Q450 L451 D457 I458Q450-L454 WeakPolarHBondContact O-CG 3.41Å; Q450-L454 PolarHBondContact O-N 3.32Å; L451-L454 PolarHBondContact O-N 3.4Å; L454-D457 PolarHBondContact O-N 3.02Å; L454-I458 VanDerWaalsContact O-CG1 3.25Å; L454-I458 WeakPolarHBondContact O-CG1 3.32Å; L454-I458 PolarHBondContact O-N 3.17Å
455Q94.5Very high94.5Very high89 Ų8995.8 Ų95.842%0.41650%0.5SS..Hα-helixtrans-63.3-44.2174.6-174.959.243.100111.1L451 N452 L453 D457 I458 D459L451-Q455 VanDerWaalsContact O-CB 3.29Å; L451-Q455 WeakPolarHBondContact O-CB 3.31Å; L451-Q455 PolarHBondContact O-N 3.16Å; N452-Q455 PolarHBondContact O-N 3.32Å; L453-Q455 VanDerWaalsContact C-N 3.31Å; L453-Q455 PolarHBondContact O-N 3.47Å; Q455-D457 PolarHBondContact O-N 3.02Å; Q455-I458 PolarHBondContact O-N 3.44Å; Q455-D459 PolarHBondContact NE2-OD1 3.48Å; Q455-D459 PolarHBondContact NE2-OD2 2.9Å; Q455-D459 PolarHBondContact O-N 3.34Å
456A94.5Very high94.3Very high56 Ų56100 Ų10046%0.46351%0.513SS..Hα-helixtrans-63-39.7174.800000112.4N452 L453 D459 A460N452-A456 WeakPolarHBondContact O-CB 3.38Å; N452-A456 PolarHBondContact O-N 2.89Å; L453-A456 PolarHBondContact O-N 3.4Å; A456-D459 PolarHBondContact O-N 3.37Å; A456-A460 WeakPolarHBondContact O-CB 3.32Å; A456-A460 PolarHBondContact O-N 3.47Å
457D94Very high94.2Very high99 Ų9998.6 Ų98.653%0.52951%0.511SS..Hα-helixtrans-64.5-41.3175-75.2-21.1000111.8L453 L454 Q455 A460 L461L453-D457 PolarHBondContact O-N 3.41Å; L454-D457 PolarHBondContact O-N 3.02Å; Q455-D457 PolarHBondContact O-N 3.02Å; D457-A460 PolarHBondContact O-N 2.99Å; D457-L461 WeakPolarHBondContact O-CB 3.29Å; D457-L461 VanDerWaalsContact O-CG 3.29Å; D457-L461 WeakPolarHBondContact O-CG 3.38Å; D457-L461 PolarHBondContact O-N 3.41Å
458I95.2Very high94.1Very high75 Ų7598.7 Ų98.739%0.38551%0.512SS..Hα-helixtrans-61.2-45.9174.6-72.1165.1000110.6L454 Q455 L461 R462L454-I458 VanDerWaalsContact O-CG1 3.25Å; L454-I458 WeakPolarHBondContact O-CG1 3.32Å; L454-I458 PolarHBondContact O-N 3.17Å; Q455-I458 PolarHBondContact O-N 3.44Å; I458-L461 PolarHBondContact O-N 3.35Å; I458-R462 WeakPolarHBondContact O-CG 3.4Å; I458-R462 PolarHBondContact O-N 3.36Å
459D94.5Very high93.9Very high73 Ų7398 Ų9839%0.3951%0.511SS..Hα-helixtrans-68.4-35.9-179.5-67-31.5000111.7Q455 A456 R462 G463Q455-D459 PolarHBondContact NE2-OD1 3.48Å; Q455-D459 PolarHBondContact NE2-OD2 2.9Å; Q455-D459 PolarHBondContact O-N 3.34Å; A456-D459 PolarHBondContact O-N 3.37Å; D459-R462 PolarHBondContact O-N 3.06Å; D459-R462 IonicContact OD1-NH1 3.13Å; D459-R462 PolarHBondContact OD1-NH1 2.84Å; D459-G463 PolarHBondContact O-N 3.27Å
460A94.7Very high93.9Very high51 Ų5198 Ų9842%0.42151%0.511SS..Hα-helixtrans-65.5-38.4171.700000112.7A456 D457 K464A456-A460 WeakPolarHBondContact O-CB 3.32Å; A456-A460 PolarHBondContact O-N 3.47Å; D457-A460 PolarHBondContact O-N 2.99Å; A460-K464 WeakPolarHBondContact O-CG 3.39Å; A460-K464 PolarHBondContact O-N 3.2Å; A460-K464 VanDerWaalsContact O-N 3.13Å
461L93.5Very high93.7Very high111 Ų11196.5 Ų96.558%0.58151%0.505SS*.Hα-helixtrans-68.4-37.6174.4-73.1174.4000111.9D457 I458 K464 L465D457-L461 WeakPolarHBondContact O-CB 3.29Å; D457-L461 VanDerWaalsContact O-CG 3.29Å; D457-L461 WeakPolarHBondContact O-CG 3.38Å; D457-L461 PolarHBondContact O-N 3.41Å; I458-L461 PolarHBondContact O-N 3.35Å; L461-K464 PolarHBondContact O-N 3.33Å; L461-L465 WeakPolarHBondContact O-CB 3.47Å; L461-L465 PolarHBondContact O-N 3.49Å
462R95.1Very high93.4Very high139 Ų13996.2 Ų96.253%0.52550%0.502SS..Hα-helixtrans-60.5-48.9173.4-75.4170.6173.6178.4-5.6111.7I458 D459 K464 L465 E466I458-R462 WeakPolarHBondContact O-CG 3.4Å; I458-R462 PolarHBondContact O-N 3.36Å; D459-R462 PolarHBondContact O-N 3.06Å; D459-R462 IonicContact OD1-NH1 3.13Å; D459-R462 PolarHBondContact OD1-NH1 2.84Å; R462-K464 VanDerWaalsContact C-N 3.3Å; R462-K464 PolarHBondContact O-N 2.94Å; R462-L465 WeakPolarHBondContact O-CB 3.5Å; R462-L465 PolarHBondContact O-N 3.3Å; R462-E466 WeakPolarHBondContact O-CG 3.28Å; R462-E466 PolarHBondContact O-N 3.17Å
463G92.7Very high93.4Very high34 Ų3495.3 Ų95.335%0.35150%0.498SS..Hα-helixtrans-61.1-36.7176.200000113.3D459 E466 A467D459-G463 PolarHBondContact O-N 3.27Å; G463-E466 PolarHBondContact O-N 2.97Å; G463-A467 WeakPolarHBondContact O-CB 3.49Å; G463-A467 PolarHBondContact O-N 3.49Å
464K94.8Very high93.5Very high143 Ų14395.3 Ų95.362%0.62250%0.495SS*.Hα-helixtrans-66.3-37.8173-74.2173.3177.6173.10112.5A460 L461 R462 K468A460-K464 WeakPolarHBondContact O-CG 3.39Å; A460-K464 PolarHBondContact O-N 3.2Å; A460-K464 VanDerWaalsContact O-N 3.13Å; L461-K464 PolarHBondContact O-N 3.33Å; R462-K464 VanDerWaalsContact C-N 3.3Å; R462-K464 PolarHBondContact O-N 2.94Å; K464-K468 WeakPolarHBondContact O-CB 3.42Å; K464-K468 VanDerWaalsContact O-CG 3.29Å; K464-K468 WeakPolarHBondContact O-CG 3.42Å; K464-K468 PolarHBondContact O-N 3.22Å
465L90.9Very high93.4Very high125 Ų12597.3 Ų97.365%0.65450%0.499SS*.Hα-helixtrans-68-41.8176.9-173.866.7000111.1L461 R462 K468 N469L461-L465 WeakPolarHBondContact O-CB 3.47Å; L461-L465 PolarHBondContact O-N 3.49Å; R462-L465 WeakPolarHBondContact O-CB 3.5Å; R462-L465 PolarHBondContact O-N 3.3Å; L465-K468 PolarHBondContact O-N 3.43Å; L465-N469 WeakPolarHBondContact O-CB 3.38Å; L465-N469 PolarHBondContact O-N 3.41Å
466E93.2Very high93.3Very high127 Ų12795.2 Ų95.259%0.59350%0.497SS*.Hα-helixtrans-60.2-49.1174.1-72.8167.5-173.100111.2R462 G463 K468 N469 E470R462-E466 WeakPolarHBondContact O-CG 3.28Å; R462-E466 PolarHBondContact O-N 3.17Å; G463-E466 PolarHBondContact O-N 2.97Å; E466-K468 VanDerWaalsContact C-N 3.25Å; E466-K468 PolarHBondContact O-N 3.29Å; E466-N469 WeakPolarHBondContact O-CA 3.33Å; E466-N469 WeakPolarHBondContact O-CB 3.42Å; E466-N469 PolarHBondContact O-N 3.35Å; E466-E470 PolarHBondContact O-N 3.01Å
467A92.7Very high93.3Very high43 Ų4397.7 Ų97.736%0.35550%0.499SS..Hα-helixtrans-60.7-33.9175.700000112.8G463 Q471G463-A467 WeakPolarHBondContact O-CB 3.49Å; G463-A467 PolarHBondContact O-N 3.49Å; A467-Q471 WeakPolarHBondContact O-CG 3.36Å; A467-Q471 PolarHBondContact O-N 3.11Å; A467-Q471 VanDerWaalsContact O-N 3.12Å
468K93.3Very high93.1Very high122 Ų12298.6 Ų98.653%0.5350%0.5SS..Hα-helixtrans-71.3-36.7173.3-75-71.3171.2-164.10112.2K464 L465 E466 Q471 I472K464-K468 WeakPolarHBondContact O-CB 3.42Å; K464-K468 VanDerWaalsContact O-CG 3.29Å; K464-K468 WeakPolarHBondContact O-CG 3.42Å; K464-K468 PolarHBondContact O-N 3.22Å; L465-K468 PolarHBondContact O-N 3.43Å; E466-K468 VanDerWaalsContact C-N 3.25Å; E466-K468 PolarHBondContact O-N 3.29Å; K468-Q471 PolarHBondContact O-N 2.96Å; K468-I472 WeakPolarHBondContact O-CG1 3.33Å; K468-I472 PolarHBondContact O-N 3.42Å
469N91.1Very high92.9Very high89 Ų89101.6 Ų101.648%0.47651%0.514SS..Hα-helixtrans-65.4-44.1174.9-158.180.7000111L465 E466 Q471 I472 D473L465-N469 WeakPolarHBondContact O-CB 3.38Å; L465-N469 PolarHBondContact O-N 3.41Å; E466-N469 WeakPolarHBondContact O-CA 3.33Å; E466-N469 WeakPolarHBondContact O-CB 3.42Å; E466-N469 PolarHBondContact O-N 3.35Å; N469-Q471 VanDerWaalsContact C-N 3.31Å; N469-Q471 PolarHBondContact O-N 2.91Å; N469-I472 WeakPolarHBondContact O-CB 3.25Å; N469-I472 PolarHBondContact O-N 2.96Å; N469-D473 PolarHBondContact ND2-OD2 3.32Å; N469-D473 PolarHBondContact O-N 2.9Å
470E95.8Very high92.8Very high119 Ų119101.8 Ų101.856%0.55652%0.518SS*.Hα-helixtrans-59-40.2173.1-71.2178.7178.300112.3E466 I472 D473 Q474E466-E470 PolarHBondContact O-N 3.01Å; E470-I472 VanDerWaalsContact C-N 3.32Å; E470-I472 PolarHBondContact O-N 3Å; E470-D473 PolarHBondContact O-N 3.37Å; E470-Q474 WeakPolarHBondContact O-CB 3.34Å; E470-Q474 VanDerWaalsContact O-CG 3.27Å; E470-Q474 WeakPolarHBondContact O-CG 3.39Å; E470-Q474 PolarHBondContact O-N 3.27Å
471Q90.1Very high92.8Very high91 Ų91103.3 Ų103.343%0.42552%0.519SS..Hα-helixtrans-63.9-36.5174-76.71784.300112.5A467 K468 N469 K475A467-Q471 WeakPolarHBondContact O-CG 3.36Å; A467-Q471 PolarHBondContact O-N 3.11Å; A467-Q471 VanDerWaalsContact O-N 3.12Å; K468-Q471 PolarHBondContact O-N 2.96Å; N469-Q471 VanDerWaalsContact C-N 3.31Å; N469-Q471 PolarHBondContact O-N 2.91Å; Q471-K475 WeakPolarHBondContact O-CB 3.47Å; Q471-K475 WeakPolarHBondContact O-CG 3.49Å; Q471-K475 PolarHBondContact O-N 3.13Å
472I88.9Confident92.7Very high107 Ų107103.7 Ų103.755%0.54952%0.521SS..Hα-helixtrans-67.3-44.3175.7-69.4165.3000109.8K468 N469 E470 Q474 K475 A476K468-I472 WeakPolarHBondContact O-CG1 3.33Å; K468-I472 PolarHBondContact O-N 3.42Å; N469-I472 WeakPolarHBondContact O-CB 3.25Å; N469-I472 PolarHBondContact O-N 2.96Å; E470-I472 VanDerWaalsContact C-N 3.32Å; E470-I472 PolarHBondContact O-N 3Å; I472-Q474 PolarHBondContact O-N 2.94Å; I472-K475 PolarHBondContact O-N 3.21Å; I472-A476 WeakPolarHBondContact O-CB 3.47Å; I472-A476 PolarHBondContact O-N 2.92Å
473D95Very high92.6Very high93 Ų93101.9 Ų101.950%0.49752%0.518SS..Hα-helixtrans-63-42.4178-66.5-31.9000111.6N469 E470 K475 A476 Q477N469-D473 PolarHBondContact ND2-OD2 3.32Å; N469-D473 PolarHBondContact O-N 2.9Å; E470-D473 PolarHBondContact O-N 3.37Å; D473-K475 PolarHBondContact O-N 2.86Å; D473-A476 PolarHBondContact O-N 3.27Å; D473-Q477 PolarHBondContact O-N 3.01Å
474Q94.9Very high92.7Very high117 Ų117103 Ų10355%0.54752%0.524SS..Hα-helixtrans-60.8-43.5173.7-73.6171.719.200112.2E470 I472 Q477 Q478E470-Q474 WeakPolarHBondContact O-CB 3.34Å; E470-Q474 VanDerWaalsContact O-CG 3.27Å; E470-Q474 WeakPolarHBondContact O-CG 3.39Å; E470-Q474 PolarHBondContact O-N 3.27Å; I472-Q474 PolarHBondContact O-N 2.94Å; Q474-Q477 PolarHBondContact O-N 3.47Å; Q474-Q478 WeakPolarHBondContact O-CG 3.4Å; Q474-Q478 PolarHBondContact O-N 2.96Å
475K92.3Very high92.6Very high140 Ų14099.7 Ų99.761%0.60951%0.514SS*.Hα-helixtrans-67.6-36.2176.4-76.3-175.2177.4-171.10112.3Q471 I472 D473 Q477 Q478 M479Q471-K475 WeakPolarHBondContact O-CB 3.47Å; Q471-K475 WeakPolarHBondContact O-CG 3.49Å; Q471-K475 PolarHBondContact O-N 3.13Å; I472-K475 PolarHBondContact O-N 3.21Å; D473-K475 PolarHBondContact O-N 2.86Å; K475-Q477 VanDerWaalsContact C-N 3.34Å; K475-Q478 PolarHBondContact O-N 3.38Å; K475-M479 WeakPolarHBondContact O-CG 3.49Å; K475-M479 PolarHBondContact O-N 3.32Å
476A92Very high92.8Very high45 Ų4599.7 Ų99.737%0.37251%0.508SS..Hα-helixtrans-62.5-43.6174.100000110.8I472 D473 M479 T480I472-A476 WeakPolarHBondContact O-CB 3.47Å; I472-A476 PolarHBondContact O-N 2.92Å; D473-A476 PolarHBondContact O-N 3.27Å; A476-M479 PolarHBondContact O-N 2.96Å; A476-T480 PolarHBondContact O-N 2.96Å
477Q94.4Very high92.8Very high109 Ų10998 Ų9851%0.50950%0.503SS..Hα-helixtrans-62.4-44.8174.6-171.460.547.400112.1D473 Q474 K475 M479 T480 D481D473-Q477 PolarHBondContact O-N 3.01Å; Q474-Q477 PolarHBondContact O-N 3.47Å; K475-Q477 VanDerWaalsContact C-N 3.34Å; Q477-M479 VanDerWaalsContact C-N 3.3Å; Q477-M479 PolarHBondContact O-N 3.49Å; Q477-T480 WeakPolarHBondContact CA-OG1 3.36Å; Q477-T480 PolarHBondContact NE2-OG1 2.87Å; Q477-T480 PolarHBondContact O-N 3.31Å; Q477-T480 VanDerWaalsContact O-N 3.11Å; Q477-T480 PolarHBondContact O-OG1 3.33Å; Q477-D481 PolarHBondContact NE2-OD1 3.33Å; Q477-D481 PolarHBondContact O-N 3.3Å
478Q91.3Very high93Very high118 Ų118102 Ų10255%0.55151%0.509SS*.Hα-helixtrans-59.7-39.2175.1-73.7175.7-3.900112.3Q474 K475 D481 L482Q474-Q478 WeakPolarHBondContact O-CG 3.4Å; Q474-Q478 PolarHBondContact O-N 2.96Å; K475-Q478 PolarHBondContact O-N 3.38Å; Q478-D481 PolarHBondContact O-N 3.48Å; Q478-L482 WeakPolarHBondContact O-CB 3.38Å; Q478-L482 WeakPolarHBondContact O-CG 3.27Å; Q478-L482 PolarHBondContact O-N 2.93Å
479M91Very high93.1Very high138 Ų138100.6 Ų100.668%0.6851%0.507SS*.Hα-helixtrans-65.4-38.4174.6-73.1-155.7-42.500112.5K475 A476 Q477 D481 Q483K475-M479 WeakPolarHBondContact O-CG 3.49Å; K475-M479 PolarHBondContact O-N 3.32Å; A476-M479 PolarHBondContact O-N 2.96Å; Q477-M479 VanDerWaalsContact C-N 3.3Å; Q477-M479 PolarHBondContact O-N 3.49Å; M479-D481 VanDerWaalsContact C-N 3.35Å; M479-Q483 VanDerWaalsContact O-CB 3.24Å; M479-Q483 WeakPolarHBondContact O-CB 3.4Å; M479-Q483 PolarHBondContact O-N 2.96Å
480T92.1Very high93.1Very high77 Ų7799.4 Ų99.447%0.47250%0.502SS..Hα-helixtrans-67-37.617753.50000112.1A476 Q477 Q483 A484A476-T480 PolarHBondContact O-N 2.96Å; Q477-T480 WeakPolarHBondContact CA-OG1 3.36Å; Q477-T480 PolarHBondContact NE2-OG1 2.87Å; Q477-T480 PolarHBondContact O-N 3.31Å; Q477-T480 VanDerWaalsContact O-N 3.11Å; Q477-T480 PolarHBondContact O-OG1 3.33Å; T480-Q483 PolarHBondContact O-N 3.29Å; T480-A484 PolarHBondContact O-N 2.96Å
481D94Very high93Very high82 Ų8296.5 Ų96.544%0.43950%0.496SS..Hα-helixtrans-67.9-46.8178-61.1-15.1000110.6Q477 Q478 M479 Q483 A484 D485Q477-D481 PolarHBondContact NE2-OD1 3.33Å; Q477-D481 PolarHBondContact O-N 3.3Å; Q478-D481 PolarHBondContact O-N 3.48Å; M479-D481 VanDerWaalsContact C-N 3.35Å; D481-Q483 VanDerWaalsContact C-N 3.29Å; D481-Q483 PolarHBondContact O-N 3.2Å; D481-A484 WeakPolarHBondContact O-CB 3.36Å; D481-A484 PolarHBondContact O-N 3.44Å; D481-A484 VanDerWaalsContact O-N 3.1Å; D481-D485 PolarHBondContact O-N 3.28Å
482L92.2Very high93.2Very high120 Ų12096 Ų9663%0.62849%0.493SS*.Hα-helixtrans-62-35.9174.7-72.2173.6000112.5Q478 D485 K486Q478-L482 WeakPolarHBondContact O-CB 3.38Å; Q478-L482 WeakPolarHBondContact O-CG 3.27Å; Q478-L482 PolarHBondContact O-N 2.93Å; L482-D485 PolarHBondContact O-N 3.28Å; L482-K486 WeakPolarHBondContact O-CB 3.31Å; L482-K486 PolarHBondContact O-N 3Å
483Q93.3Very high93.4Very high100 Ų10096.1 Ų96.147%0.46749%0.494SS..Hα-helixtrans-68.1-36.9174.5-175.171.3-1000111.6M479 T480 D481 N487M479-Q483 VanDerWaalsContact O-CB 3.24Å; M479-Q483 WeakPolarHBondContact O-CB 3.4Å; M479-Q483 PolarHBondContact O-N 2.96Å; T480-Q483 PolarHBondContact O-N 3.29Å; D481-Q483 VanDerWaalsContact C-N 3.29Å; D481-Q483 PolarHBondContact O-N 3.2Å; Q483-N487 PolarHBondContact O-N 3.4Å; Q483-N487 VanDerWaalsContact O-N 3.09Å; Q483-N487 PolarHBondContact O-ND2 3.34Å
484A93.1Very high93.3Very high58 Ų5896 Ų9648%0.47949%0.494SS..Hα-helixtrans-65.3-43.7173.500000111.6T480 D481 N487 R488T480-A484 PolarHBondContact O-N 2.96Å; D481-A484 WeakPolarHBondContact O-CB 3.36Å; D481-A484 PolarHBondContact O-N 3.44Å; D481-A484 VanDerWaalsContact O-N 3.1Å; A484-N487 WeakPolarHBondContact O-CB 3.41Å; A484-N487 PolarHBondContact O-N 3.48Å; A484-R488 PolarHBondContact O-N 3.49Å
485D94.1Very high93.3Very high74 Ų7495.9 Ų95.940%0.39650%0.496SS..Hα-helixtrans-64.6-41.1175.7-86.9-31.2000112.7D481 L482 N487 R488 I489D481-D485 PolarHBondContact O-N 3.28Å; L482-D485 PolarHBondContact O-N 3.28Å; D485-N487 VanDerWaalsContact C-N 3.28Å; D485-N487 PolarHBondContact O-N 2.85Å; D485-R488 WeakPolarHBondContact O-CB 3.37Å; D485-R488 PolarHBondContact O-N 3.38Å; D485-R488 VanDerWaalsContact O-N 3.17Å; D485-R488 IonicContact OD1-NE 3.62Å; D485-R488 PolarHBondContact OD1-NE 3.48Å; D485-R488 IonicContact OD1-NH2 2.77Å; D485-I489 WeakPolarHBondContact O-CG1 3.35Å; D485-I489 PolarHBondContact O-N 3.06Å
486K94Very high93.5Very high124 Ų12494.5 Ų94.554%0.53950%0.495SS..Hα-helixtrans-56.1-45.5172.2179.2-175.7174.9-179.60111L482 T490L482-K486 WeakPolarHBondContact O-CB 3.31Å; L482-K486 PolarHBondContact O-N 3Å; K486-T490 WeakPolarHBondContact O-CB 3.48Å; K486-T490 PolarHBondContact O-N 2.97Å; K486-T490 PolarHBondContact O-OG1 3.38Å
487N94Very high93.6Very high92 Ų9295.1 Ų95.149%0.49249%0.494SS..Hα-helixtrans-65.8-39.3178.2-67.5-23.5000111.7Q483 A484 D485 T490 S491Q483-N487 PolarHBondContact O-N 3.4Å; Q483-N487 VanDerWaalsContact O-N 3.09Å; Q483-N487 PolarHBondContact O-ND2 3.34Å; A484-N487 WeakPolarHBondContact O-CB 3.41Å; A484-N487 PolarHBondContact O-N 3.48Å; D485-N487 VanDerWaalsContact C-N 3.28Å; D485-N487 PolarHBondContact O-N 2.85Å; N487-T490 PolarHBondContact O-N 3.41Å; N487-S491 PolarHBondContact O-N 3.26Å
488R96.2Very high93.7Very high127 Ų12794.8 Ų94.848%0.47949%0.492SS..Hα-helixtrans-59.8-53.9174.6-175.7176.771.694.4-9.3111.3A484 D485 T490 S491 E492A484-R488 PolarHBondContact O-N 3.49Å; D485-R488 WeakPolarHBondContact O-CB 3.37Å; D485-R488 PolarHBondContact O-N 3.38Å; D485-R488 VanDerWaalsContact O-N 3.17Å; D485-R488 IonicContact OD1-NE 3.62Å; D485-R488 PolarHBondContact OD1-NE 3.48Å; D485-R488 IonicContact OD1-NH2 2.77Å; R488-T490 VanDerWaalsContact C-N 3.28Å; R488-T490 PolarHBondContact O-N 2.91Å; R488-S491 WeakPolarHBondContact O-CB 3.48Å; R488-S491 PolarHBondContact O-N 2.88Å; R488-S491 PolarHBondContact O-OG 3.37Å; R488-E492 WeakPolarHBondContact CG-OE1 3.33Å; R488-E492 IonicContact CZ-OE1 3.51Å; R488-E492 IonicContact NH1-OE1 2.92Å; R488-E492 PolarHBondContact NH1-OE1 3.27Å; R488-E492 IonicContact NH1-OE2 2.64Å; R488-E492 WeakPolarHBondContact O-CG 3.38Å; R488-E492 PolarHBondContact O-N 3.35Å
489I94.6Very high93.8Very high93 Ų9394.7 Ų94.748%0.47749%0.492SS..Hα-helixtrans-61-39.2178.4-65.6168.6000110.9D485 S491 E492 L493D485-I489 WeakPolarHBondContact O-CG1 3.35Å; D485-I489 PolarHBondContact O-N 3.06Å; I489-S491 VanDerWaalsContact C-N 3.31Å; I489-S491 PolarHBondContact O-N 2.92Å; I489-E492 PolarHBondContact O-N 3.01Å; I489-L493 WeakPolarHBondContact O-CB 3.31Å; I489-L493 PolarHBondContact O-N 2.82Å
490T92.7Very high94Very high63 Ų6394.8 Ų94.839%0.38749%0.489SS..Hα-helixtrans-62.1-40175.9-56.20000111.3K486 N487 R488 L493 N494K486-T490 WeakPolarHBondContact O-CB 3.48Å; K486-T490 PolarHBondContact O-N 2.97Å; K486-T490 PolarHBondContact O-OG1 3.38Å; N487-T490 PolarHBondContact O-N 3.41Å; R488-T490 VanDerWaalsContact C-N 3.28Å; R488-T490 PolarHBondContact O-N 2.91Å; T490-L493 PolarHBondContact O-N 3.02Å; T490-N494 PolarHBondContact O-N 3.35Å; T490-N494 PolarHBondContact O-ND2 2.96Å
491S93Very high94.1Very high59 Ų5995.7 Ų95.741%0.41349%0.486SS..Hα-helixtrans-67.2-40.2175.6740000112.5N487 R488 I489 N494 L495N487-S491 PolarHBondContact O-N 3.26Å; R488-S491 WeakPolarHBondContact O-CB 3.48Å; R488-S491 PolarHBondContact O-N 2.88Å; R488-S491 PolarHBondContact O-OG 3.37Å; I489-S491 VanDerWaalsContact C-N 3.31Å; I489-S491 PolarHBondContact O-N 2.92Å; S491-N494 PolarHBondContact O-N 3.3Å; S491-L495 WeakPolarHBondContact O-CG 3.33Å; S491-L495 PolarHBondContact O-N 3.35Å
492E95.2Very high94.2Very high81 Ų8197.4 Ų97.438%0.37950%0.495SS..Hα-helixtrans-63.7-43.6175.1-69.5171-167.200111.1R488 I489 N494 L495 L496R488-E492 WeakPolarHBondContact CG-OE1 3.33Å; R488-E492 IonicContact CZ-OE1 3.51Å; R488-E492 IonicContact NH1-OE1 2.92Å; R488-E492 PolarHBondContact NH1-OE1 3.27Å; R488-E492 IonicContact NH1-OE2 2.64Å; R488-E492 WeakPolarHBondContact O-CG 3.38Å; R488-E492 PolarHBondContact O-N 3.35Å; I489-E492 PolarHBondContact O-N 3.01Å; E492-N494 VanDerWaalsContact C-N 3.34Å; E492-N494 PolarHBondContact O-N 3.33Å; E492-L495 PolarHBondContact O-N 3.49Å; E492-L496 WeakPolarHBondContact O-CD1 3.34Å; E492-L496 PolarHBondContact O-N 2.71Å
493L91.6Very high94.3Very high108 Ų10896.1 Ų96.157%0.56549%0.489SS*.Hα-helixtrans-60.6-42.8175.5-168.197.6000111.7I489 T490 L496 T497I489-L493 WeakPolarHBondContact O-CB 3.31Å; I489-L493 PolarHBondContact O-N 2.82Å; T490-L493 PolarHBondContact O-N 3.02Å; L493-L496 PolarHBondContact O-N 2.83Å; L493-T497 WeakPolarHBondContact O-CB 3.39Å; L493-T497 PolarHBondContact O-N 3.33Å; L493-T497 PolarHBondContact O-OG1 2.79Å
494N94.6Very high94.4Very high92 Ų9297 Ų9749%0.49249%0.493SS..Hα-helixtrans-63.2-42.7176.7-71.5-24.4000111.4T490 S491 E492 T497 E498T490-N494 PolarHBondContact O-N 3.35Å; T490-N494 PolarHBondContact O-ND2 2.96Å; S491-N494 PolarHBondContact O-N 3.3Å; E492-N494 VanDerWaalsContact C-N 3.34Å; E492-N494 PolarHBondContact O-N 3.33Å; N494-T497 PolarHBondContact O-N 2.81Å; N494-E498 WeakPolarHBondContact O-CG 3.28Å; N494-E498 PolarHBondContact O-N 3.34Å
495L94.8Very high94.6Very high113 Ų11398.8 Ų98.859%0.59250%0.497SS*.Hα-helixtrans-62.7-44.8175.6-69.9173.6000112.1S491 E492 T497 E498 Q499S491-L495 WeakPolarHBondContact O-CG 3.33Å; S491-L495 PolarHBondContact O-N 3.35Å; E492-L495 PolarHBondContact O-N 3.49Å; L495-T497 VanDerWaalsContact C-N 3.29Å; L495-T497 PolarHBondContact O-N 2.61Å; L495-E498 PolarHBondContact O-N 3.35Å; L495-Q499 WeakPolarHBondContact O-CG 3.48Å; L495-Q499 PolarHBondContact O-N 3.22Å
496L94.9Very high94.7Very high111 Ų11198 Ų9858%0.58150%0.498SS*.Hα-helixtrans-62.2-38175.5-9770000111.7E492 L493 Q499 F500E492-L496 WeakPolarHBondContact O-CD1 3.34Å; E492-L496 PolarHBondContact O-N 2.71Å; L493-L496 PolarHBondContact O-N 2.83Å; L496-Q499 PolarHBondContact O-N 2.84Å; L496-F500 WeakPolarHBondContact O-CB 3.29Å; L496-F500 PolarHBondContact O-N 3.46Å
497T95.1Very high94.6Very high59 Ų5997.2 Ų97.236%0.36250%0.499SS..Hα-helixtrans-65.2-43.2177.4-57.20000111.4L493 N494 L495 F500 K501L493-T497 WeakPolarHBondContact O-CB 3.39Å; L493-T497 PolarHBondContact O-N 3.33Å; L493-T497 PolarHBondContact O-OG1 2.79Å; N494-T497 PolarHBondContact O-N 2.81Å; L495-T497 VanDerWaalsContact C-N 3.29Å; L495-T497 PolarHBondContact O-N 2.61Å; T497-F500 PolarHBondContact O-N 3.28Å; T497-K501 WeakPolarHBondContact O-CG 3.28Å; T497-K501 PolarHBondContact O-N 2.93Å
498E95.4Very high94.7Very high101 Ų10194.8 Ų94.847%0.47249%0.489SS..Hα-helixtrans-66.2-38.1174.9-68.1-56.2129.700112.1N494 L495 F500 K501 L502N494-E498 WeakPolarHBondContact O-CG 3.28Å; N494-E498 PolarHBondContact O-N 3.34Å; L495-E498 PolarHBondContact O-N 3.35Å; E498-F500 VanDerWaalsContact C-N 3.33Å; E498-F500 PolarHBondContact O-N 2.82Å; E498-K501 PolarHBondContact O-N 3.4Å; E498-K501 IonicContact OE1-NZ 2.74Å; E498-K501 PolarHBondContact OE1-NZ 2.91Å; E498-L502 WeakPolarHBondContact O-CG 3.29Å; E498-L502 PolarHBondContact O-N 3.18Å
499Q95Very high94.6Very high116 Ų11691.9 Ų91.954%0.54249%0.486SS..Hα-helixtrans-62-40.8171.9-74.1-177.42.100112.1L495 L496 L502 N503L495-Q499 WeakPolarHBondContact O-CG 3.48Å; L495-Q499 PolarHBondContact O-N 3.22Å; L496-Q499 PolarHBondContact O-N 2.84Å; Q499-L502 PolarHBondContact O-N 3.41Å; Q499-N503 WeakPolarHBondContact O-CB 3.4Å; Q499-N503 VanDerWaalsContact O-CG 3.24Å; Q499-N503 PolarHBondContact O-N 3.48Å; Q499-N503 PolarHBondContact O-ND2 2.93Å
500F93.5Very high94.6Very high140 Ų14089.5 Ų89.561%0.61448%0.48SS*.Hα-helixtrans-61.7-44.3175.9-174-92.3000111.6L496 T497 E498 L502 N503 E504L496-F500 WeakPolarHBondContact O-CB 3.29Å; L496-F500 PolarHBondContact O-N 3.46Å; T497-F500 PolarHBondContact O-N 3.28Å; E498-F500 VanDerWaalsContact C-N 3.33Å; E498-F500 PolarHBondContact O-N 2.82Å; F500-L502 PolarHBondContact O-N 3.4Å; F500-N503 PolarHBondContact O-N 3.47Å; F500-E504 WeakPolarHBondContact O-CB 3.4Å; F500-E504 PolarHBondContact O-N 3.29Å
501K95.8Very high94.7Very high96 Ų9691.9 Ų91.942%0.41749%0.487SS..Hα-helixtrans-61.2-41.8175-68.2172.3-173.4168.70112.6T497 E498 N503 E504 V505T497-K501 WeakPolarHBondContact O-CG 3.28Å; T497-K501 PolarHBondContact O-N 2.93Å; E498-K501 PolarHBondContact O-N 3.4Å; E498-K501 IonicContact OE1-NZ 2.74Å; E498-K501 PolarHBondContact OE1-NZ 2.91Å; K501-N503 VanDerWaalsContact C-N 3.32Å; K501-N503 PolarHBondContact O-N 2.97Å; K501-E504 PolarHBondContact O-N 3.07Å; K501-V505 WeakPolarHBondContact O-CG2 3.44Å; K501-V505 PolarHBondContact O-N 2.92Å
502L94.6Very high94.8Very high119 Ų11994.8 Ų94.862%0.62349%0.492SS*.Hα-helixtrans-62.3-41.4175.1-78163000111.5E498 Q499 F500 V505 S506E498-L502 WeakPolarHBondContact O-CG 3.29Å; E498-L502 PolarHBondContact O-N 3.18Å; Q499-L502 PolarHBondContact O-N 3.41Å; F500-L502 PolarHBondContact O-N 3.4Å; L502-V505 PolarHBondContact O-N 2.9Å; L502-S506 PolarHBondContact O-N 3.48Å; L502-S506 PolarHBondContact O-OG 3.38Å
503N94.3Very high94.9Very high93 Ų9397.4 Ų97.450%0.49750%0.502SS..Hα-helixtrans-65.6-41176.1-69.9-16.8000111.4Q499 F500 K501 V505 S506 L507Q499-N503 WeakPolarHBondContact O-CB 3.4Å; Q499-N503 VanDerWaalsContact O-CG 3.24Å; Q499-N503 PolarHBondContact O-N 3.48Å; Q499-N503 PolarHBondContact O-ND2 2.93Å; F500-N503 PolarHBondContact O-N 3.47Å; K501-N503 VanDerWaalsContact C-N 3.32Å; K501-N503 PolarHBondContact O-N 2.97Å; N503-V505 PolarHBondContact O-N 3.3Å; N503-S506 WeakPolarHBondContact CA-OG 3.42Å; N503-S506 PolarHBondContact O-N 2.99Å; N503-S506 PolarHBondContact O-OG 3Å; N503-L507 WeakPolarHBondContact O-CB 3.46Å; N503-L507 WeakPolarHBondContact O-CG 3.05Å; N503-L507 PolarHBondContact O-N 3.45Å
504E96.8Very high95.1Very high119 Ų11996.6 Ų96.656%0.55650%0.497SS*.Hα-helixtrans-61.1-43.4175.7-167.8178.6-177.700112F500 K501 S508F500-E504 WeakPolarHBondContact O-CB 3.4Å; F500-E504 PolarHBondContact O-N 3.29Å; K501-E504 PolarHBondContact O-N 3.07Å; E504-S508 WeakPolarHBondContact O-CB 3.29Å; E504-S508 PolarHBondContact O-N 3.44Å
505V95.9Very high95.1Very high94 Ų9497.7 Ų97.757%0.5750%0.5SS*.Hα-helixtrans-64.7-43.2174.1173.70000111.3K501 L502 N503 S508 T509K501-V505 WeakPolarHBondContact O-CG2 3.44Å; K501-V505 PolarHBondContact O-N 2.92Å; L502-V505 PolarHBondContact O-N 2.9Å; N503-V505 PolarHBondContact O-N 3.3Å; V505-S508 PolarHBondContact O-N 3.39Å; V505-T509 WeakPolarHBondContact O-CG2 3.49Å; V505-T509 PolarHBondContact O-N 3Å; V505-T509 PolarHBondContact O-OG1 3.37Å
506S96.8Very high95.1Very high59 Ų5997.3 Ų97.341%0.41350%0.498SS..Hα-helixtrans-66.3-40.1179.867.50000112.2L502 N503 T509 A510L502-S506 PolarHBondContact O-N 3.48Å; L502-S506 PolarHBondContact O-OG 3.38Å; N503-S506 WeakPolarHBondContact CA-OG 3.42Å; N503-S506 PolarHBondContact O-N 2.99Å; N503-S506 PolarHBondContact O-OG 3Å; S506-T509 WeakPolarHBondContact CA-OG1 3.37Å; S506-T509 PolarHBondContact O-N 3.26Å; S506-T509 PolarHBondContact O-OG1 3.34Å; S506-A510 PolarHBondContact O-N 2.99Å
507L92.8Very high95.2Very high106 Ų10697.2 Ų97.256%0.55550%0.497SS*.Hα-helixtrans-59.8-49.2170.5-76.9169000111N503 T509 A510 E511N503-L507 WeakPolarHBondContact O-CB 3.46Å; N503-L507 WeakPolarHBondContact O-CG 3.05Å; N503-L507 PolarHBondContact O-N 3.45Å; L507-T509 VanDerWaalsContact C-N 3.26Å; L507-T509 PolarHBondContact O-N 3.34Å; L507-A510 CarbonylContact O-C 3.6Å; L507-A510 WeakPolarHBondContact O-CA 3.44Å; L507-A510 WeakPolarHBondContact O-CB 3.39Å; L507-A510 PolarHBondContact O-N 2.9Å; L507-E511 WeakPolarHBondContact O-CG 3.48Å; L507-E511 PolarHBondContact O-N 3Å
508S94.6Very high95.1Very high41 Ų4199.3 Ų99.329%0.28750%0.503SS..Hα-helixtrans-59.2-36.2176.8-175.60000112.8E504 V505 K512E504-S508 WeakPolarHBondContact O-CB 3.29Å; E504-S508 PolarHBondContact O-N 3.44Å; V505-S508 PolarHBondContact O-N 3.39Å; S508-K512 WeakPolarHBondContact O-CG 3.45Å; S508-K512 PolarHBondContact O-N 2.96Å; S508-K512 VanDerWaalsContact O-N 3.11Å
509T94.8Very high95.1Very high66 Ų6699.1 Ų99.141%0.40550%0.502SS..Hα-helixtrans-70.6-32.5173.859.50000113.3V505 S506 L507 K513V505-T509 WeakPolarHBondContact O-CG2 3.49Å; V505-T509 PolarHBondContact O-N 3Å; V505-T509 PolarHBondContact O-OG1 3.37Å; S506-T509 WeakPolarHBondContact CA-OG1 3.37Å; S506-T509 PolarHBondContact O-N 3.26Å; S506-T509 PolarHBondContact O-OG1 3.34Å; L507-T509 VanDerWaalsContact C-N 3.26Å; L507-T509 PolarHBondContact O-N 3.34Å; T509-K513 VanDerWaalsContact O-CG 3.3Å; T509-K513 WeakPolarHBondContact O-CG 3.44Å; T509-K513 PolarHBondContact O-N 3.22Å; T509-K513 VanDerWaalsContact O-N 3.16Å
510A94Very high95.1Very high43 Ų4396.8 Ų96.836%0.35550%0.495SS..Hα-helixtrans-71.4-42.2175.200000111.2S506 L507 K513 I514S506-A510 PolarHBondContact O-N 2.99Å; L507-A510 CarbonylContact O-C 3.6Å; L507-A510 WeakPolarHBondContact O-CA 3.44Å; L507-A510 WeakPolarHBondContact O-CB 3.39Å; L507-A510 PolarHBondContact O-N 2.9Å; A510-K513 WeakPolarHBondContact O-CB 3.45Å; A510-K513 PolarHBondContact O-N 2.97Å; A510-K513 VanDerWaalsContact O-N 3.14Å; A510-I514 WeakPolarHBondContact O-CG1 3.44Å; A510-I514 PolarHBondContact O-N 2.93Å
511E95Very high95.2Very high113 Ų11394.8 Ų94.853%0.52849%0.49SS..Hα-helixtrans-56.5-51173.7-71.7171.3164.100111L507 K513 I514 E515L507-E511 WeakPolarHBondContact O-CG 3.48Å; L507-E511 PolarHBondContact O-N 3Å; E511-K513 VanDerWaalsContact C-N 3.27Å; E511-K513 PolarHBondContact O-N 3.5Å; E511-I514 WeakPolarHBondContact O-CA 3.47Å; E511-I514 WeakPolarHBondContact O-CB 3.44Å; E511-I514 PolarHBondContact O-N 3.37Å; E511-E515 WeakPolarHBondContact O-CG 3.38Å; E511-E515 PolarHBondContact O-N 3.44Å
512K95.8Very high95Very high120 Ų12097.8 Ų97.852%0.52250%0.499SS..Hα-helixtrans-59.5-35.7175.5-72.2170.1-177.1164.80113.2S508 L516S508-K512 WeakPolarHBondContact O-CG 3.45Å; S508-K512 PolarHBondContact O-N 2.96Å; S508-K512 VanDerWaalsContact O-N 3.11Å; K512-L516 WeakPolarHBondContact O-CB 3.29Å; K512-L516 VanDerWaalsContact O-CG 3.26Å; K512-L516 WeakPolarHBondContact O-CG 3.49Å; K512-L516 PolarHBondContact O-N 2.97Å
513K96.7Very high95Very high136 Ų13697.2 Ų97.259%0.59149%0.493SS*.Hα-helixtrans-67.7-37.9175.1-77.5172.8-178.3176.40111.6T509 A510 E511 L517T509-K513 VanDerWaalsContact O-CG 3.3Å; T509-K513 WeakPolarHBondContact O-CG 3.44Å; T509-K513 PolarHBondContact O-N 3.22Å; T509-K513 VanDerWaalsContact O-N 3.16Å; A510-K513 WeakPolarHBondContact O-CB 3.45Å; A510-K513 PolarHBondContact O-N 2.97Å; A510-K513 VanDerWaalsContact O-N 3.14Å; E511-K513 VanDerWaalsContact C-N 3.27Å; E511-K513 PolarHBondContact O-N 3.5Å; K513-L517 WeakPolarHBondContact O-CB 3.42Å; K513-L517 VanDerWaalsContact O-CG 3.28Å; K513-L517 WeakPolarHBondContact O-CG 3.33Å; K513-L517 PolarHBondContact O-N 2.93Å
514I95.5Very high94.9Very high91 Ų91100.5 Ų100.547%0.46750%0.498SS..Hα-helixtrans-64.9-48.4175.1-69165.8000109.5A510 E511 L516 L517 E518A510-I514 WeakPolarHBondContact O-CG1 3.44Å; A510-I514 PolarHBondContact O-N 2.93Å; E511-I514 WeakPolarHBondContact O-CA 3.47Å; E511-I514 WeakPolarHBondContact O-CB 3.44Å; E511-I514 PolarHBondContact O-N 3.37Å; I514-L516 VanDerWaalsContact C-N 3.32Å; I514-L516 PolarHBondContact O-N 3.45Å; I514-L517 PolarHBondContact O-N 3.34Å; I514-L517 VanDerWaalsContact O-N 3.08Å; I514-E518 HydrophobicContact CG2-CG 4.19Å; I514-E518 WeakPolarHBondContact CG2-OE1 3.35Å; I514-E518 WeakPolarHBondContact O-CB 3.43Å; I514-E518 WeakPolarHBondContact O-CG 3.46Å; I514-E518 PolarHBondContact O-N 3.03Å
515E95.3Very high94.8Very high116 Ų11699.2 Ų99.254%0.54250%0.495SS..Hα-helixtrans-55.7-44.9176.7-70172.6178.200112.2E511 E518 E519E511-E515 WeakPolarHBondContact O-CG 3.38Å; E511-E515 PolarHBondContact O-N 3.44Å; E515-E518 PolarHBondContact O-N 3.38Å; E515-E519 PolarHBondContact O-N 3.42Å
516L94.1Very high94.6Very high105 Ų10598.4 Ų98.455%0.5549%0.493SS..Hα-helixtrans-63.1-43.1175.6-74.1169.6000112.2K512 I514 E519 T520K512-L516 WeakPolarHBondContact O-CB 3.29Å; K512-L516 VanDerWaalsContact O-CG 3.26Å; K512-L516 WeakPolarHBondContact O-CG 3.49Å; K512-L516 PolarHBondContact O-N 2.97Å; I514-L516 VanDerWaalsContact C-N 3.32Å; I514-L516 PolarHBondContact O-N 3.45Å; L516-E519 PolarHBondContact O-N 3.5Å; L516-T520 WeakPolarHBondContact O-CG2 3.22Å; L516-T520 PolarHBondContact O-N 3.43Å
517L97.3Very high94.5Very high108 Ų108100.7 Ų100.757%0.56550%0.497SS*.Hα-helixtrans-65.9-41.7177-73.2171.9000111.4K513 I514 E519 T520 I521K513-L517 WeakPolarHBondContact O-CB 3.42Å; K513-L517 VanDerWaalsContact O-CG 3.28Å; K513-L517 WeakPolarHBondContact O-CG 3.33Å; K513-L517 PolarHBondContact O-N 2.93Å; I514-L517 PolarHBondContact O-N 3.34Å; I514-L517 VanDerWaalsContact O-N 3.08Å; L517-E519 VanDerWaalsContact C-N 3.29Å; L517-E519 PolarHBondContact O-N 3.06Å; L517-T520 WeakPolarHBondContact CA-OG1 3.36Å; L517-T520 PolarHBondContact O-N 2.77Å; L517-T520 PolarHBondContact O-OG1 3.26Å; L517-I521 WeakPolarHBondContact O-CG1 3.2Å; L517-I521 PolarHBondContact O-N 3.25Å
518E94.3Very high94.3Very high104 Ų104100 Ų10049%0.48649%0.494SS..Hα-helixtrans-62-35.8174.6-72.4176.2169.800112.1I514 E515 R522I514-E518 HydrophobicContact CG2-CG 4.19Å; I514-E518 WeakPolarHBondContact CG2-OE1 3.35Å; I514-E518 WeakPolarHBondContact O-CB 3.43Å; I514-E518 WeakPolarHBondContact O-CG 3.46Å; I514-E518 PolarHBondContact O-N 3.03Å; E515-E518 PolarHBondContact O-N 3.38Å; E518-R522 WeakPolarHBondContact O-CB 3.41Å; E518-R522 VanDerWaalsContact O-CG 3.29Å; E518-R522 WeakPolarHBondContact O-CG 3.5Å; E518-R522 PolarHBondContact O-N 2.89Å; E518-R522 PolarHBondContact O-NE 2.67Å
519E93.9Very high93.9Very high97 Ų97102.4 Ų102.445%0.45350%0.5SS..Hα-helixtrans-64.7-47.5171-168.4166.1-152.500111.8E515 L516 L517 I521 R522 E523E515-E519 PolarHBondContact O-N 3.42Å; L516-E519 PolarHBondContact O-N 3.5Å; L517-E519 VanDerWaalsContact C-N 3.29Å; L517-E519 PolarHBondContact O-N 3.06Å; E519-I521 VanDerWaalsContact C-N 3.3Å; E519-I521 PolarHBondContact O-N 3.34Å; E519-R522 PolarHBondContact O-N 3.13Å; E519-E523 WeakPolarHBondContact O-CG 3.42Å; E519-E523 PolarHBondContact O-N 2.69Å
520T95Very high93.6Very high66 Ų66103.8 Ų103.841%0.40551%0.505SS..Hα-helixtrans-62.3-35.3176.862.50000113.2L516 L517 R524L516-T520 WeakPolarHBondContact O-CG2 3.22Å; L516-T520 PolarHBondContact O-N 3.43Å; L517-T520 WeakPolarHBondContact CA-OG1 3.36Å; L517-T520 PolarHBondContact O-N 2.77Å; L517-T520 PolarHBondContact O-OG1 3.26Å; T520-R524 VanDerWaalsContact O-CG 3.23Å; T520-R524 WeakPolarHBondContact O-CG 3.39Å; T520-R524 PolarHBondContact O-N 2.99Å
521I95.2Very high93.2Very high98 Ų98106.5 Ų106.550%0.50351%0.511SS..Hα-helixtrans-66.9-46.7175.3-69.4167.5000109.9L517 E519 E523 R524 D525L517-I521 WeakPolarHBondContact O-CG1 3.2Å; L517-I521 PolarHBondContact O-N 3.25Å; E519-I521 VanDerWaalsContact C-N 3.3Å; E519-I521 PolarHBondContact O-N 3.34Å; I521-E523 VanDerWaalsContact C-N 3.3Å; I521-E523 PolarHBondContact O-N 2.93Å; I521-R524 PolarHBondContact O-N 3.48Å; I521-R524 VanDerWaalsContact O-N 3.11Å; I521-D525 PolarHBondContact O-N 3.27Å
522R93.4Very high92.8Very high160 Ų160108.9 Ų108.960%0.60452%0.515SS*.Hα-helixtrans-57.9-40.9176.6-76.8-179.8-70.9156.4-2.4112.5E518 E519 C526E518-R522 WeakPolarHBondContact O-CB 3.41Å; E518-R522 VanDerWaalsContact O-CG 3.29Å; E518-R522 WeakPolarHBondContact O-CG 3.5Å; E518-R522 PolarHBondContact O-N 2.89Å; E518-R522 PolarHBondContact O-NE 2.67Å; E519-R522 PolarHBondContact O-N 3.13Å; R522-C526 PolarHBondContact O-N 3.41Å; R522-C526 VanDerWaalsContact O-N 3.08Å
523E94Very high92Very high107 Ų107109.6 Ų109.650%0.552%0.515SS..Hα-helixtrans-62.4-46.3174.2-72.5179.6166.800111.8E519 I521 D525 C526 E527E519-E523 WeakPolarHBondContact O-CG 3.42Å; E519-E523 PolarHBondContact O-N 2.69Å; I521-E523 VanDerWaalsContact C-N 3.3Å; I521-E523 PolarHBondContact O-N 2.93Å; E523-D525 PolarHBondContact O-N 3.35Å; E523-C526 WeakPolarHBondContact O-CB 3.43Å; E523-C526 PolarHBondContact O-N 3.36Å; E523-C526 VanDerWaalsContact O-N 3.17Å; E523-E527 PolarHBondContact O-N 3.37Å
524R92.3Very high91.6Very high161 Ų161111.6 Ų111.661%0.60852%0.519SS*.Hα-helixtrans-66-37.6179.4-68.1-66.7163.3115.21.1112.9T520 I521 C526 E527 L528T520-R524 VanDerWaalsContact O-CG 3.23Å; T520-R524 WeakPolarHBondContact O-CG 3.39Å; T520-R524 PolarHBondContact O-N 2.99Å; I521-R524 PolarHBondContact O-N 3.48Å; I521-R524 VanDerWaalsContact O-N 3.11Å; R524-C526 VanDerWaalsContact C-N 3.3Å; R524-C526 PolarHBondContact O-N 2.95Å; R524-E527 WeakPolarHBondContact CD-OE2 3.33Å; R524-E527 IonicContact NE-OE2 2.79Å; R524-E527 PolarHBondContact O-N 3.1Å; R524-L528 WeakPolarHBondContact O-CB 3.43Å; R524-L528 VanDerWaalsContact O-CG 3.31Å; R524-L528 WeakPolarHBondContact O-CG 3.39Å; R524-L528 PolarHBondContact O-N 3.01Å
525D94.4Very high90.9Very high93 Ų93111.7 Ų111.750%0.49752%0.519SS..Hα-helixtrans-63.5-39.6173.1-74.1-27.8000111I521 E523 L528 E529I521-D525 PolarHBondContact O-N 3.27Å; E523-D525 PolarHBondContact O-N 3.35Å; D525-L528 PolarHBondContact O-N 3.47Å; D525-E529 VanDerWaalsContact O-CB 3.28Å; D525-E529 WeakPolarHBondContact O-CB 3.47Å; D525-E529 PolarHBondContact O-N 3.27Å
526C92Very high90Very high77 Ų77110 Ų11052%0.5251%0.514SS..Hα-helixtrans-63.7-43.4174.5-163.80000112.3R522 E523 R524 E529 L530R522-C526 PolarHBondContact O-N 3.41Å; R522-C526 VanDerWaalsContact O-N 3.08Å; E523-C526 WeakPolarHBondContact O-CB 3.43Å; E523-C526 PolarHBondContact O-N 3.36Å; E523-C526 VanDerWaalsContact O-N 3.17Å; R524-C526 VanDerWaalsContact C-N 3.3Å; R524-C526 PolarHBondContact O-N 2.95Å; C526-E529 WeakPolarHBondContact O-CB 3.5Å; C526-E529 PolarHBondContact O-N 2.87Å; C526-L530 WeakPolarHBondContact O-CG 3.3Å; C526-L530 PolarHBondContact O-N 3.32Å
527E94.5Very high89.1Confident107 Ų107112.8 Ų112.850%0.552%0.522SS..Hα-helixtrans-61.5-43.4174.1-71.4-179.8171.800112E523 R524 L530 M531E523-E527 PolarHBondContact O-N 3.37Å; R524-E527 WeakPolarHBondContact CD-OE2 3.33Å; R524-E527 IonicContact NE-OE2 2.79Å; R524-E527 PolarHBondContact O-N 3.1Å; E527-L530 PolarHBondContact O-N 3.48Å; E527-M531 WeakPolarHBondContact O-CB 3.42Å; E527-M531 VanDerWaalsContact O-CG 3.26Å; E527-M531 WeakPolarHBondContact O-CG 3.49Å; E527-M531 PolarHBondContact O-N 3.31Å
528L88.1Confident88.3Confident92 Ų92110.6 Ų110.648%0.48251%0.513SS..Hα-helixtrans-65-41176.7-74.8175000111.8R524 D525 M531 R532R524-L528 WeakPolarHBondContact O-CB 3.43Å; R524-L528 VanDerWaalsContact O-CG 3.31Å; R524-L528 WeakPolarHBondContact O-CG 3.39Å; R524-L528 PolarHBondContact O-N 3.01Å; D525-L528 PolarHBondContact O-N 3.47Å; L528-M531 PolarHBondContact O-N 3.34Å; L528-R532 WeakPolarHBondContact O-CB 3.29Å; L528-R532 WeakPolarHBondContact O-CG 3.48Å; L528-R532 PolarHBondContact O-N 2.93Å
529E87.5Confident87.3Confident91 Ų91110.2 Ų110.243%0.42552%0.52SS..Hα-helixtrans-59.9-45.7174.8-174.177.7-165.500110.8D525 C526 R532 R533D525-E529 VanDerWaalsContact O-CB 3.28Å; D525-E529 WeakPolarHBondContact O-CB 3.47Å; D525-E529 PolarHBondContact O-N 3.27Å; C526-E529 WeakPolarHBondContact O-CB 3.5Å; C526-E529 PolarHBondContact O-N 2.87Å; E529-R532 PolarHBondContact O-N 3.32Å; E529-R533 WeakPolarHBondContact O-CG 3.5Å; E529-R533 PolarHBondContact O-N 2.92Å; E529-R533 IonicContact OE1-CZ 2.87Å; E529-R533 IonicContact OE1-NE 3.75Å; E529-R533 IonicContact OE1-NH2 2.8Å; E529-R533 PolarHBondContact OE1-NH2 3.42Å
530L87.7Confident86.4Confident95 Ų95108.6 Ų108.650%0.49752%0.523SS..Hα-helixtrans-63.3-42.5175.7-73.9171.1000112.2C526 E527 R533 R534C526-L530 WeakPolarHBondContact O-CG 3.3Å; C526-L530 PolarHBondContact O-N 3.32Å; E527-L530 PolarHBondContact O-N 3.48Å; L530-R533 PolarHBondContact O-N 2.96Å; L530-R534 WeakPolarHBondContact O-CG 3.47Å; L530-R534 PolarHBondContact O-N 3.37Å
531M86.4Confident85.3Confident100 Ų100107.1 Ų107.149%0.49351%0.514SS..Hα-helixtrans-64.3-43.9175.3-73.5-81.4-84.900111.6E527 L528 R533 R534 I535E527-M531 WeakPolarHBondContact O-CB 3.42Å; E527-M531 VanDerWaalsContact O-CG 3.26Å; E527-M531 WeakPolarHBondContact O-CG 3.49Å; E527-M531 PolarHBondContact O-N 3.31Å; L528-M531 PolarHBondContact O-N 3.34Å; M531-R533 VanDerWaalsContact C-N 3.35Å; M531-R533 PolarHBondContact O-N 2.87Å; M531-R534 PolarHBondContact O-N 2.99Å; M531-I535 VanDerWaalsContact O-CG1 3.31Å; M531-I535 WeakPolarHBondContact O-CG1 3.5Å; M531-I535 PolarHBondContact O-N 3.23Å
532R84.6Confident84.1Confident163 Ų163106 Ų10662%0.61551%0.508SS*.Hα-helixtrans-59.8-43.6174.8-76.1173.6-174.6-84.11.9111.4L528 E529 I535 N536L528-R532 WeakPolarHBondContact O-CB 3.29Å; L528-R532 WeakPolarHBondContact O-CG 3.48Å; L528-R532 PolarHBondContact O-N 2.93Å; E529-R532 PolarHBondContact O-N 3.32Å; R532-I535 PolarHBondContact O-N 2.91Å; R532-N536 WeakPolarHBondContact O-CB 3.36Å; R532-N536 PolarHBondContact O-N 2.98Å; R532-N536 PolarHBondContact O-ND2 3.44Å
533R80.9Confident83.1Confident134 Ų134104.1 Ų104.151%0.50651%0.506SS..Hα-helixtrans-60.7-49.7174-72.7175.8-168.9172.47.4111E529 L530 M531 I535 N536 F537E529-R533 WeakPolarHBondContact O-CG 3.5Å; E529-R533 PolarHBondContact O-N 2.92Å; E529-R533 IonicContact OE1-CZ 2.87Å; E529-R533 IonicContact OE1-NE 3.75Å; E529-R533 IonicContact OE1-NH2 2.8Å; E529-R533 PolarHBondContact OE1-NH2 3.42Å; L530-R533 PolarHBondContact O-N 2.96Å; M531-R533 VanDerWaalsContact C-N 3.35Å; M531-R533 PolarHBondContact O-N 2.87Å; R533-I535 VanDerWaalsContact C-N 3.35Å; R533-I535 PolarHBondContact O-N 3.22Å; R533-N536 PolarHBondContact O-N 3.31Å; R533-F537 WeakPolarHBondContact O-CD2 3.45Å; R533-F537 PolarHBondContact O-N 2.98Å
534R87.1Confident81.8Confident178 Ų178104 Ų10467%0.67251%0.506SS*.Hα-helixtrans-57-45177.5-75.1172.862.8-170.7-1.1112.7L530 M531 F537 T538L530-R534 WeakPolarHBondContact O-CG 3.47Å; L530-R534 PolarHBondContact O-N 3.37Å; M531-R534 PolarHBondContact O-N 2.99Å; R534-F537 PolarHBondContact O-N 3.05Å; R534-T538 PolarHBondContact O-N 3.36Å; R534-T538 PolarHBondContact O-OG1 3.01Å
535I80.5Confident80.4Confident93 Ų93102 Ų10248%0.47750%0.501SS..Hα-helixtrans-63.7-46177.2-69.2168.5000110.5M531 R532 R533 F537 T538 V541M531-I535 VanDerWaalsContact O-CG1 3.31Å; M531-I535 WeakPolarHBondContact O-CG1 3.5Å; M531-I535 PolarHBondContact O-N 3.23Å; R532-I535 PolarHBondContact O-N 2.91Å; R533-I535 VanDerWaalsContact C-N 3.35Å; R533-I535 PolarHBondContact O-N 3.22Å; I535-F537 PolarHBondContact O-N 3.37Å; I535-T538 WeakPolarHBondContact CA-OG1 3.47Å; I535-T538 VanDerWaalsContact O-CB 3.24Å; I535-T538 WeakPolarHBondContact O-CB 3.47Å; I535-T538 PolarHBondContact O-N 2.84Å; I535-T538 PolarHBondContact O-OG1 3.22Å; I535-V541 HydrophobicContact CG2-CG2 4.07Å
536N76.3Confident79Confident81 Ų81103.3 Ų103.343%0.43350%0.504SS..Hα-helixtrans-62.4-28.5179.1-82-28.5000113.7R532 R533R532-N536 WeakPolarHBondContact O-CB 3.36Å; R532-N536 PolarHBondContact O-N 2.98Å; R532-N536 PolarHBondContact O-ND2 3.44Å; R533-N536 PolarHBondContact O-N 3.31Å
537F75.8Confident77.4Confident164 Ų164104.5 Ų104.572%0.71951%0.505SS*.THydrogen-bonded Turntrans-89.61.2174.2-71.1-68000113.9R533 R534 I535R533-F537 WeakPolarHBondContact O-CD2 3.45Å; R533-F537 PolarHBondContact O-N 2.98Å; R534-F537 PolarHBondContact O-N 3.05Å; I535-F537 PolarHBondContact O-N 3.37Å
538T79.7Confident75.5Confident61 Ų61104 Ų10437%0.37450%0.503SS..SBendtrans-72.5124176.7-52.50000108.6R534 I535 A540 V541 I542R534-T538 PolarHBondContact O-N 3.36Å; R534-T538 PolarHBondContact O-OG1 3.01Å; I535-T538 WeakPolarHBondContact CA-OG1 3.47Å; I535-T538 VanDerWaalsContact O-CB 3.24Å; I535-T538 WeakPolarHBondContact O-CB 3.47Å; I535-T538 PolarHBondContact O-N 2.84Å; I535-T538 PolarHBondContact O-OG1 3.22Å; T538-A540 HydrophobicContact CG2-CB 4.47Å; T538-A540 PolarHBondContact O-N 3.02Å; T538-V541 PolarHBondContact O-N 3.04Å; T538-I542 PolarHBondContact O-N 3.35Å
539P74.8Confident73.9Confident97 Ų97105 Ų10563%0.6351%0.512SS*.Hα-helixtrans-58.4-28.7-172.217.9-29.8000113.6I542 Q543P539-I542 PolarHBondContact O-N 3.44Å; P539-Q543 PolarHBondContact O-N 3.06Å
540A74.4Confident72.1Confident63 Ų63107 Ų10752%0.52152%0.523SS..Hα-helixtrans-62.8-41.4173.400000113T538 Q543 E544T538-A540 HydrophobicContact CG2-CB 4.47Å; T538-A540 PolarHBondContact O-N 3.02Å; A540-Q543 PolarHBondContact O-N 2.87Å; A540-E544 WeakPolarHBondContact O-CB 3.37Å; A540-E544 PolarHBondContact O-N 2.9Å
541V71.4Confident70.1Confident35 Ų35104.4 Ų104.421%0.21251%0.513CS..Hα-helixtrans-72.2-33178.9179.60000111I535 T538 E544 K545I535-V541 HydrophobicContact CG2-CG2 4.07Å; T538-V541 PolarHBondContact O-N 3.04Å; V541-E544 PolarHBondContact O-N 3.3Å; V541-K545 WeakPolarHBondContact O-CG 3.45Å; V541-K545 PolarHBondContact O-N 3Å
542I69.6Low68.4Low73 Ų73106.2 Ų106.237%0.37453%0.525SS..Hα-helixtrans-65.7-49.4173.9-60.1169.5000109.6T538 P539 E544 K545 E546T538-I542 PolarHBondContact O-N 3.35Å; P539-I542 PolarHBondContact O-N 3.44Å; I542-E544 VanDerWaalsContact C-N 3.31Å; I542-E544 PolarHBondContact O-N 3.47Å; I542-K545 PolarHBondContact O-N 3.44Å; I542-E546 WeakPolarHBondContact O-CG 3.49Å; I542-E546 PolarHBondContact O-N 3.01Å
543Q72.2Confident66.6Low122 Ų122107.4 Ų107.457%0.5753%0.534SS*.Hα-helixtrans-60.2-38.6173.1-93.9-176.5-14.600112.6P539 A540 E546 L547P539-Q543 PolarHBondContact O-N 3.06Å; A540-Q543 PolarHBondContact O-N 2.87Å; Q543-E546 PolarHBondContact O-N 2.87Å; Q543-L547 VanDerWaalsContact O-CB 3.27Å; Q543-L547 WeakPolarHBondContact O-CB 3.44Å; Q543-L547 VanDerWaalsContact O-CG 3.22Å; Q543-L547 WeakPolarHBondContact O-CG 3.4Å; Q543-L547 PolarHBondContact O-N 3.27Å
544E66.9Low64.8Low105 Ų105105.5 Ų105.549%0.49154%0.541SS..Hα-helixtrans-66.4-39.1177.8-171.7172.9-176.800111.7A540 V541 I542 E546 L547 Q548A540-E544 WeakPolarHBondContact O-CB 3.37Å; A540-E544 PolarHBondContact O-N 2.9Å; V541-E544 PolarHBondContact O-N 3.3Å; I542-E544 VanDerWaalsContact C-N 3.31Å; I542-E544 PolarHBondContact O-N 3.47Å; E544-E546 VanDerWaalsContact C-N 3.35Å; E544-L547 PolarHBondContact O-N 2.95Å; E544-Q548 VanDerWaalsContact O-CB 3.31Å; E544-Q548 WeakPolarHBondContact O-CB 3.48Å; E544-Q548 PolarHBondContact O-N 2.98Å
545K64.7Low62.1Low118 Ų118104.6 Ų104.651%0.51355%0.545SS..Hα-helixtrans-64-40172.2-77.8-178.9-179.9173.90111.7V541 I542 V549V541-K545 WeakPolarHBondContact O-CG 3.45Å; V541-K545 PolarHBondContact O-N 3Å; I542-K545 PolarHBondContact O-N 3.44Å; K545-V549 VanDerWaalsContact O-CG2 3.31Å; K545-V549 WeakPolarHBondContact O-CG2 3.41Å; K545-V549 PolarHBondContact O-N 3.04Å
546E64Low59.7Low120 Ų120106.3 Ų106.356%0.56156%0.56SS**Hα-helixtrans-64.8-42.7174.5-70.3176.2171.100111.6I542 Q543 E544 V549 M550I542-E546 WeakPolarHBondContact O-CG 3.49Å; I542-E546 PolarHBondContact O-N 3.01Å; Q543-E546 PolarHBondContact O-N 2.87Å; E544-E546 VanDerWaalsContact C-N 3.35Å; E546-V549 PolarHBondContact O-N 3.42Å; E546-M550 PolarHBondContact O-N 2.8Å
547L58.1Low57.5Low102 Ų102107.3 Ų107.353%0.53457%0.573SS.*Hα-helixtrans-73.3-33.3179.5-72.8169.6000112.6Q543 E544 V549 M550 S551Q543-L547 VanDerWaalsContact O-CB 3.27Å; Q543-L547 WeakPolarHBondContact O-CB 3.44Å; Q543-L547 VanDerWaalsContact O-CG 3.22Å; Q543-L547 WeakPolarHBondContact O-CG 3.4Å; Q543-L547 PolarHBondContact O-N 3.27Å; E544-L547 PolarHBondContact O-N 2.95Å; L547-V549 VanDerWaalsContact C-N 3.34Å; L547-M550 CarbonylContact O-C 3.57Å; L547-M550 WeakPolarHBondContact O-CA 3.38Å; L547-M550 PolarHBondContact O-N 3.1Å; L547-M550 VanDerWaalsContact O-N 3.12Å; L547-S551 WeakPolarHBondContact O-CB 3.3Å; L547-S551 PolarHBondContact O-N 3.44Å
548Q55.8Low55.2Low98 Ų98106.9 Ų106.946%0.45858%0.577SS.*Hα-helixtrans-68.6-33.1173.1-90.8169.71.600112E544 M550 S551 N552E544-Q548 VanDerWaalsContact O-CB 3.31Å; E544-Q548 WeakPolarHBondContact O-CB 3.48Å; E544-Q548 PolarHBondContact O-N 2.98Å; Q548-M550 PolarHBondContact O-N 3.08Å; Q548-S551 PolarHBondContact O-N 2.94Å; Q548-N552 WeakPolarHBondContact O-CB 3.48Å; Q548-N552 PolarHBondContact O-N 3.42Å; Q548-N552 VanDerWaalsContact O-N 3.16Å; Q548-N552 PolarHBondContact O-ND2 3.41Å
549V54.4Low53Low111 Ų111110 Ų11067%0.67360%0.599SS**Hα-helixtrans-65.3-30.4170.3172.10000111.1K545 E546 L547K545-V549 VanDerWaalsContact O-CG2 3.31Å; K545-V549 WeakPolarHBondContact O-CG2 3.41Å; K545-V549 PolarHBondContact O-N 3.04Å; E546-V549 PolarHBondContact O-N 3.42Å; L547-V549 VanDerWaalsContact C-N 3.34Å
550M49.2Very low50.6Low134 Ų134114.2 Ų114.266%0.6661%0.608SS**Hα-helixtrans-82.5-38.5174.4-70.4-177.443.900113.8E546 L547 Q548 K553E546-M550 PolarHBondContact O-N 2.8Å; L547-M550 CarbonylContact O-C 3.57Å; L547-M550 WeakPolarHBondContact O-CA 3.38Å; L547-M550 PolarHBondContact O-N 3.1Å; L547-M550 VanDerWaalsContact O-N 3.12Å; Q548-M550 PolarHBondContact O-N 3.08Å; M550-K553 PolarHBondContact O-N 3.06Å
551S45.9Very low48.7Very low41 Ų41113.9 Ų113.929%0.28761%0.61SS.*Hα-helixtrans-74.3-32.4-174.2-154.80000112.8L547 Q548 K553 S554 E555L547-S551 WeakPolarHBondContact O-CB 3.3Å; L547-S551 PolarHBondContact O-N 3.44Å; Q548-S551 PolarHBondContact O-N 2.94Å; S551-K553 PolarHBondContact O-N 2.91Å; S551-S554 PolarHBondContact O-N 3.47Å; S551-S554 VanDerWaalsContact O-N 3.15Å; S551-E555 PolarHBondContact OG-OE1 2.99Å; S551-E555 VanDerWaalsContact OG-OE1 3.07Å
552N49.5Very low47.1Very low138 Ų138119.8 Ų119.874%0.73864%0.639SS**THydrogen-bonded Turntrans-642.2175-71.1-19.9000114Q548Q548-N552 WeakPolarHBondContact O-CB 3.48Å; Q548-N552 PolarHBondContact O-N 3.42Å; Q548-N552 VanDerWaalsContact O-N 3.16Å; Q548-N552 PolarHBondContact O-ND2 3.41Å
553K48.4Very low45.9Very low188 Ų188122.9 Ų122.982%0.81765%0.652SS**THydrogen-bonded Turntrans-106.7-1.1174.4-76.1-175.7176.6177.10115.8M550 S551M550-K553 PolarHBondContact O-N 3.06Å; S551-K553 PolarHBondContact O-N 2.91Å
554S41.5Very low44.8Very low93 Ų93122.2 Ų122.265%0.6565%0.649SS**THydrogen-bonded Turntrans-143.21.8-174.849.50000118.5S551 T556S551-S554 PolarHBondContact O-N 3.47Å; S551-S554 VanDerWaalsContact O-N 3.15Å; S554-T556 PolarHBondContact O-N 3.32Å; S554-T556 VanDerWaalsContact O-N 3.12Å
555E30.7Very low44Very low159 Ų159122.2 Ų122.274%0.74366%0.656SS**  trans-88.974.3-178.9-73180177.600113.3S551S551-E555 PolarHBondContact OG-OE1 2.99Å; S551-E555 VanDerWaalsContact OG-OE1 3.07Å
556T30.7Very low43.2Very low130 Ų130121.9 Ų121.980%0.79866%0.664SS**  trans-134.5128.4154.9-36.40000108.9S554S554-T556 PolarHBondContact O-N 3.32Å; S554-T556 VanDerWaalsContact O-N 3.12Å
557S30.6Very low42.7Very low101 Ų101122.4 Ų122.471%0.70666%0.664SS**  trans100.2104.9164.277.30000118.9
558L26.9Very low42.4Very low156 Ų156124.4 Ų124.482%0.81767%0.666SS**  61.8163125.1-75.7140.5000118.1
559P33Very low42Very low127 Ų127127.8 Ų127.883%0.82568%0.679SS**  cis-133.4161.49.829-5.2000116.7
560F25.4Very low42.1Very low185 Ų185126 Ų12681%0.81168%0.676SS**  trans-95.6148.3-172.5-171.6-97.4000110.6
561G33.5Very low42.5Very low56 Ų56128.4 Ų128.458%0.57768%0.678SS**  trans12533.5145.800000121.7
562I39.1Very low43.1Very low158 Ų158132 Ų13281%0.8169%0.692SS**SBendtrans-124.5-12.4167-54.8179.6000114E564I562-E564 VanDerWaalsContact C-N 3.33Å; I562-E564 PolarHBondContact O-N 2.95Å
563E44.1Very low43.6Very low138 Ų138131.4 Ų131.465%0.64569%0.694SS**THydrogen-bonded Turntrans-84.7-3.4-176.2-141.2-172.2-138.400114.6K567E563-K567 IonicContact OE2-NZ 3.59Å; E563-K567 PolarHBondContact OE2-NZ 3.47Å
564E49.1Very low44.4Very low109 Ų109126.7 Ų126.751%0.50967%0.673SS.*Hα-helixtrans-80.7-24.4-167.2-135.4163.9-159.100113.4I562 Y568I562-E564 VanDerWaalsContact C-N 3.33Å; I562-E564 PolarHBondContact O-N 2.95Å; E564-Y568 HydrophobicContact CG-CE2 4.42Å; E564-Y568 WeakPolarHBondContact O-CD2 3.38Å; E564-Y568 WeakPolarHBondContact O-CE2 3.43Å
565T48.9Very low45.5Very low105 Ų105126.9 Ų126.964%0.64467%0.666SS**Hα-helixtrans-80.6-28.1-175.953.10000113.2
566T48.1Very low47Very low110 Ų110124 Ų12468%0.67566%0.661SS**Hα-helixtrans-79.5-24.2179.8-26.20000112.6
567K54.5Low48.7Very low132 Ų132125.1 Ų125.157%0.57466%0.655SS**Hα-helixtrans-72.3-24.2177-83.3170.9177.1152.30113.7E563 R571E563-K567 IonicContact OE2-NZ 3.59Å; E563-K567 PolarHBondContact OE2-NZ 3.47Å; K567-R571 PolarHBondContact O-N 3.24Å
568Y51Low50.7Low144 Ų144125 Ų12557%0.56564%0.641SS**Hα-helixtrans-67.5-39.2-179.2-80.8-77.3000113.3E564 R571E564-Y568 HydrophobicContact CG-CE2 4.42Å; E564-Y568 WeakPolarHBondContact O-CD2 3.38Å; E564-Y568 WeakPolarHBondContact O-CE2 3.43Å; Y568-R571 PolarHBondContact O-N 2.91Å
569F48.4Very low52.7Low169 Ų169120.8 Ų120.874%0.74162%0.622SS**Hα-helixtrans-73.8-35.4-179.4-78.4-76.3000113.2R571F569-R571 PolarHBondContact O-N 2.95Å
570A55.3Low54.5Low72 Ų72116.3 Ų116.360%0.59560%0.599SS**Hα-helixtrans-65.4-21.617400000112.8
571R58.6Low56.6Low186 Ų186111.6 Ų111.670%0.70258%0.579SS**Hα-helixtrans-78.3-28.6-175.5-156.5168.4-175.31750.5113.6K567 Y568 F569 I575K567-R571 PolarHBondContact O-N 3.24Å; Y568-R571 PolarHBondContact O-N 2.91Å; F569-R571 PolarHBondContact O-N 2.95Å; R571-I575 VanDerWaalsContact O-CG1 3.3Å; R571-I575 WeakPolarHBondContact O-CG1 3.37Å
572I58.4Low58.3Low115 Ų115113.2 Ų113.259%0.5957%0.574SS**Hα-helixtrans-77.3-39.8-174.8-66.4170.3000112F574 I575I572-F574 PolarHBondContact O-N 3.47Å; I572-I575 WeakPolarHBondContact O-CG1 3.43Å; I572-I575 PolarHBondContact O-N 3.46Å
573V60.4Low59.7Low127 Ų127112 Ų11277%0.7757%0.565SS**Hα-helixtrans-71.7-21.5179.7179.80000112.1
574F63.3Low60.9Low88 Ų88112.5 Ų112.539%0.38657%0.567SS.*Hα-helixtrans-77.1-23.7178.2-148-66.1000112.8I572 K577 K578I572-F574 PolarHBondContact O-N 3.47Å; F574-K577 HydrophobicContact CD1-CB 4.4Å; F574-K577 HydrophobicContact CE1-CB 4.22Å; F574-K577 PolarHBondContact O-N 2.92Å; F574-K577 VanDerWaalsContact O-N 3.13Å; F574-K578 HydrophobicContact CD1-CB 4Å; F574-K578 HydrophobicContact CD1-CD 3.08Å; F574-K578 HydrophobicContact CD1-CG 4.15Å; F574-K578 HydrophobicContact CE1-CB 4.4Å; F574-K578 HydrophobicContact CE1-CD 3.07Å; F574-K578 HydrophobicContact CE1-CG 4.35Å; F574-K578 HydrophobicContact CG-CD 4.23Å; F574-K578 HydrophobicContact CZ-CD 4.15Å; F574-K578 PolarHBondContact O-N 3.15Å
575I64.7Low61.9Low97 Ų97111 Ų11150%0.49757%0.569SS.*Hα-helixtrans-52.9-48.1-167.3-57.5175.6000113.3R571 I572 K577 K578 V579R571-I575 VanDerWaalsContact O-CG1 3.3Å; R571-I575 WeakPolarHBondContact O-CG1 3.37Å; I572-I575 WeakPolarHBondContact O-CG1 3.43Å; I572-I575 PolarHBondContact O-N 3.46Å; I575-K577 PolarHBondContact O-N 3.09Å; I575-K578 WeakPolarHBondContact O-CB 3.37Å; I575-K578 PolarHBondContact O-N 3.49Å; I575-V579 HydrophobicContact CG2-CG2 4.45Å; I575-V579 WeakPolarHBondContact O-CG2 3.43Å; I575-V579 PolarHBondContact O-N 3.46Å
576P62.2Low62.9Low99 Ų99110.5 Ų110.564%0.64356%0.562SS**Hα-helixtrans-68.1-36.7-178.2-20.534.1000113.8K578 V579 G580P576-K578 VanDerWaalsContact C-N 3.35Å; P576-V579 PolarHBondContact O-N 3.36Å; P576-G580 PolarHBondContact O-N 2.93Å
577K67.7Low63.9Low153 Ų153111.2 Ų111.267%0.66556%0.558SS**Hα-helixtrans-65.5-39.4172.2-84.9-172.8174.3-176.80111.3F574 I575 V579 G580 E581F574-K577 HydrophobicContact CD1-CB 4.4Å; F574-K577 HydrophobicContact CE1-CB 4.22Å; F574-K577 PolarHBondContact O-N 2.92Å; F574-K577 VanDerWaalsContact O-N 3.13Å; I575-K577 PolarHBondContact O-N 3.09Å; K577-V579 VanDerWaalsContact C-N 3.33Å; K577-V579 PolarHBondContact O-N 3.29Å; K577-G580 PolarHBondContact O-N 2.9Å; K577-E581 WeakPolarHBondContact O-CB 3.49Å; K577-E581 VanDerWaalsContact O-CG 3.3Å; K577-E581 WeakPolarHBondContact O-CG 3.27Å; K577-E581 PolarHBondContact O-N 2.83Å
578K71.1Confident64.6Low98 Ų98108.1 Ų108.143%0.42655%0.551SS.*Hα-helixtrans-61.2-42175-133.576.5-169.9158.30111.2F574 I575 P576 E581 I582F574-K578 HydrophobicContact CD1-CB 4Å; F574-K578 HydrophobicContact CD1-CD 3.08Å; F574-K578 HydrophobicContact CD1-CG 4.15Å; F574-K578 HydrophobicContact CE1-CB 4.4Å; F574-K578 HydrophobicContact CE1-CD 3.07Å; F574-K578 HydrophobicContact CE1-CG 4.35Å; F574-K578 HydrophobicContact CG-CD 4.23Å; F574-K578 HydrophobicContact CZ-CD 4.15Å; F574-K578 PolarHBondContact O-N 3.15Å; I575-K578 WeakPolarHBondContact O-CB 3.37Å; I575-K578 PolarHBondContact O-N 3.49Å; P576-K578 VanDerWaalsContact C-N 3.35Å; K578-E581 IonicContact NZ-OE2 3.97Å; K578-E581 PolarHBondContact NZ-OE2 3.01Å; K578-E581 PolarHBondContact O-N 3.23Å; K578-I582 HydrophobicContact CB-CD1 4.42Å; K578-I582 HydrophobicContact CG-CD1 4.29Å; K578-I582 VanDerWaalsContact O-CB 3.29Å; K578-I582 WeakPolarHBondContact O-CB 3.47Å; K578-I582 VanDerWaalsContact O-CD1 3.27Å; K578-I582 WeakPolarHBondContact O-CD1 3.45Å; K578-I582 WeakPolarHBondContact O-CG1 3.29Å; K578-I582 PolarHBondContact O-N 3.49Å
579V70.8Confident65.6Low68 Ų68104.7 Ų104.741%0.41255%0.545SS..Hα-helixtrans-65.1-44.9-179.31750000111.3I575 P576 K577 I582 E583I575-V579 HydrophobicContact CG2-CG2 4.45Å; I575-V579 WeakPolarHBondContact O-CG2 3.43Å; I575-V579 PolarHBondContact O-N 3.46Å; P576-V579 PolarHBondContact O-N 3.36Å; K577-V579 VanDerWaalsContact C-N 3.33Å; K577-V579 PolarHBondContact O-N 3.29Å; V579-I582 CarbonylContact O-C 3.5Å; V579-I582 WeakPolarHBondContact O-CB 3.35Å; V579-I582 PolarHBondContact O-N 3.47Å; V579-I582 VanDerWaalsContact O-N 3.15Å; V579-E583 PolarHBondContact O-N 3.06Å
580G69.9Low66.5Low33 Ų33101.6 Ų101.634%0.3454%0.535SS..Hα-helixtrans-66-38.4175.300000113.5P576 K577 I582 E583 Q584P576-G580 PolarHBondContact O-N 2.93Å; K577-G580 PolarHBondContact O-N 2.9Å; G580-I582 VanDerWaalsContact C-N 3.31Å; G580-E583 PolarHBondContact O-N 2.82Å; G580-Q584 PolarHBondContact O-N 3.35Å
581E69.6Low67.2Low86 Ų86107 Ų10740%0.40254%0.54SS..Hα-helixtrans-61.9-38.7170.1-76.3169.4-171.400111.3K577 K578 S585K577-E581 WeakPolarHBondContact O-CB 3.49Å; K577-E581 VanDerWaalsContact O-CG 3.3Å; K577-E581 WeakPolarHBondContact O-CG 3.27Å; K577-E581 PolarHBondContact O-N 2.83Å; K578-E581 IonicContact NZ-OE2 3.97Å; K578-E581 PolarHBondContact NZ-OE2 3.01Å; K578-E581 PolarHBondContact O-N 3.23Å; E581-S585 WeakPolarHBondContact O-CB 3.27Å; E581-S585 PolarHBondContact O-N 3.33Å; E581-S585 PolarHBondContact O-OG 3.01Å
582I69.9Low68.1Low91 Ų91102.3 Ų102.347%0.46753%0.529SS..Hα-helixtrans-67-44.4176.7-72.9159.3000110.4K578 V579 G580 S585 L586K578-I582 HydrophobicContact CB-CD1 4.42Å; K578-I582 HydrophobicContact CG-CD1 4.29Å; K578-I582 VanDerWaalsContact O-CB 3.29Å; K578-I582 WeakPolarHBondContact O-CB 3.47Å; K578-I582 VanDerWaalsContact O-CD1 3.27Å; K578-I582 WeakPolarHBondContact O-CD1 3.45Å; K578-I582 WeakPolarHBondContact O-CG1 3.29Å; K578-I582 PolarHBondContact O-N 3.49Å; V579-I582 CarbonylContact O-C 3.5Å; V579-I582 WeakPolarHBondContact O-CB 3.35Å; V579-I582 PolarHBondContact O-N 3.47Å; V579-I582 VanDerWaalsContact O-N 3.15Å; G580-I582 VanDerWaalsContact C-N 3.31Å; I582-S585 CarbonylContact O-C 3.6Å; I582-S585 WeakPolarHBondContact O-CA 3.45Å; I582-S585 WeakPolarHBondContact O-CB 3.44Å; I582-S585 PolarHBondContact O-N 2.93Å; I582-S585 VanDerWaalsContact O-N 3.14Å; I582-L586 WeakPolarHBondContact O-CB 3.41Å; I582-L586 PolarHBondContact O-N 3.2Å
583E67.2Low69.1Low132 Ų132102.4 Ų102.462%0.61753%0.527SS*.Hα-helixtrans-64.3-42.2178-76.2178.6162.800112.2V579 G580 S585 L586 Q587V579-E583 PolarHBondContact O-N 3.06Å; G580-E583 PolarHBondContact O-N 2.82Å; E583-S585 VanDerWaalsContact C-N 3.32Å; E583-L586 WeakPolarHBondContact O-CB 3.49Å; E583-L586 PolarHBondContact O-N 3.32Å; E583-L586 VanDerWaalsContact O-N 3.14Å; E583-Q587 PolarHBondContact O-N 2.86Å
584Q69.9Low70.1Confident149 Ų149101.9 Ų101.970%0.69652%0.52SS*.Hα-helixtrans-65.4-36.3170.4-81.5-175.86.300112.2G580 L586 Q587 P588G580-Q584 PolarHBondContact O-N 3.35Å; Q584-L586 PolarHBondContact O-N 2.91Å; Q584-Q587 PolarHBondContact O-N 3.12Å; Q584-P588 VanDerWaalsContact O-CD 3.28Å; Q584-P588 WeakPolarHBondContact O-CD 3.36Å
585S69.7Low71Confident78 Ų78102.7 Ų102.755%0.54553%0.525SS..Hα-helixtrans-72-15173.6-58.50000112.8E581 I582 E583 P588E581-S585 WeakPolarHBondContact O-CB 3.27Å; E581-S585 PolarHBondContact O-N 3.33Å; E581-S585 PolarHBondContact O-OG 3.01Å; I582-S585 CarbonylContact O-C 3.6Å; I582-S585 WeakPolarHBondContact O-CA 3.45Å; I582-S585 WeakPolarHBondContact O-CB 3.44Å; I582-S585 PolarHBondContact O-N 2.93Å; I582-S585 VanDerWaalsContact O-N 3.14Å; E583-S585 VanDerWaalsContact C-N 3.32Å; S585-P588 WeakPolarHBondContact O-CD 3.39Å; S585-P588 WeakPolarHBondContact O-CG 3.38Å
586L70.3Confident72Confident93 Ų93103.2 Ų103.249%0.48753%0.528SS..Hα-helixtrans-88.2-25.3176.5-135.580.5000112.5I582 E583 Q584 V589 L590I582-L586 WeakPolarHBondContact O-CB 3.41Å; I582-L586 PolarHBondContact O-N 3.2Å; E583-L586 WeakPolarHBondContact O-CB 3.49Å; E583-L586 PolarHBondContact O-N 3.32Å; E583-L586 VanDerWaalsContact O-N 3.14Å; Q584-L586 PolarHBondContact O-N 2.91Å; L586-V589 HydrophobicContact CD1-CG2 4.48Å; L586-V589 HydrophobicContact CG-CB 4.46Å; L586-V589 WeakPolarHBondContact O-CA 3.31Å; L586-V589 VanDerWaalsContact O-CB 3.24Å; L586-V589 WeakPolarHBondContact O-CB 3.46Å; L586-V589 PolarHBondContact O-N 3.46Å; L586-L590 PolarHBondContact O-N 3.19Å; L586-L590 VanDerWaalsContact O-N 3.13Å
587Q69.9Low73Confident126 Ų126102.1 Ų102.159%0.58952%0.52SS*.Hα-helixtrans-51.7-42.9172.6-84.9-167.3-10.600114.6E583 Q584 V589 L590 R591E583-Q587 PolarHBondContact O-N 2.86Å; Q584-Q587 PolarHBondContact O-N 3.12Å; Q587-V589 PolarHBondContact O-N 3.02Å; Q587-L590 PolarHBondContact O-N 2.85Å; Q587-R591 PolarHBondContact O-N 3.05Å
588P67.7Low73.9Confident67 Ų67102.1 Ų102.144%0.43552%0.515SS..Hα-helixtrans-66.9-24.2173.125.1-34.1000112.9Q584 S585 R591 N592Q584-P588 VanDerWaalsContact O-CD 3.28Å; Q584-P588 WeakPolarHBondContact O-CD 3.36Å; S585-P588 WeakPolarHBondContact O-CD 3.39Å; S585-P588 WeakPolarHBondContact O-CG 3.38Å; P588-R591 PolarHBondContact O-N 3.45Å; P588-N592 WeakPolarHBondContact O-CB 3.42Å; P588-N592 VanDerWaalsContact O-CG 3.27Å; P588-N592 PolarHBondContact O-N 3.17Å
589V71.6Confident74.7Confident72 Ų72101.7 Ų101.744%0.43652%0.517SS..Hα-helixtrans-69.7-40.2174.6-174.70000111.1L586 Q587 N592 E593L586-V589 HydrophobicContact CD1-CG2 4.48Å; L586-V589 HydrophobicContact CG-CB 4.46Å; L586-V589 WeakPolarHBondContact O-CA 3.31Å; L586-V589 VanDerWaalsContact O-CB 3.24Å; L586-V589 WeakPolarHBondContact O-CB 3.46Å; L586-V589 PolarHBondContact O-N 3.46Å; Q587-V589 PolarHBondContact O-N 3.02Å; V589-N592 WeakPolarHBondContact O-CA 3.41Å; V589-N592 WeakPolarHBondContact O-CB 3.48Å; V589-N592 PolarHBondContact O-N 2.98Å; V589-N592 VanDerWaalsContact O-N 3.16Å; V589-E593 PolarHBondContact O-N 3.49Å
590L67.7Low75.7Confident104 Ų104102.4 Ų102.455%0.54552%0.519SS..Hα-helixtrans-65.1-41.2173.8-71.8169000111.9L586 Q587 N592 E593 D594L586-L590 PolarHBondContact O-N 3.19Å; L586-L590 VanDerWaalsContact O-N 3.13Å; Q587-L590 PolarHBondContact O-N 2.85Å; L590-N592 PolarHBondContact O-N 3.42Å; L590-E593 PolarHBondContact O-N 3.02Å; L590-E593 VanDerWaalsContact O-N 3.14Å; L590-D594 PolarHBondContact O-N 3.02Å
591R70.2Confident76.7Confident184 Ų184105.5 Ų105.569%0.69453%0.527SS*.Hα-helixtrans-61.4-35.9171.4-71.6-171.5-173.6-1783.1112Q587 P588 E593 D594 E595Q587-R591 PolarHBondContact O-N 3.05Å; P588-R591 PolarHBondContact O-N 3.45Å; R591-E593 VanDerWaalsContact C-N 3.35Å; R591-D594 PolarHBondContact O-N 2.8Å; R591-E595 WeakPolarHBondContact O-CB 3.48Å; R591-E595 PolarHBondContact O-N 3.17Å
592N77.8Confident77.8Confident89 Ų89104.9 Ų104.948%0.47652%0.524SS..Hα-helixtrans-65.4-34.9174.2-79-11000112.3P588 V589 L590 E595 I596P588-N592 WeakPolarHBondContact O-CB 3.42Å; P588-N592 VanDerWaalsContact O-CG 3.27Å; P588-N592 PolarHBondContact O-N 3.17Å; V589-N592 WeakPolarHBondContact O-CA 3.41Å; V589-N592 WeakPolarHBondContact O-CB 3.48Å; V589-N592 PolarHBondContact O-N 2.98Å; V589-N592 VanDerWaalsContact O-N 3.16Å; L590-N592 PolarHBondContact O-N 3.42Å; N592-E595 PolarHBondContact O-N 3.38Å; N592-I596 VanDerWaalsContact O-CB 3.27Å; N592-I596 WeakPolarHBondContact O-CB 3.46Å; N592-I596 VanDerWaalsContact O-CD1 3.32Å; N592-I596 WeakPolarHBondContact O-CD1 3.45Å; N592-I596 WeakPolarHBondContact O-CG1 3.4Å; N592-I596 PolarHBondContact O-N 3.19Å
593E80Confident78.8Confident117 Ų117103.5 Ų103.555%0.54752%0.522SS..Hα-helixtrans-64-43.9175.2-76.1-174.1156.900111.9V589 L590 R591 E595 I596 T597V589-E593 PolarHBondContact O-N 3.49Å; L590-E593 PolarHBondContact O-N 3.02Å; L590-E593 VanDerWaalsContact O-N 3.14Å; R591-E593 VanDerWaalsContact C-N 3.35Å; E593-E595 VanDerWaalsContact C-N 3.34Å; E593-E595 PolarHBondContact O-N 3Å; E593-I596 PolarHBondContact O-N 3.42Å; E593-T597 WeakPolarHBondContact O-CG2 3.44Å; E593-T597 PolarHBondContact O-N 3.36Å; E593-T597 PolarHBondContact O-OG1 2.97Å
594D81.2Confident80Confident115 Ų115100.4 Ų100.462%0.61551%0.51SS*.Hα-helixtrans-63.2-40.5174.2-71.6-27.4000111.7L590 R591 T597 R598L590-D594 PolarHBondContact O-N 3.02Å; R591-D594 PolarHBondContact O-N 2.8Å; D594-T597 WeakPolarHBondContact CA-OG1 3.36Å; D594-T597 PolarHBondContact O-N 3.45Å; D594-T597 PolarHBondContact O-OG1 2.9Å; D594-R598 WeakPolarHBondContact O-CB 3.45Å; D594-R598 PolarHBondContact O-N 3.5Å
595E82.9Confident81Confident106 Ų10696.7 Ų96.750%0.49550%0.497SS..Hα-helixtrans-66.7-40.5176.4-163.7120.3-145.500111.6R591 N592 E593 R598 L599R591-E595 WeakPolarHBondContact O-CB 3.48Å; R591-E595 PolarHBondContact O-N 3.17Å; N592-E595 PolarHBondContact O-N 3.38Å; E593-E595 VanDerWaalsContact C-N 3.34Å; E593-E595 PolarHBondContact O-N 3Å; E595-R598 PolarHBondContact O-N 2.8Å; E595-L599 HydrophobicContact CG-CD1 4.3Å; E595-L599 WeakPolarHBondContact O-CB 3.4Å; E595-L599 VanDerWaalsContact O-CG 3.27Å; E595-L599 WeakPolarHBondContact O-CG 3.4Å; E595-L599 PolarHBondContact O-N 3.31Å
596I83.9Confident82.1Confident108 Ų108101.1 Ų101.155%0.55450%0.502SS*.Hα-helixtrans-63.3-44.8174.7-72.6162.7000110.4N592 E593 L599 N600N592-I596 VanDerWaalsContact O-CB 3.27Å; N592-I596 WeakPolarHBondContact O-CB 3.46Å; N592-I596 VanDerWaalsContact O-CD1 3.32Å; N592-I596 WeakPolarHBondContact O-CD1 3.45Å; N592-I596 WeakPolarHBondContact O-CG1 3.4Å; N592-I596 PolarHBondContact O-N 3.19Å; E593-I596 PolarHBondContact O-N 3.42Å; I596-L599 PolarHBondContact O-N 2.95Å; I596-N600 WeakPolarHBondContact O-CB 3.18Å; I596-N600 PolarHBondContact O-N 3.38Å
597T83.9Confident83.2Confident76 Ų76104 Ų10447%0.46651%0.507SS..Hα-helixtrans-65.5-40.1177.857.10000111.6E593 D594 N600 N601E593-T597 WeakPolarHBondContact O-CG2 3.44Å; E593-T597 PolarHBondContact O-N 3.36Å; E593-T597 PolarHBondContact O-OG1 2.97Å; D594-T597 WeakPolarHBondContact CA-OG1 3.36Å; D594-T597 PolarHBondContact O-N 3.45Å; D594-T597 PolarHBondContact O-OG1 2.9Å; T597-N600 PolarHBondContact O-N 2.92Å; T597-N601 WeakPolarHBondContact O-CB 3.43Å; T597-N601 VanDerWaalsContact O-CG 3.23Å; T597-N601 PolarHBondContact O-N 2.92Å; T597-N601 PolarHBondContact O-ND2 3.29Å
598R87.2Confident84.2Confident153 Ų153103.6 Ų103.658%0.57751%0.505SS*.Hα-helixtrans-61.8-50.4173.8-177.2-176.4157.6-177.8-6.7111.7D594 E595 N600 N601 E602D594-R598 WeakPolarHBondContact O-CB 3.45Å; D594-R598 PolarHBondContact O-N 3.5Å; E595-R598 PolarHBondContact O-N 2.8Å; R598-N600 VanDerWaalsContact C-N 3.27Å; R598-N600 PolarHBondContact O-N 3.3Å; R598-N601 PolarHBondContact O-N 3.36Å; R598-E602 IonicContact CZ-OE1 2.66Å; R598-E602 IonicContact NE-OE1 3.73Å; R598-E602 PolarHBondContact NE-OE1 3.35Å; R598-E602 IonicContact NH2-OE1 3.34Å; R598-E602 PolarHBondContact NH2-OE1 2.84Å; R598-E602 WeakPolarHBondContact O-CG 3.42Å; R598-E602 PolarHBondContact O-N 3.43Å
599L87.5Confident85.4Confident89 Ų89105 Ų10547%0.46651%0.505SS..Hα-helixtrans-61.8-35.8177.1-73.4172000111.8E595 I596 E602 C603E595-L599 HydrophobicContact CG-CD1 4.3Å; E595-L599 WeakPolarHBondContact O-CB 3.4Å; E595-L599 VanDerWaalsContact O-CG 3.27Å; E595-L599 WeakPolarHBondContact O-CG 3.4Å; E595-L599 PolarHBondContact O-N 3.31Å; I596-L599 PolarHBondContact O-N 2.95Å; L599-E602 PolarHBondContact O-N 3.32Å; L599-C603 WeakPolarHBondContact O-CB 3.33Å; L599-C603 PolarHBondContact O-N 3.27Å; L599-C603 PolarHBondContact O-SG 2.95Å
600N91.4Very high86.3Confident83 Ų83108.5 Ų108.544%0.44452%0.515SS..Hα-helixtrans-67.9-40.3175.7-169.850.3000111.9I596 T597 R598 C603 N604I596-N600 WeakPolarHBondContact O-CB 3.18Å; I596-N600 PolarHBondContact O-N 3.38Å; T597-N600 PolarHBondContact O-N 2.92Å; R598-N600 VanDerWaalsContact C-N 3.27Å; R598-N600 PolarHBondContact O-N 3.3Å; N600-C603 PolarHBondContact O-N 2.95Å; N600-N604 WeakPolarHBondContact O-CB 3.36Å; N600-N604 PolarHBondContact O-N 2.85Å; N600-N604 PolarHBondContact O-ND2 3.21Å
601N91.5Very high87.5Confident98 Ų98105.2 Ų105.252%0.52451%0.506SS..Hα-helixtrans-64.9-44.3173.3-70.7-20.5000111.4T597 R598 C603 N604 V605T597-N601 WeakPolarHBondContact O-CB 3.43Å; T597-N601 VanDerWaalsContact O-CG 3.23Å; T597-N601 PolarHBondContact O-N 2.92Å; T597-N601 PolarHBondContact O-ND2 3.29Å; R598-N601 PolarHBondContact O-N 3.36Å; N601-C603 PolarHBondContact O-N 3.05Å; N601-N604 WeakPolarHBondContact O-CB 3.44Å; N601-N604 PolarHBondContact O-N 3.13Å; N601-V605 WeakPolarHBondContact O-CG2 3.47Å; N601-V605 PolarHBondContact O-N 3.01Å
602E92.8Very high88.5Confident72 Ų72101.5 Ų101.534%0.33650%0.497SS..Hα-helixtrans-58.5-46.9172.7-72.6177.8-164.300110.3R598 L599 N604 V605 W606R598-E602 IonicContact CZ-OE1 2.66Å; R598-E602 IonicContact NE-OE1 3.73Å; R598-E602 PolarHBondContact NE-OE1 3.35Å; R598-E602 IonicContact NH2-OE1 3.34Å; R598-E602 PolarHBondContact NH2-OE1 2.84Å; R598-E602 WeakPolarHBondContact O-CG 3.42Å; R598-E602 PolarHBondContact O-N 3.43Å; L599-E602 PolarHBondContact O-N 3.32Å; E602-N604 VanDerWaalsContact C-N 3.3Å; E602-N604 PolarHBondContact O-N 2.73Å; E602-V605 PolarHBondContact O-N 3.11Å; E602-V605 VanDerWaalsContact O-N 3.16Å; E602-W606 PolarHBondContact O-N 3.05Å
603C89.9Confident89.1Confident62 Ų62101 Ų10142%0.41949%0.491SS..Hα-helixtrans-60.2-36175.2-75.60000113.3L599 N600 N601 R607L599-C603 WeakPolarHBondContact O-CB 3.33Å; L599-C603 PolarHBondContact O-N 3.27Å; L599-C603 PolarHBondContact O-SG 2.95Å; N600-C603 PolarHBondContact O-N 2.95Å; N601-C603 PolarHBondContact O-N 3.05Å; C603-R607 WeakPolarHBondContact O-CB 3.41Å; C603-R607 PolarHBondContact O-N 3.36Å
604N92.4Very high89.6Confident68 Ų68100.1 Ų100.136%0.36449%0.487SS..Hα-helixtrans-67.2-43174.6-71.2-28.4000111.5N600 N601 E602 R607 Q608N600-N604 WeakPolarHBondContact O-CB 3.36Å; N600-N604 PolarHBondContact O-N 2.85Å; N600-N604 PolarHBondContact O-ND2 3.21Å; N601-N604 WeakPolarHBondContact O-CB 3.44Å; N601-N604 PolarHBondContact O-N 3.13Å; E602-N604 VanDerWaalsContact C-N 3.3Å; E602-N604 PolarHBondContact O-N 2.73Å; N604-R607 PolarHBondContact O-N 2.93Å; N604-R607 PolarHBondContact OD1-NH2 3.47Å; N604-Q608 WeakPolarHBondContact O-CB 3.33Å; N604-Q608 PolarHBondContact O-N 3.38Å
605V92.4Very high90Very high70 Ų70101 Ų10142%0.42449%0.488SS..Hα-helixtrans-62.7-46.6174.6173.30000110.6N601 E602 R607 Q608 Q609N601-V605 WeakPolarHBondContact O-CG2 3.47Å; N601-V605 PolarHBondContact O-N 3.01Å; E602-V605 PolarHBondContact O-N 3.11Å; E602-V605 VanDerWaalsContact O-N 3.16Å; V605-R607 VanDerWaalsContact C-N 3.34Å; V605-R607 PolarHBondContact O-N 3.26Å; V605-Q608 PolarHBondContact O-N 2.98Å; V605-Q609 HydrophobicContact CG1-CG 4.3Å; V605-Q609 WeakPolarHBondContact O-CB 3.5Å; V605-Q609 WeakPolarHBondContact O-CG 3.24Å; V605-Q609 PolarHBondContact O-N 2.98Å
606W91.3Very high90.5Very high171 Ų171104.8 Ų104.865%0.64850%0.498SS*.Hα-helixtrans-60.1-42.2175.7-74.6114.7000112.1E602 F610E602-W606 PolarHBondContact O-N 3.05Å; W606-F610 VanDerWaalsContact O-CB 3.25Å; W606-F610 WeakPolarHBondContact O-CB 3.36Å; W606-F610 PolarHBondContact O-N 3.25Å
607R93.3Very high90.7Very high155 Ų155106 Ų10659%0.58550%0.495SS*.Hα-helixtrans-61.5-43.9174.1-89.9-172.4-73.1-112.3-1.2112.3C603 N604 V605 F610 G611C603-R607 WeakPolarHBondContact O-CB 3.41Å; C603-R607 PolarHBondContact O-N 3.36Å; N604-R607 PolarHBondContact O-N 2.93Å; N604-R607 PolarHBondContact OD1-NH2 3.47Å; V605-R607 VanDerWaalsContact C-N 3.34Å; V605-R607 PolarHBondContact O-N 3.26Å; R607-F610 PolarHBondContact O-N 2.87Å; R607-G611 PolarHBondContact O-N 3.25Å
608Q91.6Very high91Very high117 Ų117104.2 Ų104.255%0.54749%0.486SS..Hα-helixtrans-63.8-50177.9-178.4179.7-4.100111N604 V605 F610 G611 E612N604-Q608 WeakPolarHBondContact O-CB 3.33Å; N604-Q608 PolarHBondContact O-N 3.38Å; V605-Q608 PolarHBondContact O-N 2.98Å; Q608-F610 VanDerWaalsContact C-N 3.3Å; Q608-F610 PolarHBondContact O-N 2.88Å; Q608-G611 WeakPolarHBondContact O-CA 3.4Å; Q608-G611 PolarHBondContact O-N 2.77Å; Q608-G611 VanDerWaalsContact O-N 3.08Å; Q608-E612 HydrophobicContact CG-CG 4.46Å; Q608-E612 WeakPolarHBondContact CG-OE1 3.45Å; Q608-E612 PolarHBondContact NE2-OE1 3.12Å; Q608-E612 WeakPolarHBondContact O-CG 3.33Å; Q608-E612 PolarHBondContact O-N 2.96Å
609Q93Very high91.1Very high95 Ų95102 Ų10244%0.44449%0.485SS..Hα-helixtrans-59.3-40.6177.6-73178.1-500112V605 G611 E612 E613V605-Q609 HydrophobicContact CG1-CG 4.3Å; V605-Q609 WeakPolarHBondContact O-CB 3.5Å; V605-Q609 WeakPolarHBondContact O-CG 3.24Å; V605-Q609 PolarHBondContact O-N 2.98Å; Q609-G611 VanDerWaalsContact C-N 3.33Å; Q609-G611 PolarHBondContact O-N 2.74Å; Q609-E612 PolarHBondContact O-N 3.11Å; Q609-E613 VanDerWaalsContact O-CB 3.27Å; Q609-E613 WeakPolarHBondContact O-CB 3.27Å; Q609-E613 PolarHBondContact O-N 2.9Å
610F90.3Very high91.2Very high147 Ų147104 Ų10465%0.64549%0.492SS*.Hα-helixtrans-65.4-36.9176.1-169.2-95.8000112.3W606 R607 Q608 Q614W606-F610 VanDerWaalsContact O-CB 3.25Å; W606-F610 WeakPolarHBondContact O-CB 3.36Å; W606-F610 PolarHBondContact O-N 3.25Å; R607-F610 PolarHBondContact O-N 2.87Å; Q608-F610 VanDerWaalsContact C-N 3.3Å; Q608-F610 PolarHBondContact O-N 2.88Å; F610-Q614 HydrophobicContact CE1-CG 4.23Å; F610-Q614 WeakPolarHBondContact O-CB 3.37Å; F610-Q614 PolarHBondContact O-N 2.84Å
611G93Very high91.2Very high35 Ų35107.1 Ų107.136%0.36150%0.497SS..Hα-helixtrans-65.3-47.7172.800000112.8R607 Q608 Q609 E613 Q614 E615R607-G611 PolarHBondContact O-N 3.25Å; Q608-G611 WeakPolarHBondContact O-CA 3.4Å; Q608-G611 PolarHBondContact O-N 2.77Å; Q608-G611 VanDerWaalsContact O-N 3.08Å; Q609-G611 VanDerWaalsContact C-N 3.33Å; Q609-G611 PolarHBondContact O-N 2.74Å; G611-E613 PolarHBondContact O-N 2.97Å; G611-Q614 WeakPolarHBondContact O-CB 3.45Å; G611-Q614 PolarHBondContact O-N 3.28Å; G611-E615 PolarHBondContact O-N 2.68Å
612E90.6Very high91.2Very high106 Ų106108.5 Ų108.550%0.49550%0.499SS..Hα-helixtrans-62.6-40177.7-70.7173.1-17200112Q608 Q609 E615 R616Q608-E612 HydrophobicContact CG-CG 4.46Å; Q608-E612 WeakPolarHBondContact CG-OE1 3.45Å; Q608-E612 PolarHBondContact NE2-OE1 3.12Å; Q608-E612 WeakPolarHBondContact O-CG 3.33Å; Q608-E612 PolarHBondContact O-N 2.96Å; Q609-E612 PolarHBondContact O-N 3.11Å; E612-E615 PolarHBondContact O-N 3.33Å; E612-R616 PolarHBondContact O-N 3.48Å
613E91.7Very high91Very high77 Ų77108.4 Ų108.436%0.3651%0.506SS..Hα-helixtrans-67.1-38.8175.5-178.361.8-158.400111.9Q609 G611 R616 R617Q609-E613 VanDerWaalsContact O-CB 3.27Å; Q609-E613 WeakPolarHBondContact O-CB 3.27Å; Q609-E613 PolarHBondContact O-N 2.9Å; G611-E613 PolarHBondContact O-N 2.97Å; E613-R616 PolarHBondContact O-N 2.85Å; E613-R617 WeakPolarHBondContact O-CB 3.47Å; E613-R617 WeakPolarHBondContact O-CG 3.33Å; E613-R617 PolarHBondContact O-N 3.2Å; E613-R617 IonicContact OE1-CZ 2.83Å; E613-R617 IonicContact OE1-NE 3.46Å; E613-R617 PolarHBondContact OE1-NE 3.33Å; E613-R617 IonicContact OE1-NH2 3.68Å; E613-R617 PolarHBondContact OE1-NH2 3.49Å
614Q88.9Confident90.9Very high100 Ų100108.3 Ų108.347%0.46750%0.504SS..Hα-helixtrans-61.1-45.7171.1-91.6-87.614.600111.7F610 G611 R617 S618F610-Q614 HydrophobicContact CE1-CG 4.23Å; F610-Q614 WeakPolarHBondContact O-CB 3.37Å; F610-Q614 PolarHBondContact O-N 2.84Å; G611-Q614 WeakPolarHBondContact O-CB 3.45Å; G611-Q614 PolarHBondContact O-N 3.28Å; Q614-R617 PolarHBondContact O-N 3.42Å; Q614-S618 WeakPolarHBondContact O-CB 3.3Å; Q614-S618 PolarHBondContact O-N 2.96Å
615E91.3Very high90.8Very high134 Ų134108.5 Ų108.563%0.62651%0.51SS*.Hα-helixtrans-63-44.2176.2-73.8-149.9156.100111.8G611 E612 R617 S618 L619G611-E615 PolarHBondContact O-N 2.68Å; E612-E615 PolarHBondContact O-N 3.33Å; E615-R617 PolarHBondContact O-N 2.85Å; E615-S618 WeakPolarHBondContact O-CB 3.23Å; E615-S618 PolarHBondContact O-N 3.3Å; E615-S618 VanDerWaalsContact O-N 3.11Å; E615-S618 PolarHBondContact O-OG 2.94Å; E615-L619 WeakPolarHBondContact O-CG 3.25Å; E615-L619 PolarHBondContact O-N 3.46Å
616R91.7Very high90.7Very high185 Ų185110.1 Ų110.170%0.69851%0.513SS*.Hα-helixtrans-56.5-50.3174.2-100-174.1178.1155.41.7112.4E612 E613 S618 L619 E620E612-R616 PolarHBondContact O-N 3.48Å; E613-R616 PolarHBondContact O-N 2.85Å; R616-S618 PolarHBondContact O-N 2.94Å; R616-L619 PolarHBondContact O-N 2.95Å; R616-E620 WeakPolarHBondContact O-CB 3.35Å; R616-E620 PolarHBondContact O-N 3.23Å
617R89.1Confident90.6Very high132 Ų132107.1 Ų107.150%0.49851%0.506SS..Hα-helixtrans-62.9-31.1177.3-70.9178-175.1-163.2-2.3112.2E613 Q614 E615 R621E613-R617 WeakPolarHBondContact O-CB 3.47Å; E613-R617 WeakPolarHBondContact O-CG 3.33Å; E613-R617 PolarHBondContact O-N 3.2Å; E613-R617 IonicContact OE1-CZ 2.83Å; E613-R617 IonicContact OE1-NE 3.46Å; E613-R617 PolarHBondContact OE1-NE 3.33Å; E613-R617 IonicContact OE1-NH2 3.68Å; E613-R617 PolarHBondContact OE1-NH2 3.49Å; Q614-R617 PolarHBondContact O-N 3.42Å; E615-R617 PolarHBondContact O-N 2.85Å; R617-R621 WeakPolarHBondContact O-CB 3.35Å; R617-R621 VanDerWaalsContact O-CG 3.28Å; R617-R621 WeakPolarHBondContact O-CG 3.48Å; R617-R621 PolarHBondContact O-N 3.44Å; R617-R621 PolarHBondContact O-NE 3.37Å
618S90Very high90.4Very high40 Ų40105.1 Ų105.128%0.2850%0.504SS..Hα-helixtrans-71.7-39.4175.683.40000112.2Q614 E615 R616 K622Q614-S618 WeakPolarHBondContact O-CB 3.3Å; Q614-S618 PolarHBondContact O-N 2.96Å; E615-S618 WeakPolarHBondContact O-CB 3.23Å; E615-S618 PolarHBondContact O-N 3.3Å; E615-S618 VanDerWaalsContact O-N 3.11Å; E615-S618 PolarHBondContact O-OG 2.94Å; R616-S618 PolarHBondContact O-N 2.94Å; S618-K622 VanDerWaalsContact O-CG 3.32Å; S618-K622 WeakPolarHBondContact O-CG 3.4Å; S618-K622 PolarHBondContact O-N 3.21Å
619L89.7Confident90.4Very high106 Ų106105.1 Ų105.156%0.55550%0.503SS*.Hα-helixtrans-69.5-41175.6-74.8166.9000111.4E615 R616 K622 S623E615-L619 WeakPolarHBondContact O-CG 3.25Å; E615-L619 PolarHBondContact O-N 3.46Å; R616-L619 PolarHBondContact O-N 2.95Å; L619-K622 PolarHBondContact O-N 3.29Å; L619-S623 WeakPolarHBondContact O-CB 3.5Å; L619-S623 PolarHBondContact O-N 3.44Å
620E88.6Confident90.4Very high131 Ų131107 Ų10761%0.61251%0.51SS*.Hα-helixtrans-62.3-47.2175.1-171.6174.1-154.400110.9R616 K622 S623 T624R616-E620 WeakPolarHBondContact O-CB 3.35Å; R616-E620 PolarHBondContact O-N 3.23Å; E620-K622 VanDerWaalsContact C-N 3.31Å; E620-K622 PolarHBondContact O-N 2.93Å; E620-S623 WeakPolarHBondContact O-CB 3.32Å; E620-S623 PolarHBondContact O-N 3.22Å; E620-S623 VanDerWaalsContact O-N 3.15Å; E620-T624 WeakPolarHBondContact O-CG2 3.38Å; E620-T624 PolarHBondContact O-N 3.05Å; E620-T624 PolarHBondContact O-OG1 3.09Å
621R91.3Very high90.5Very high148 Ų148104 Ų10456%0.55850%0.498SS*.Hα-helixtrans-58.7-39.2173.8-78.8-178.9-116146.8-1.3113.1R617 T624 S625R617-R621 WeakPolarHBondContact O-CB 3.35Å; R617-R621 VanDerWaalsContact O-CG 3.28Å; R617-R621 WeakPolarHBondContact O-CG 3.48Å; R617-R621 PolarHBondContact O-N 3.44Å; R617-R621 PolarHBondContact O-NE 3.37Å; R621-T624 WeakPolarHBondContact CA-OG1 3.32Å; R621-T624 PolarHBondContact O-OG1 3.01Å; R621-T624 VanDerWaalsContact O-OG1 3.06Å; R621-S625 WeakPolarHBondContact O-CB 3.46Å; R621-S625 PolarHBondContact O-N 2.83Å
622K91.5Very high90.4Very high127 Ų127104.1 Ų104.155%0.55250%0.496SS*.Hα-helixtrans-65.1-46.8174.3-75.5174.2-179.7178.80111S618 L619 E620 T624 S625 E626S618-K622 VanDerWaalsContact O-CG 3.32Å; S618-K622 WeakPolarHBondContact O-CG 3.4Å; S618-K622 PolarHBondContact O-N 3.21Å; L619-K622 PolarHBondContact O-N 3.29Å; E620-K622 VanDerWaalsContact C-N 3.31Å; E620-K622 PolarHBondContact O-N 2.93Å; K622-T624 PolarHBondContact O-N 3.48Å; K622-S625 PolarHBondContact O-N 2.97Å; K622-E626 WeakPolarHBondContact O-CB 3.35Å; K622-E626 WeakPolarHBondContact O-CG 3.41Å; K622-E626 PolarHBondContact O-N 3.44Å
623S89.7Confident90.5Very high70 Ų70102 Ų10249%0.4949%0.488SS..Hα-helixtrans-60.9-44.6178.1-174.80000112.5L619 E620 E626 Q627L619-S623 WeakPolarHBondContact O-CB 3.5Å; L619-S623 PolarHBondContact O-N 3.44Å; E620-S623 WeakPolarHBondContact O-CB 3.32Å; E620-S623 PolarHBondContact O-N 3.22Å; E620-S623 VanDerWaalsContact O-N 3.15Å; S623-E626 PolarHBondContact O-N 3.15Å; S623-Q627 WeakPolarHBondContact O-CB 3.39Å; S623-Q627 PolarHBondContact O-N 2.94Å
624T88.2Confident90.6Very high60 Ų60103.3 Ų103.337%0.36850%0.498SS..Hα-helixtrans-67.8-38.517757.50000111.2E620 R621 K622 Q627 H628E620-T624 WeakPolarHBondContact O-CG2 3.38Å; E620-T624 PolarHBondContact O-N 3.05Å; E620-T624 PolarHBondContact O-OG1 3.09Å; R621-T624 WeakPolarHBondContact CA-OG1 3.32Å; R621-T624 PolarHBondContact O-OG1 3.01Å; R621-T624 VanDerWaalsContact O-OG1 3.06Å; K622-T624 PolarHBondContact O-N 3.48Å; T624-Q627 PolarHBondContact O-N 2.85Å; T624-H628 PolarHBondContact O-CD2 2.91Å; T624-H628 VanDerWaalsContact O-CG 3.32Å; T624-H628 PolarHBondContact O-N 3.43Å
625S89.1Confident90.8Very high72 Ų72104 Ų10450%0.50350%0.504SS..Hα-helixtrans-63.5-44.5175.4-172.70000112R621 K622 Q627 H628 E629R621-S625 WeakPolarHBondContact O-CB 3.46Å; R621-S625 PolarHBondContact O-N 2.83Å; K622-S625 PolarHBondContact O-N 2.97Å; S625-Q627 VanDerWaalsContact C-N 3.3Å; S625-Q627 PolarHBondContact O-N 3.36Å; S625-H628 PolarHBondContact O-N 3.31Å; S625-E629 WeakPolarHBondContact O-CB 3.32Å; S625-E629 PolarHBondContact O-N 3.42Å
626E91.2Very high91.1Very high105 Ų105105.2 Ų105.249%0.49150%0.503SS..Hα-helixtrans-64.2-35.7175.6-74.7174.8-161.500111.8K622 S623 E629 K630K622-E626 WeakPolarHBondContact O-CB 3.35Å; K622-E626 WeakPolarHBondContact O-CG 3.41Å; K622-E626 PolarHBondContact O-N 3.44Å; S623-E626 PolarHBondContact O-N 3.15Å; E626-E629 PolarHBondContact O-N 3.41Å; E626-K630 WeakPolarHBondContact O-CG 3.43Å; E626-K630 PolarHBondContact O-N 3.1Å
627Q89Confident91.1Very high107 Ų107101.8 Ų101.850%0.550%0.498SS..Hα-helixtrans-66.3-47.8175-176.8170.9-21.200111.6S623 T624 S625 E629 K630 E631S623-Q627 WeakPolarHBondContact O-CB 3.39Å; S623-Q627 PolarHBondContact O-N 2.94Å; T624-Q627 PolarHBondContact O-N 2.85Å; S625-Q627 VanDerWaalsContact C-N 3.3Å; S625-Q627 PolarHBondContact O-N 3.36Å; Q627-E629 VanDerWaalsContact C-N 3.26Å; Q627-E629 PolarHBondContact O-N 3.4Å; Q627-K630 PolarHBondContact O-N 2.94Å; Q627-E631 WeakPolarHBondContact CG-OE1 3.24Å; Q627-E631 PolarHBondContact NE2-OE1 2.99Å; Q627-E631 VanDerWaalsContact NE2-OE1 3.12Å; Q627-E631 WeakPolarHBondContact O-CG 3.28Å; Q627-E631 PolarHBondContact O-N 2.91Å
628H88.5Confident91.4Very high114 Ų11497.8 Ų97.853%0.52849%0.493SS..Hα-helixtrans-63.2-32.8175.4-65.6-43.3000112.6T624 S625 E631 A632T624-H628 PolarHBondContact O-CD2 2.91Å; T624-H628 VanDerWaalsContact O-CG 3.32Å; T624-H628 PolarHBondContact O-N 3.43Å; S625-H628 PolarHBondContact O-N 3.31Å; H628-E631 IonicContact ND1-OE2 3.36Å; H628-E631 PolarHBondContact ND1-OE2 3.44Å; H628-A632 WeakPolarHBondContact O-CB 3.36Å; H628-A632 PolarHBondContact O-N 3.32Å
629E92.5Very high91.4Very high116 Ų116100.3 Ų100.354%0.54250%0.502SS..Hα-helixtrans-67.6-41.1174.3-171.3177.2179.200111.9S625 E626 Q627 A632 N633S625-E629 WeakPolarHBondContact O-CB 3.32Å; S625-E629 PolarHBondContact O-N 3.42Å; E626-E629 PolarHBondContact O-N 3.41Å; Q627-E629 VanDerWaalsContact C-N 3.26Å; Q627-E629 PolarHBondContact O-N 3.4Å; E629-A632 PolarHBondContact O-N 2.91Å; E629-N633 WeakPolarHBondContact O-CB 3.26Å; E629-N633 PolarHBondContact O-N 3.35Å; E629-N633 PolarHBondContact O-ND2 3.48Å; E629-N633 VanDerWaalsContact O-ND2 3.1Å
630K92.3Very high91.6Very high134 Ų13498.9 Ų98.958%0.58350%0.498SS*.Hα-helixtrans-62.6-49.8173-73.2170.6-174.5171.20111.6E626 Q627 A632 N633 D634E626-K630 WeakPolarHBondContact O-CG 3.43Å; E626-K630 PolarHBondContact O-N 3.1Å; Q627-K630 PolarHBondContact O-N 2.94Å; K630-A632 VanDerWaalsContact C-N 3.28Å; K630-A632 PolarHBondContact O-N 2.84Å; K630-N633 WeakPolarHBondContact O-CB 3.44Å; K630-N633 PolarHBondContact O-N 2.84Å; K630-D634 PolarHBondContact O-N 3.03Å
631E92.3Very high91.8Very high84 Ų8496.3 Ų96.339%0.39349%0.494SS..Hα-helixtrans-57.7-42176.2-71.5168.4-17400111.2Q627 H628 N633 D634 L635Q627-E631 WeakPolarHBondContact CG-OE1 3.24Å; Q627-E631 PolarHBondContact NE2-OE1 2.99Å; Q627-E631 VanDerWaalsContact NE2-OE1 3.12Å; Q627-E631 WeakPolarHBondContact O-CG 3.28Å; Q627-E631 PolarHBondContact O-N 2.91Å; H628-E631 IonicContact ND1-OE2 3.36Å; H628-E631 PolarHBondContact ND1-OE2 3.44Å; E631-N633 PolarHBondContact O-N 2.88Å; E631-D634 PolarHBondContact O-N 3.46Å; E631-L635 WeakPolarHBondContact O-CB 3.44Å; E631-L635 VanDerWaalsContact O-CG 3.29Å; E631-L635 WeakPolarHBondContact O-CG 3.41Å; E631-L635 PolarHBondContact O-N 2.79Å
632A90.8Very high92Very high38 Ų3893.9 Ų93.931%0.31449%0.492SS..Hα-helixtrans-65.1-36.8175.200000112.7H628 E629 K630 R636H628-A632 WeakPolarHBondContact O-CB 3.36Å; H628-A632 PolarHBondContact O-N 3.32Å; E629-A632 PolarHBondContact O-N 2.91Å; K630-A632 VanDerWaalsContact C-N 3.28Å; K630-A632 PolarHBondContact O-N 2.84Å; A632-R636 WeakPolarHBondContact O-CB 3.44Å; A632-R636 VanDerWaalsContact O-CG 3.24Å; A632-R636 WeakPolarHBondContact O-CG 3.24Å; A632-R636 PolarHBondContact O-N 3.27Å
633N93Very high92.2Very high62 Ų6293.8 Ų93.833%0.33249%0.494SS..Hα-helixtrans-70.1-40.4176-71.5-30.3000111.9E629 K630 E631 R636 L637E629-N633 WeakPolarHBondContact O-CB 3.26Å; E629-N633 PolarHBondContact O-N 3.35Å; E629-N633 PolarHBondContact O-ND2 3.48Å; E629-N633 VanDerWaalsContact O-ND2 3.1Å; K630-N633 WeakPolarHBondContact O-CB 3.44Å; K630-N633 PolarHBondContact O-N 2.84Å; E631-N633 PolarHBondContact O-N 2.88Å; N633-R636 WeakPolarHBondContact O-CB 3.38Å; N633-R636 PolarHBondContact O-N 3.33Å; N633-R636 PolarHBondContact OD1-NH1 3Å; N633-L637 WeakPolarHBondContact O-CG 3.35Å; N633-L637 PolarHBondContact O-N 3.28Å
634D93Very high92.4Very high105 Ų10597.4 Ų97.456%0.56150%0.5SS*.Hα-helixtrans-63.9-42.6175.3-68.7-21000111.2K630 E631 R636 L637 A638K630-D634 PolarHBondContact O-N 3.03Å; E631-D634 PolarHBondContact O-N 3.46Å; D634-R636 PolarHBondContact O-N 3.26Å; D634-L637 PolarHBondContact O-N 3.49Å; D634-A638 PolarHBondContact O-N 3.33Å
635L95Very high92.6Very high114 Ų11498.5 Ų98.560%0.59750%0.501SS*.Hα-helixtrans-63.5-39.6173.8-72173.5000112.3E631 L637 A638 I639E631-L635 WeakPolarHBondContact O-CB 3.44Å; E631-L635 VanDerWaalsContact O-CG 3.29Å; E631-L635 WeakPolarHBondContact O-CG 3.41Å; E631-L635 PolarHBondContact O-N 2.79Å; L635-L637 VanDerWaalsContact C-N 3.34Å; L635-L637 PolarHBondContact O-N 3.29Å; L635-A638 PolarHBondContact O-N 2.9Å; L635-I639 WeakPolarHBondContact O-CB 3.44Å; L635-I639 VanDerWaalsContact O-CG1 3.24Å; L635-I639 WeakPolarHBondContact O-CG1 3.5Å; L635-I639 PolarHBondContact O-N 3.46Å
636R95.6Very high92.8Very high160 Ų16099.9 Ų99.960%0.60450%0.502SS*.Hα-helixtrans-62.2-40.3173.9-77169.6178.8159.3-1111.9A632 N633 D634 I639 T640A632-R636 WeakPolarHBondContact O-CB 3.44Å; A632-R636 VanDerWaalsContact O-CG 3.24Å; A632-R636 WeakPolarHBondContact O-CG 3.24Å; A632-R636 PolarHBondContact O-N 3.27Å; N633-R636 WeakPolarHBondContact O-CB 3.38Å; N633-R636 PolarHBondContact O-N 3.33Å; N633-R636 PolarHBondContact OD1-NH1 3Å; D634-R636 PolarHBondContact O-N 3.26Å; R636-I639 PolarHBondContact O-N 3.49Å; R636-T640 WeakPolarHBondContact O-CG2 3.39Å; R636-T640 PolarHBondContact O-N 2.93Å; R636-T640 PolarHBondContact O-OG1 3.33Å
637L92.7Very high92.9Very high113 Ų11396.4 Ų96.459%0.59249%0.494SS*.Hα-helixtrans-67.3-40.2175.2-70.5172.4000112N633 D634 L635 T640 S641N633-L637 WeakPolarHBondContact O-CG 3.35Å; N633-L637 PolarHBondContact O-N 3.28Å; D634-L637 PolarHBondContact O-N 3.49Å; L635-L637 VanDerWaalsContact C-N 3.34Å; L635-L637 PolarHBondContact O-N 3.29Å; L637-T640 PolarHBondContact O-N 2.91Å; L637-T640 PolarHBondContact O-OG1 2.88Å; L637-S641 WeakPolarHBondContact O-CB 3.38Å; L637-S641 PolarHBondContact O-N 3.19Å
638A94.9Very high93.2Very high48 Ų4896 Ų9640%0.39750%0.496SS..Hα-helixtrans-62.8-43174.700000111.7D634 L635 S641 L642D634-A638 PolarHBondContact O-N 3.33Å; L635-A638 PolarHBondContact O-N 2.9Å; A638-S641 PolarHBondContact O-N 3.06Å; A638-L642 WeakPolarHBondContact O-CG 3.39Å; A638-L642 PolarHBondContact O-N 2.67Å
639I91.5Very high93.4Very high92 Ų9298 Ų9847%0.47250%0.499SS..Hα-helixtrans-62-44.9176.1-70.3165.5000111L635 R636 S641 L642 Q643L635-I639 WeakPolarHBondContact O-CB 3.44Å; L635-I639 VanDerWaalsContact O-CG1 3.24Å; L635-I639 WeakPolarHBondContact O-CG1 3.5Å; L635-I639 PolarHBondContact O-N 3.46Å; R636-I639 PolarHBondContact O-N 3.49Å; I639-S641 VanDerWaalsContact C-N 3.35Å; I639-S641 PolarHBondContact O-N 3.49Å; I639-L642 PolarHBondContact O-N 3.22Å; I639-Q643 HydrophobicContact CG2-CG 4.26Å; I639-Q643 WeakPolarHBondContact O-CB 3.41Å; I639-Q643 VanDerWaalsContact O-CG 3.28Å; I639-Q643 WeakPolarHBondContact O-CG 3.31Å; I639-Q643 PolarHBondContact O-N 3.37Å
640T93.6Very high93.5Very high77 Ų7797.8 Ų97.847%0.47250%0.497SS..Hα-helixtrans-66.2-37178.855.10000112.3R636 L637 K644R636-T640 WeakPolarHBondContact O-CG2 3.39Å; R636-T640 PolarHBondContact O-N 2.93Å; R636-T640 PolarHBondContact O-OG1 3.33Å; L637-T640 PolarHBondContact O-N 2.91Å; L637-T640 PolarHBondContact O-OG1 2.88Å; T640-K644 PolarHBondContact O-N 2.92Å
641S93Very high93.6Very high76 Ų7695.8 Ų95.853%0.53150%0.497SS..Hα-helixtrans-61.7-47172.5-174.90000112.1L637 A638 I639 K644 E645L637-S641 WeakPolarHBondContact O-CB 3.38Å; L637-S641 PolarHBondContact O-N 3.19Å; A638-S641 PolarHBondContact O-N 3.06Å; I639-S641 VanDerWaalsContact C-N 3.35Å; I639-S641 PolarHBondContact O-N 3.49Å; S641-K644 PolarHBondContact O-N 3.45Å; S641-E645 PolarHBondContact O-N 3.39Å
642L94.6Very high93.8Very high97 Ų9797.9 Ų97.951%0.50850%0.504SS..Hα-helixtrans-67-39.5178.5-72.9172.8000112.1A638 I639 K644 E645 I646A638-L642 WeakPolarHBondContact O-CG 3.39Å; A638-L642 PolarHBondContact O-N 2.67Å; I639-L642 PolarHBondContact O-N 3.22Å; L642-K644 VanDerWaalsContact C-N 3.31Å; L642-K644 PolarHBondContact O-N 2.92Å; L642-E645 PolarHBondContact O-N 3.16Å; L642-I646 WeakPolarHBondContact O-CB 3.5Å; L642-I646 VanDerWaalsContact O-CG1 3.24Å; L642-I646 WeakPolarHBondContact O-CG1 3.48Å; L642-I646 PolarHBondContact O-N 2.91Å
643Q94.8Very high93.9Very high126 Ų126101 Ų10159%0.58952%0.515SS*.Hα-helixtrans-60.9-40.2174.5-77.5175.7-19.200112I639 I646 G647I639-Q643 HydrophobicContact CG2-CG 4.26Å; I639-Q643 WeakPolarHBondContact O-CB 3.41Å; I639-Q643 VanDerWaalsContact O-CG 3.28Å; I639-Q643 WeakPolarHBondContact O-CG 3.31Å; I639-Q643 PolarHBondContact O-N 3.37Å; Q643-I646 PolarHBondContact O-N 3.17Å; Q643-G647 PolarHBondContact O-N 3.09Å
644K94.5Very high94Very high146 Ų146103.2 Ų103.264%0.63552%0.523SS*.Hα-helixtrans-63.8-46.7173.7-174.8-173.4172.5-169.40111.6T640 S641 L642 I646 G647 D648T640-K644 PolarHBondContact O-N 2.92Å; S641-K644 PolarHBondContact O-N 3.45Å; L642-K644 VanDerWaalsContact C-N 3.31Å; L642-K644 PolarHBondContact O-N 2.92Å; K644-I646 VanDerWaalsContact C-N 3.32Å; K644-I646 PolarHBondContact O-N 2.9Å; K644-G647 PolarHBondContact O-N 2.87Å; K644-G647 VanDerWaalsContact O-N 3.15Å; K644-D648 PolarHBondContact O-N 3.47Å
645E93Very high94Very high82 Ų82101.3 Ų101.338%0.38352%0.518SS..Hα-helixtrans-62.6-38178.1-170.4-178.817100112.2S641 L642 D648 R649S641-E645 PolarHBondContact O-N 3.39Å; L642-E645 PolarHBondContact O-N 3.16Å; E645-D648 PolarHBondContact O-N 2.9Å; E645-R649 WeakPolarHBondContact O-CB 3.24Å; E645-R649 VanDerWaalsContact O-CG 3.26Å; E645-R649 WeakPolarHBondContact O-CG 3.47Å; E645-R649 PolarHBondContact O-N 3.34Å; E645-R649 IonicContact OE1-CZ 3.3Å; E645-R649 IonicContact OE1-NE 2.69Å; E645-R649 PolarHBondContact OE1-NE 3.44Å; E645-R649 IonicContact OE1-NH2 3.99Å; E645-R649 PolarHBondContact OE1-NH2 3.29Å
646I92.5Very high93.9Very high101 Ų101100.1 Ų100.152%0.51851%0.51SS..Hα-helixtrans-62.4-45.3172.7-70.1165.7000110.3L642 Q643 K644 R649 Q650L642-I646 WeakPolarHBondContact O-CB 3.5Å; L642-I646 VanDerWaalsContact O-CG1 3.24Å; L642-I646 WeakPolarHBondContact O-CG1 3.48Å; L642-I646 PolarHBondContact O-N 2.91Å; Q643-I646 PolarHBondContact O-N 3.17Å; K644-I646 VanDerWaalsContact C-N 3.32Å; K644-I646 PolarHBondContact O-N 2.9Å; I646-R649 PolarHBondContact O-N 3.19Å; I646-Q650 WeakPolarHBondContact O-CB 3.42Å; I646-Q650 PolarHBondContact O-N 2.97Å
647G94.4Very high93.8Very high32 Ų3295.7 Ų95.733%0.3350%0.501SS..Hα-helixtrans-58.7-46.9175.300000112.9Q643 K644 R649 Q650 V651Q643-G647 PolarHBondContact O-N 3.09Å; K644-G647 PolarHBondContact O-N 2.87Å; K644-G647 VanDerWaalsContact O-N 3.15Å; G647-R649 VanDerWaalsContact C-N 3.34Å; G647-R649 PolarHBondContact O-N 2.88Å; G647-Q650 PolarHBondContact O-N 3.05Å; G647-V651 WeakPolarHBondContact O-CG2 3.44Å; G647-V651 PolarHBondContact O-N 3.16Å
648D93.8Very high93.8Very high100 Ų10096.1 Ų96.154%0.53550%0.499SS..Hα-helixtrans-62.3-40.2177.5-68.5-23.9000111.6K644 E645 F652K644-D648 PolarHBondContact O-N 3.47Å; E645-D648 PolarHBondContact O-N 2.9Å; D648-F652 PolarHBondContact O-N 2.66Å
649R93.4Very high93.8Very high156 Ų15698.5 Ų98.559%0.58950%0.501SS*.Hα-helixtrans-66.6-36.8174.8-73176.2-175-158.24.5112.2E645 I646 G647 F652 I653E645-R649 WeakPolarHBondContact O-CB 3.24Å; E645-R649 VanDerWaalsContact O-CG 3.26Å; E645-R649 WeakPolarHBondContact O-CG 3.47Å; E645-R649 PolarHBondContact O-N 3.34Å; E645-R649 IonicContact OE1-CZ 3.3Å; E645-R649 IonicContact OE1-NE 2.69Å; E645-R649 PolarHBondContact OE1-NE 3.44Å; E645-R649 IonicContact OE1-NH2 3.99Å; E645-R649 PolarHBondContact OE1-NH2 3.29Å; I646-R649 PolarHBondContact O-N 3.19Å; G647-R649 VanDerWaalsContact C-N 3.34Å; G647-R649 PolarHBondContact O-N 2.88Å; R649-F652 PolarHBondContact O-N 2.95Å; R649-I653 WeakPolarHBondContact O-CG1 3.43Å; R649-I653 PolarHBondContact O-N 3.32Å
650Q94.7Very high93.8Very high110 Ų11098.5 Ų98.551%0.51450%0.501SS..Hα-helixtrans-68-43.9178.6-168.41480.300111.5I646 G647 F652 I653 E654I646-Q650 WeakPolarHBondContact O-CB 3.42Å; I646-Q650 PolarHBondContact O-N 2.97Å; G647-Q650 PolarHBondContact O-N 3.05Å; Q650-F652 VanDerWaalsContact C-N 3.28Å; Q650-F652 PolarHBondContact O-N 3Å; Q650-I653 PolarHBondContact O-N 3.44Å; Q650-I653 VanDerWaalsContact O-N 3.16Å; Q650-E654 WeakPolarHBondContact O-CG 3.49Å; Q650-E654 PolarHBondContact O-N 2.85Å
651V94.2Very high93.8Very high93 Ų9398.6 Ų98.656%0.56450%0.498SS*.Hα-helixtrans-59.6-39.5171.81730000111.5G647 E654 S655G647-V651 WeakPolarHBondContact O-CG2 3.44Å; G647-V651 PolarHBondContact O-N 3.16Å; V651-E654 PolarHBondContact O-N 3.34Å; V651-S655 PolarHBondContact O-N 3.37Å
652F97Very high93.8Very high127 Ų12798 Ų9856%0.55749%0.489SS*.Hα-helixtrans-64.3-43.2175.4-179.1-98.8000112.2D648 R649 Q650 S655 Q656D648-F652 PolarHBondContact O-N 2.66Å; R649-F652 PolarHBondContact O-N 2.95Å; Q650-F652 VanDerWaalsContact C-N 3.28Å; Q650-F652 PolarHBondContact O-N 3Å; F652-S655 PolarHBondContact O-N 3.01Å; F652-Q656 HydrophobicContact CD1-CG 4.19Å; F652-Q656 HydrophobicContact CE1-CG 3.77Å; F652-Q656 HydrophobicContact CE2-CG 4.4Å; F652-Q656 HydrophobicContact CZ-CG 3.89Å; F652-Q656 WeakPolarHBondContact O-CG 3.38Å; F652-Q656 PolarHBondContact O-N 2.86Å
653I92.9Very high93.8Very high103 Ų10396.3 Ų96.353%0.52848%0.48SS..Hα-helixtrans-61.8-45.4176.1-70166.4000110.5R649 Q650 S655 Q656 T657R649-I653 WeakPolarHBondContact O-CG1 3.43Å; R649-I653 PolarHBondContact O-N 3.32Å; Q650-I653 PolarHBondContact O-N 3.44Å; Q650-I653 VanDerWaalsContact O-N 3.16Å; I653-S655 VanDerWaalsContact C-N 3.3Å; I653-S655 PolarHBondContact O-N 3.45Å; I653-Q656 PolarHBondContact O-N 3.5Å; I653-Q656 VanDerWaalsContact O-N 3.09Å; I653-T657 HydrophobicContact CG2-CG2 4.32Å; I653-T657 PolarHBondContact O-N 2.9Å; I653-T657 PolarHBondContact O-OG1 2.74Å
654E94.7Very high93.6Very high109 Ų10995 Ų9551%0.50948%0.478SS..Hα-helixtrans-58.6-40.8176.4-73169.8-170.700112.2Q650 V651 T657 E658Q650-E654 WeakPolarHBondContact O-CG 3.49Å; Q650-E654 PolarHBondContact O-N 2.85Å; V651-E654 PolarHBondContact O-N 3.34Å; E654-T657 WeakPolarHBondContact CA-OG1 3.4Å; E654-T657 PolarHBondContact O-N 3.29Å; E654-T657 PolarHBondContact O-OG1 2.98Å; E654-E658 PolarHBondContact O-N 3.46Å
655S92.3Very high93.6Very high66 Ų6695.6 Ų95.646%0.46248%0.476SS..Hα-helixtrans-65.6-38.4174.4178.70000112.6V651 F652 I653 K659V651-S655 PolarHBondContact O-N 3.37Å; F652-S655 PolarHBondContact O-N 3.01Å; I653-S655 VanDerWaalsContact C-N 3.3Å; I653-S655 PolarHBondContact O-N 3.45Å; S655-K659 PolarHBondContact O-N 3.24Å; S655-K659 VanDerWaalsContact O-N 3.15Å
656Q94.8Very high93.6Very high89 Ų8995.9 Ų95.942%0.41648%0.477SS..Hα-helixtrans-71.3-38.2177-66.3-62.7-41.300112.1F652 I653 K659 I660F652-Q656 HydrophobicContact CD1-CG 4.19Å; F652-Q656 HydrophobicContact CE1-CG 3.77Å; F652-Q656 HydrophobicContact CE2-CG 4.4Å; F652-Q656 HydrophobicContact CZ-CG 3.89Å; F652-Q656 WeakPolarHBondContact O-CG 3.38Å; F652-Q656 PolarHBondContact O-N 2.86Å; I653-Q656 PolarHBondContact O-N 3.5Å; I653-Q656 VanDerWaalsContact O-N 3.09Å; Q656-K659 WeakPolarHBondContact O-CB 3.32Å; Q656-K659 PolarHBondContact O-N 2.87Å; Q656-I660 WeakPolarHBondContact O-CG1 3.43Å; Q656-I660 PolarHBondContact O-N 3.4Å
657T91.6Very high93.5Very high67 Ų6793.9 Ų93.941%0.41147%0.47SS..Hα-helixtrans-66.2-39.1176.349.50000111.5I653 E654 K659 I660 N661I653-T657 HydrophobicContact CG2-CG2 4.32Å; I653-T657 PolarHBondContact O-N 2.9Å; I653-T657 PolarHBondContact O-OG1 2.74Å; E654-T657 WeakPolarHBondContact CA-OG1 3.4Å; E654-T657 PolarHBondContact O-N 3.29Å; E654-T657 PolarHBondContact O-OG1 2.98Å; T657-K659 VanDerWaalsContact C-N 3.32Å; T657-K659 PolarHBondContact O-N 2.76Å; T657-I660 PolarHBondContact O-N 3.31Å; T657-N661 WeakPolarHBondContact O-CB 3.18Å; T657-N661 PolarHBondContact O-N 3.36Å; T657-N661 PolarHBondContact O-ND2 2.84Å
658E94Very high93.5Very high121 Ų12194 Ų9457%0.56547%0.471SS*.Hα-helixtrans-59.8-42.4171-172.3176.9-159.500111.6E654 I660 N661 D662E654-E658 PolarHBondContact O-N 3.46Å; E658-I660 VanDerWaalsContact C-N 3.35Å; E658-I660 PolarHBondContact O-N 2.89Å; E658-N661 WeakPolarHBondContact O-CB 3.23Å; E658-N661 PolarHBondContact O-N 2.94Å; E658-D662 PolarHBondContact O-N 3.08Å
659K95.2Very high93.3Very high99 Ų9992.7 Ų92.743%0.4347%0.469SS..Hα-helixtrans-63.6-38.9177.3-175.757.6178.71770112.9S655 Q656 T657 D662 L663S655-K659 PolarHBondContact O-N 3.24Å; S655-K659 VanDerWaalsContact O-N 3.15Å; Q656-K659 WeakPolarHBondContact O-CB 3.32Å; Q656-K659 PolarHBondContact O-N 2.87Å; T657-K659 VanDerWaalsContact C-N 3.32Å; T657-K659 PolarHBondContact O-N 2.76Å; K659-D662 PolarHBondContact O-N 3.05Å; K659-L663 WeakPolarHBondContact O-CG 3.48Å; K659-L663 PolarHBondContact O-N 2.86Å; K659-L663 VanDerWaalsContact O-N 3.13Å
660I90.7Very high93.1Very high92 Ų9288.9 Ų88.947%0.47246%0.46SS..Hα-helixtrans-64.4-46.2174.4-69166000109.8Q656 T657 E658 D662 L663 D664Q656-I660 WeakPolarHBondContact O-CG1 3.43Å; Q656-I660 PolarHBondContact O-N 3.4Å; T657-I660 PolarHBondContact O-N 3.31Å; E658-I660 VanDerWaalsContact C-N 3.35Å; E658-I660 PolarHBondContact O-N 2.89Å; I660-D662 VanDerWaalsContact C-N 3.28Å; I660-D662 PolarHBondContact O-N 2.87Å; I660-L663 CarbonylContact O-C 3.59Å; I660-L663 WeakPolarHBondContact O-CB 3.39Å; I660-L663 PolarHBondContact O-N 2.85Å; I660-D664 PolarHBondContact O-N 2.99Å
661N93.7Very high92.9Very high78 Ų7892.3 Ų92.342%0.41747%0.469SS..Hα-helixtrans-59.1-38177.3-69.3-28000112.4T657 E658 D664 R665T657-N661 WeakPolarHBondContact O-CB 3.18Å; T657-N661 PolarHBondContact O-N 3.36Å; T657-N661 PolarHBondContact O-ND2 2.84Å; E658-N661 WeakPolarHBondContact O-CB 3.23Å; E658-N661 PolarHBondContact O-N 2.94Å; N661-D664 PolarHBondContact O-N 3.39Å; N661-R665 WeakPolarHBondContact O-CG 3.43Å; N661-R665 PolarHBondContact O-N 3.48Å
662D94Very high92.6Very high64 Ų6491.7 Ų91.734%0.34247%0.465SS..Hα-helixtrans-66.1-39.6173.9-79.9-10.3000113.1E658 K659 I660 D664 R665 Q666E658-D662 PolarHBondContact O-N 3.08Å; K659-D662 PolarHBondContact O-N 3.05Å; I660-D662 VanDerWaalsContact C-N 3.28Å; I660-D662 PolarHBondContact O-N 2.87Å; D662-D664 VanDerWaalsContact C-N 3.35Å; D662-R665 PolarHBondContact O-N 3.15Å; D662-R665 IonicContact OD1-NH1 2.81Å; D662-R665 PolarHBondContact OD1-NH1 3.39Å; D662-Q666 WeakPolarHBondContact O-CG 3.24Å; D662-Q666 PolarHBondContact O-N 2.89Å
663L92.5Very high92.2Very high62 Ų6290.3 Ų90.333%0.32546%0.46SS..Hα-helixtrans-66-39.6174.2-70.7172.8000111K659 I660 Q666 V667K659-L663 WeakPolarHBondContact O-CG 3.48Å; K659-L663 PolarHBondContact O-N 2.86Å; K659-L663 VanDerWaalsContact O-N 3.13Å; I660-L663 CarbonylContact O-C 3.59Å; I660-L663 WeakPolarHBondContact O-CB 3.39Å; I660-L663 PolarHBondContact O-N 2.85Å; L663-Q666 WeakPolarHBondContact O-CB 3.41Å; L663-Q666 PolarHBondContact O-N 3.15Å; L663-V667 VanDerWaalsContact O-CG2 3.31Å; L663-V667 WeakPolarHBondContact O-CG2 3.35Å; L663-V667 PolarHBondContact O-N 2.91Å
664D92.1Very high91.4Very high99 Ų9989 Ų8953%0.52946%0.455SS..Hα-helixtrans-64.4-39.3175.5-79.9-28.5000112.1I660 N661 D662 V667 G668I660-D664 PolarHBondContact O-N 2.99Å; N661-D664 PolarHBondContact O-N 3.39Å; D662-D664 VanDerWaalsContact C-N 3.35Å; D664-V667 PolarHBondContact O-N 3.24Å; D664-G668 PolarHBondContact O-N 3.03Å
665R93.8Very high90.8Very high157 Ų15786.2 Ų86.259%0.59245%0.45SS*.Hα-helixtrans-60.5-44.5170.8-71.8173.7-169.7113.35.6111.9N661 D662 G668 S669N661-R665 WeakPolarHBondContact O-CG 3.43Å; N661-R665 PolarHBondContact O-N 3.48Å; D662-R665 PolarHBondContact O-N 3.15Å; D662-R665 IonicContact OD1-NH1 2.81Å; D662-R665 PolarHBondContact OD1-NH1 3.39Å; R665-G668 PolarHBondContact O-N 3.34Å; R665-S669 PolarHBondContact O-N 3.06Å
666Q94Very high90Very high88 Ų8889.1 Ų89.141%0.41146%0.456SS..Hα-helixtrans-63.2-43.8176.6-73.6177.720.300111.9D662 L663 G668 S669 L670D662-Q666 WeakPolarHBondContact O-CG 3.24Å; D662-Q666 PolarHBondContact O-N 2.89Å; L663-Q666 WeakPolarHBondContact O-CB 3.41Å; L663-Q666 PolarHBondContact O-N 3.15Å; Q666-G668 VanDerWaalsContact C-N 3.32Å; Q666-G668 PolarHBondContact O-N 3.43Å; Q666-S669 PolarHBondContact O-N 3.38Å; Q666-L670 WeakPolarHBondContact O-CG 3.37Å; Q666-L670 PolarHBondContact O-N 3.49Å
667V90.3Very high89.1Confident60 Ų6089.3 Ų89.336%0.36446%0.46SS..Hα-helixtrans-63.6-40176170.80000110.6L663 D664 L670 R671L663-V667 VanDerWaalsContact O-CG2 3.31Å; L663-V667 WeakPolarHBondContact O-CG2 3.35Å; L663-V667 PolarHBondContact O-N 2.91Å; D664-V667 PolarHBondContact O-N 3.24Å; V667-L670 PolarHBondContact O-N 3.02Å; V667-R671 HydrophobicContact CG1-CG 4.44Å; V667-R671 WeakPolarHBondContact O-CB 3.46Å; V667-R671 VanDerWaalsContact O-CG 3.27Å; V667-R671 WeakPolarHBondContact O-CG 3.35Å; V667-R671 PolarHBondContact O-N 3.39Å
668G93.1Very high88.3Confident34 Ų3493.5 Ų93.535%0.35147%0.468SS..Hα-helixtrans-56.6-50.2172.300000112.2D664 R665 Q666 L670 R671 T672D664-G668 PolarHBondContact O-N 3.03Å; R665-G668 PolarHBondContact O-N 3.34Å; Q666-G668 VanDerWaalsContact C-N 3.32Å; Q666-G668 PolarHBondContact O-N 3.43Å; G668-L670 PolarHBondContact O-N 3.34Å; G668-R671 WeakPolarHBondContact O-CB 3.39Å; G668-R671 PolarHBondContact O-N 2.84Å; G668-R671 VanDerWaalsContact O-N 3.15Å; G668-T672 PolarHBondContact O-N 2.96Å
669S90.8Very high87.2Confident73 Ų7395 Ų9551%0.5148%0.475SS..Hα-helixtrans-63.1-39.3177.4-171.70000113.1R665 Q666 R671 T672 E673R665-S669 PolarHBondContact O-N 3.06Å; Q666-S669 PolarHBondContact O-N 3.38Å; S669-R671 VanDerWaalsContact C-N 3.3Å; S669-R671 PolarHBondContact O-N 3.27Å; S669-T672 WeakPolarHBondContact CA-OG1 3.29Å; S669-T672 PolarHBondContact O-N 2.64Å; S669-T672 PolarHBondContact O-OG1 2.94Å; S669-E673 WeakPolarHBondContact O-CB 3.24Å; S669-E673 PolarHBondContact O-N 3.48Å
670L89Confident85.7Confident76 Ų7695.5 Ų95.540%0.39848%0.481SS..Hα-helixtrans-68.7-30.4175.6-72172.6000112Q666 V667 G668 N674Q666-L670 WeakPolarHBondContact O-CG 3.37Å; Q666-L670 PolarHBondContact O-N 3.49Å; V667-L670 PolarHBondContact O-N 3.02Å; G668-L670 PolarHBondContact O-N 3.34Å; L670-N674 VanDerWaalsContact O-CB 3.3Å; L670-N674 WeakPolarHBondContact O-CB 3.48Å; L670-N674 PolarHBondContact O-N 2.86Å; L670-N674 PolarHBondContact O-ND2 2.95Å
671R91.1Very high84.5Confident182 Ų18295.2 Ų95.269%0.68748%0.484SS*.Hα-helixtrans-70.2-41.3174.1-76.8174.4179.6-179.73.2111.5V667 G668 S669 N674 A675V667-R671 HydrophobicContact CG1-CG 4.44Å; V667-R671 WeakPolarHBondContact O-CB 3.46Å; V667-R671 VanDerWaalsContact O-CG 3.27Å; V667-R671 WeakPolarHBondContact O-CG 3.35Å; V667-R671 PolarHBondContact O-N 3.39Å; G668-R671 WeakPolarHBondContact O-CB 3.39Å; G668-R671 PolarHBondContact O-N 2.84Å; G668-R671 VanDerWaalsContact O-N 3.15Å; S669-R671 VanDerWaalsContact C-N 3.3Å; S669-R671 PolarHBondContact O-N 3.27Å; R671-N674 PolarHBondContact O-N 3.43Å; R671-A675 WeakPolarHBondContact O-CB 3.45Å; R671-A675 PolarHBondContact O-N 3.31Å
672T86.1Confident83.3Confident79 Ų7999.1 Ų99.149%0.48550%0.497SS..Hα-helixtrans-65.4-45.7175.654.40000111.2G668 S669 N674 A675 E676G668-T672 PolarHBondContact O-N 2.96Å; S669-T672 WeakPolarHBondContact CA-OG1 3.29Å; S669-T672 PolarHBondContact O-N 2.64Å; S669-T672 PolarHBondContact O-OG1 2.94Å; T672-N674 PolarHBondContact O-N 2.8Å; T672-A675 WeakPolarHBondContact O-CB 3.28Å; T672-A675 PolarHBondContact O-N 3.37Å; T672-E676 WeakPolarHBondContact O-CG 3.39Å; T672-E676 PolarHBondContact O-N 3.02Å
673E89.7Confident81.7Confident99 Ų9999.2 Ų99.246%0.46350%0.503SS..Hα-helixtrans-60.4-42.8175.8-173.7-179-173.100111.8S669 A675 E676 L677S669-E673 WeakPolarHBondContact O-CB 3.24Å; S669-E673 PolarHBondContact O-N 3.48Å; E673-A675 VanDerWaalsContact C-N 3.31Å; E673-A675 PolarHBondContact O-N 3.26Å; E673-E676 PolarHBondContact O-N 3.44Å; E673-L677 HydrophobicContact CG-CD1 4.42Å; E673-L677 WeakPolarHBondContact O-CB 3.49Å; E673-L677 WeakPolarHBondContact O-CG 3.42Å; E673-L677 PolarHBondContact O-N 3.35Å
674N75.2Confident80.3Confident76 Ų76101.1 Ų101.141%0.40651%0.514SS..Hα-helixtrans-64.6-34.3173.9-90.4-70.8000112.9L670 R671 T672 R678L670-N674 VanDerWaalsContact O-CB 3.3Å; L670-N674 WeakPolarHBondContact O-CB 3.48Å; L670-N674 PolarHBondContact O-N 2.86Å; L670-N674 PolarHBondContact O-ND2 2.95Å; R671-N674 PolarHBondContact O-N 3.43Å; T672-N674 PolarHBondContact O-N 2.8Å; N674-R678 WeakPolarHBondContact O-CB 3.38Å; N674-R678 WeakPolarHBondContact O-CG 3.39Å; N674-R678 PolarHBondContact O-N 2.84Å
675A82Confident79.1Confident50 Ų5098.2 Ų98.241%0.41351%0.507SS..Hα-helixtrans-66.8-42.5175.800000111.1R671 T672 E673 R678 Q679R671-A675 WeakPolarHBondContact O-CB 3.45Å; R671-A675 PolarHBondContact O-N 3.31Å; T672-A675 WeakPolarHBondContact O-CB 3.28Å; T672-A675 PolarHBondContact O-N 3.37Å; E673-A675 VanDerWaalsContact C-N 3.31Å; E673-A675 PolarHBondContact O-N 3.26Å; A675-R678 PolarHBondContact O-N 2.91Å; A675-Q679 WeakPolarHBondContact O-CG 3.49Å; A675-Q679 PolarHBondContact O-N 2.99Å
676E77.4Confident77.9Confident127 Ų12794.8 Ų94.859%0.59350%0.5SS*.Hα-helixtrans-63-47.3174.8-70.3175-176.200111.9T672 E673 R678 Q679 L680T672-E676 WeakPolarHBondContact O-CG 3.39Å; T672-E676 PolarHBondContact O-N 3.02Å; E673-E676 PolarHBondContact O-N 3.44Å; E676-R678 VanDerWaalsContact C-N 3.3Å; E676-R678 PolarHBondContact O-N 3.15Å; E676-Q679 PolarHBondContact O-N 3.12Å; E676-Q679 VanDerWaalsContact O-N 3.08Å; E676-L680 PolarHBondContact O-N 2.85Å
677L75.2Confident77Confident93 Ų9394.7 Ų94.749%0.48750%0.502SS..Hα-helixtrans-58.8-42.2175.5-75.3172.5000111.7E673 Q679 L680 T681E673-L677 HydrophobicContact CG-CD1 4.42Å; E673-L677 WeakPolarHBondContact O-CB 3.49Å; E673-L677 WeakPolarHBondContact O-CG 3.42Å; E673-L677 PolarHBondContact O-N 3.35Å; L677-Q679 VanDerWaalsContact C-N 3.34Å; L677-Q679 PolarHBondContact O-N 3.04Å; L677-L680 PolarHBondContact O-N 2.98Å; L677-T681 PolarHBondContact O-N 3.41Å; L677-T681 PolarHBondContact O-OG1 3.47Å
678R74.6Confident76.3Confident155 Ų15596.4 Ų96.459%0.58551%0.513SS*.Hα-helixtrans-63.9-35.9175.1-77.9171.8176.8166.9-0.3112.6N674 A675 E676 K682N674-R678 WeakPolarHBondContact O-CB 3.38Å; N674-R678 WeakPolarHBondContact O-CG 3.39Å; N674-R678 PolarHBondContact O-N 2.84Å; A675-R678 PolarHBondContact O-N 2.91Å; E676-R678 VanDerWaalsContact C-N 3.3Å; E676-R678 PolarHBondContact O-N 3.15Å; R678-K682 WeakPolarHBondContact O-CG 3.49Å; R678-K682 PolarHBondContact O-N 3.33Å
679Q70.1Confident75.6Confident152 Ų152100.2 Ų100.271%0.7152%0.524SS*.Hα-helixtrans-66.7-44.1173.2-71.5-146.86.600111.4A675 E676 L677 T681 K682 S683A675-Q679 WeakPolarHBondContact O-CG 3.49Å; A675-Q679 PolarHBondContact O-N 2.99Å; E676-Q679 PolarHBondContact O-N 3.12Å; E676-Q679 VanDerWaalsContact O-N 3.08Å; L677-Q679 VanDerWaalsContact C-N 3.34Å; L677-Q679 PolarHBondContact O-N 3.04Å; Q679-T681 VanDerWaalsContact C-N 3.29Å; Q679-T681 PolarHBondContact O-N 2.79Å; Q679-K682 PolarHBondContact O-N 2.88Å; Q679-S683 PolarHBondContact O-N 3.36Å; Q679-S683 PolarHBondContact O-OG 2.88Å
680L63.7Low75.1Confident109 Ų109102.9 Ų102.957%0.57153%0.527SS*.Hα-helixtrans-61.7-34.4176.1-72169.2000112.9E676 L677E676-L680 PolarHBondContact O-N 2.85Å; L677-L680 PolarHBondContact O-N 2.98Å
681T67.1Low74.7Confident86 Ų86101.6 Ų101.653%0.52853%0.527SS..Iπ-helixtrans-73-32.9178.6-10.40000112.7L677 Q679L677-T681 PolarHBondContact O-N 3.41Å; L677-T681 PolarHBondContact O-OG1 3.47Å; Q679-T681 VanDerWaalsContact C-N 3.29Å; Q679-T681 PolarHBondContact O-N 2.79Å
682K66.5Low74.5Confident160 Ų16097.1 Ų97.170%0.69651%0.514SS*.Iπ-helixtrans-77.1-31.2-174.9-77.3178.4-179.4-177.50113.8R678 Q679R678-K682 WeakPolarHBondContact O-CG 3.49Å; R678-K682 PolarHBondContact O-N 3.33Å; Q679-K682 PolarHBondContact O-N 2.88Å
683S60.6Low74.4Confident67 Ų6798.6 Ų98.647%0.46952%0.517SS..Iπ-helixtrans-97.4-26.8-168.8550000116Q679Q679-S683 PolarHBondContact O-N 3.36Å; Q679-S683 PolarHBondContact O-OG 2.88Å
684N63.5Low74.4Confident101 Ų10196.3 Ų96.354%0.5452%0.515SS..Iπ-helixtrans-117.1-45-166-66.9-18.9000114.7V688N684-V688 WeakPolarHBondContact O-CB 3.27Å; N684-V688 WeakPolarHBondContact O-CG2 3.34Å
685G67.4Low75.1Confident38 Ų3898.6 Ų98.639%0.39252%0.522SS..Iπ-helixtrans-79.8-48.6-170.400000113.8V688 L689G685-V688 PolarHBondContact O-N 3.41Å; G685-L689 WeakPolarHBondContact O-CB 3.43Å; G685-L689 VanDerWaalsContact O-CG 3.31Å; G685-L689 WeakPolarHBondContact O-CG 3.41Å; G685-L689 PolarHBondContact O-N 3.3Å
686I68.5Low75.5Confident85 Ų85101.5 Ų101.544%0.43653%0.53SS..Hα-helixtrans-68.1-40.8-173.5-64.9174.8000110.9L689 K690I686-L689 PolarHBondContact O-N 3.01Å; I686-K690 HydrophobicContact CG2-CD 4.04Å; I686-K690 HydrophobicContact CG2-CG 4.38Å; I686-K690 WeakPolarHBondContact O-CB 3.49Å; I686-K690 VanDerWaalsContact O-CG 3.27Å; I686-K690 WeakPolarHBondContact O-CG 3.37Å; I686-K690 PolarHBondContact O-N 3.09Å
687D74.1Confident76.2Confident87 Ų87100.2 Ų100.247%0.46553%0.527SS..Hα-helixtrans-72.1-34.2-178.6-65.9-28.1000112.1K690 A691D687-K690 IonicContact OD1-NZ 3.54Å; D687-A691 WeakPolarHBondContact O-CB 3.33Å; D687-A691 PolarHBondContact O-N 2.81Å
688V76Confident77Confident96 Ų96100.4 Ų100.458%0.58253%0.529SS*.Hα-helixtrans-65.6-45.3171.4171.70000111.1N684 G685 A691 E692N684-V688 WeakPolarHBondContact O-CB 3.27Å; N684-V688 WeakPolarHBondContact O-CG2 3.34Å; G685-V688 PolarHBondContact O-N 3.41Å; V688-A691 PolarHBondContact O-N 2.85Å; V688-E692 WeakPolarHBondContact O-CB 3.4Å; V688-E692 PolarHBondContact O-N 3.3Å
689L78.1Confident77.8Confident114 Ų11495.8 Ų95.860%0.59752%0.523SS*.Hα-helixtrans-65-40.5177.7-72173.8000112G685 I686 A691 E692 I693G685-L689 WeakPolarHBondContact O-CB 3.43Å; G685-L689 VanDerWaalsContact O-CG 3.31Å; G685-L689 WeakPolarHBondContact O-CG 3.41Å; G685-L689 PolarHBondContact O-N 3.3Å; I686-L689 PolarHBondContact O-N 3.01Å; L689-A691 VanDerWaalsContact C-N 3.35Å; L689-E692 PolarHBondContact O-N 3.07Å; L689-I693 VanDerWaalsContact O-CG1 3.28Å; L689-I693 WeakPolarHBondContact O-CG1 3.41Å; L689-I693 PolarHBondContact O-N 3.44Å
690K80.2Confident78.8Confident129 Ų12992.9 Ų92.956%0.56151%0.512SS*.Hα-helixtrans-61.2-43.5173.6-77.3173.7-179.3170.80111.8I686 D687 E692 I693 A694I686-K690 HydrophobicContact CG2-CD 4.04Å; I686-K690 HydrophobicContact CG2-CG 4.38Å; I686-K690 WeakPolarHBondContact O-CB 3.49Å; I686-K690 VanDerWaalsContact O-CG 3.27Å; I686-K690 WeakPolarHBondContact O-CG 3.37Å; I686-K690 PolarHBondContact O-N 3.09Å; D687-K690 IonicContact OD1-NZ 3.54Å; K690-E692 VanDerWaalsContact C-N 3.31Å; K690-E692 PolarHBondContact O-N 3.03Å; K690-I693 PolarHBondContact O-N 2.72Å; K690-A694 WeakPolarHBondContact O-CB 3.49Å; K690-A694 PolarHBondContact O-N 2.72Å
691A81.1Confident80.1Confident48 Ų4893 Ų9340%0.39751%0.513SS..Hα-helixtrans-63.8-37.8176.600000111.9D687 V688 L689 A694 K695D687-A691 WeakPolarHBondContact O-CB 3.33Å; D687-A691 PolarHBondContact O-N 2.81Å; V688-A691 PolarHBondContact O-N 2.85Å; L689-A691 VanDerWaalsContact C-N 3.35Å; A691-A694 PolarHBondContact O-N 3.33Å; A691-K695 WeakPolarHBondContact O-CG 3.48Å; A691-K695 PolarHBondContact O-N 2.95Å
692E87.8Confident81.4Confident88 Ų8895.5 Ų95.541%0.41152%0.519SS..Hα-helixtrans-72.2-40178.4-162.562-166.200112.6V688 L689 K690 A694 K695 L696V688-E692 WeakPolarHBondContact O-CB 3.4Å; V688-E692 PolarHBondContact O-N 3.3Å; L689-E692 PolarHBondContact O-N 3.07Å; K690-E692 VanDerWaalsContact C-N 3.31Å; K690-E692 PolarHBondContact O-N 3.03Å; E692-A694 VanDerWaalsContact C-N 3.3Å; E692-A694 PolarHBondContact O-N 2.99Å; E692-K695 PolarHBondContact O-N 3.43Å; E692-K695 IonicContact OE2-NZ 3.74Å; E692-K695 PolarHBondContact OE2-NZ 3.44Å; E692-L696 WeakPolarHBondContact O-CG 3.47Å; E692-L696 PolarHBondContact O-N 3.28Å
693I84.5Confident82.5Confident110 Ų11090.5 Ų90.556%0.56450%0.504SS*.Hα-helixtrans-60.3-42172.6-70.1167.2000110.6L689 K690 L696 N697L689-I693 VanDerWaalsContact O-CG1 3.28Å; L689-I693 WeakPolarHBondContact O-CG1 3.41Å; L689-I693 PolarHBondContact O-N 3.44Å; K690-I693 PolarHBondContact O-N 2.72Å; I693-L696 PolarHBondContact O-N 2.88Å; I693-N697 PolarHBondContact O-N 3.24Å
694A88.5Confident83.9Confident51 Ų5191.9 Ų91.942%0.42150%0.503SS..Hα-helixtrans-59.9-47.4177.300000111.7K690 A691 E692 L696 N697 D698K690-A694 WeakPolarHBondContact O-CB 3.49Å; K690-A694 PolarHBondContact O-N 2.72Å; A691-A694 PolarHBondContact O-N 3.33Å; E692-A694 VanDerWaalsContact C-N 3.3Å; E692-A694 PolarHBondContact O-N 2.99Å; A694-L696 VanDerWaalsContact C-N 3.35Å; A694-L696 PolarHBondContact O-N 3.39Å; A694-N697 WeakPolarHBondContact O-CB 3.48Å; A694-N697 PolarHBondContact O-N 3.44Å; A694-D698 PolarHBondContact O-N 2.89Å
695K90.2Very high85.2Confident124 Ų12490.2 Ų90.254%0.53950%0.499SS..Hα-helixtrans-60.6-41.4176.3-68.1175.7-159.2157.80113.1A691 E692 N697 D698 A699A691-K695 WeakPolarHBondContact O-CG 3.48Å; A691-K695 PolarHBondContact O-N 2.95Å; E692-K695 PolarHBondContact O-N 3.43Å; E692-K695 IonicContact OE2-NZ 3.74Å; E692-K695 PolarHBondContact OE2-NZ 3.44Å; K695-N697 VanDerWaalsContact C-N 3.3Å; K695-D698 PolarHBondContact O-N 3.38Å; K695-A699 WeakPolarHBondContact O-CB 3.21Å; K695-A699 PolarHBondContact O-N 3.47Å
696L90.4Very high86.4Confident112 Ų11292.8 Ų92.859%0.58650%0.501SS*.Hα-helixtrans-64.5-37.8177.9-74.6171.4000111.4E692 I693 A694 L700E692-L696 WeakPolarHBondContact O-CG 3.47Å; E692-L696 PolarHBondContact O-N 3.28Å; I693-L696 PolarHBondContact O-N 2.88Å; A694-L696 VanDerWaalsContact C-N 3.35Å; A694-L696 PolarHBondContact O-N 3.39Å; L696-L700 WeakPolarHBondContact O-CB 3.24Å; L696-L700 PolarHBondContact O-N 2.93Å
697N91.6Very high87.5Confident99 Ų9992.8 Ų92.853%0.52950%0.501SS..Hα-helixtrans-66.9-41.6176.2-120.713.4000112.1I693 A694 K695 L700 L701I693-N697 PolarHBondContact O-N 3.24Å; A694-N697 WeakPolarHBondContact O-CB 3.48Å; A694-N697 PolarHBondContact O-N 3.44Å; K695-N697 VanDerWaalsContact C-N 3.3Å; N697-L700 WeakPolarHBondContact O-CB 3.41Å; N697-L700 PolarHBondContact O-N 3.32Å; N697-L701 PolarHBondContact O-N 3.49Å
698D92.3Very high88.2Confident98 Ų9893.2 Ų93.252%0.52450%0.503SS..Hα-helixtrans-63.1-45.3176-68.4-20.6000111A694 K695 L700 L701 E702A694-D698 PolarHBondContact O-N 2.89Å; K695-D698 PolarHBondContact O-N 3.38Å; D698-L700 VanDerWaalsContact C-N 3.3Å; D698-L700 PolarHBondContact O-N 3.02Å; D698-L701 WeakPolarHBondContact O-CB 3.48Å; D698-L701 PolarHBondContact O-N 3.26Å; D698-E702 PolarHBondContact O-N 2.97Å
699A91.8Very high89.1Confident57 Ų5796.3 Ų96.347%0.47150%0.504SS..Hα-helixtrans-62.4-36.5175.900000112.8K695 E702 S703K695-A699 WeakPolarHBondContact O-CB 3.21Å; K695-A699 PolarHBondContact O-N 3.47Å; A699-E702 PolarHBondContact O-N 2.95Å; A699-S703 PolarHBondContact O-N 3.4Å
700L91.9Very high89.8Confident91 Ų9195.2 Ų95.248%0.47650%0.498SS..Hα-helixtrans-64.5-46.7175.5-164.2105.6000110.9L696 N697 D698 E702 S703 H704L696-L700 WeakPolarHBondContact O-CB 3.24Å; L696-L700 PolarHBondContact O-N 2.93Å; N697-L700 WeakPolarHBondContact O-CB 3.41Å; N697-L700 PolarHBondContact O-N 3.32Å; D698-L700 VanDerWaalsContact C-N 3.3Å; D698-L700 PolarHBondContact O-N 3.02Å; L700-E702 VanDerWaalsContact C-N 3.32Å; L700-E702 PolarHBondContact O-N 3.48Å; L700-S703 PolarHBondContact O-N 2.86Å; L700-S703 PolarHBondContact O-OG 2.89Å; L700-H704 WeakPolarHBondContact CD2-NE2 3.43Å; L700-H704 PolarHBondContact O-CD2 2.9Å; L700-H704 PolarHBondContact O-N 3.31Å
701L90.6Very high90.3Very high113 Ų11393.1 Ų93.159%0.59249%0.493SS*.Hα-helixtrans-58.5-42.4175-83.5160.5000112.2N697 D698 S703 H704 S705N697-L701 PolarHBondContact O-N 3.49Å; D698-L701 WeakPolarHBondContact O-CB 3.48Å; D698-L701 PolarHBondContact O-N 3.26Å; L701-S703 PolarHBondContact O-N 3.26Å; L701-H704 PolarHBondContact O-N 3.4Å; L701-S705 PolarHBondContact O-N 3.2Å
702E93.9Very high90.7Very high137 Ų13798.5 Ų98.564%0.6451%0.507SS*.Hα-helixtrans-60.4-46.6175.8-140104.2-133.300111D698 A699 L700 H704 S705 E706D698-E702 PolarHBondContact O-N 2.97Å; A699-E702 PolarHBondContact O-N 2.95Å; L700-E702 VanDerWaalsContact C-N 3.32Å; L700-E702 PolarHBondContact O-N 3.48Å; E702-H704 VanDerWaalsContact C-N 3.35Å; E702-H704 PolarHBondContact O-N 3.34Å; E702-S705 PolarHBondContact O-N 3.26Å; E702-S705 PolarHBondContact O-OG 2.92Å; E702-E706 PolarHBondContact O-N 3.49Å
703S90.4Very high90.9Very high55 Ų5598.4 Ų98.439%0.38551%0.509SS..Hα-helixtrans-63.8-39.3178.676.50000112.5A699 L700 L701 S705 E706 I707A699-S703 PolarHBondContact O-N 3.4Å; L700-S703 PolarHBondContact O-N 2.86Å; L700-S703 PolarHBondContact O-OG 2.89Å; L701-S703 PolarHBondContact O-N 3.26Å; S703-S705 VanDerWaalsContact C-N 3.35Å; S703-E706 PolarHBondContact O-N 2.96Å; S703-I707 VanDerWaalsContact O-CG1 3.31Å; S703-I707 WeakPolarHBondContact O-CG1 3.5Å; S703-I707 PolarHBondContact O-N 3.43Å
704H89.3Confident91.2Very high96 Ų9696.4 Ų96.444%0.44450%0.501SS..Hα-helixtrans-63.5-41.4174.1-77.2-58.5000111.6L700 L701 E702 E706 I707 D708L700-H704 WeakPolarHBondContact CD2-NE2 3.43Å; L700-H704 PolarHBondContact O-CD2 2.9Å; L700-H704 PolarHBondContact O-N 3.31Å; L701-H704 PolarHBondContact O-N 3.4Å; E702-H704 VanDerWaalsContact C-N 3.35Å; E702-H704 PolarHBondContact O-N 3.34Å; H704-E706 VanDerWaalsContact C-N 3.3Å; H704-E706 PolarHBondContact O-N 3.14Å; H704-I707 PolarHBondContact O-N 3.06Å; H704-D708 PolarHBondContact O-N 2.93Å
705S90.7Very high91Very high66 Ų6699.8 Ų99.846%0.46251%0.509SS..Hα-helixtrans-64-34.5176.779.60000112.8L701 E702 S703 R709L701-S705 PolarHBondContact O-N 3.2Å; E702-S705 PolarHBondContact O-N 3.26Å; E702-S705 PolarHBondContact O-OG 2.92Å; S703-S705 VanDerWaalsContact C-N 3.35Å; S705-R709 PolarHBondContact O-N 2.94Å; S705-R709 VanDerWaalsContact O-N 3.09Å
706E91.8Very high90.8Very high92 Ų9296.5 Ų96.543%0.4350%0.504SS..Hα-helixtrans-73.6-39.8176.2-173.460.1-164.800111.6E702 S703 H704 D708 R709 L710E702-E706 PolarHBondContact O-N 3.49Å; S703-E706 PolarHBondContact O-N 2.96Å; H704-E706 VanDerWaalsContact C-N 3.3Å; H704-E706 PolarHBondContact O-N 3.14Å; E706-D708 VanDerWaalsContact C-N 3.32Å; E706-D708 PolarHBondContact O-N 3.5Å; E706-R709 WeakPolarHBondContact O-CB 3.42Å; E706-R709 PolarHBondContact O-N 3.48Å; E706-L710 WeakPolarHBondContact O-CG 3.33Å; E706-L710 PolarHBondContact O-N 3.46Å
707I92.4Very high90.6Very high86 Ų8696.8 Ų96.844%0.44150%0.504SS..Hα-helixtrans-58.7-45.4172.4-70165.7000110.4S703 H704 R709 L710 L711S703-I707 VanDerWaalsContact O-CG1 3.31Å; S703-I707 WeakPolarHBondContact O-CG1 3.5Å; S703-I707 PolarHBondContact O-N 3.43Å; H704-I707 PolarHBondContact O-N 3.06Å; I707-R709 VanDerWaalsContact C-N 3.28Å; I707-R709 PolarHBondContact O-N 3.49Å; I707-L710 PolarHBondContact O-N 3.31Å; I707-L711 HydrophobicContact CG2-CD1 3.96Å; I707-L711 HydrophobicContact CG2-CG 4.34Å; I707-L711 WeakPolarHBondContact O-CB 3.24Å; I707-L711 WeakPolarHBondContact O-CG 3.43Å; I707-L711 PolarHBondContact O-N 3.21Å
708D89.9Confident90Very high96 Ų9697.2 Ų97.251%0.51350%0.503SS..Hα-helixtrans-62.4-36177.1-78.3-22.7000112.5H704 E706 K712H704-D708 PolarHBondContact O-N 2.93Å; E706-D708 VanDerWaalsContact C-N 3.32Å; E706-D708 PolarHBondContact O-N 3.5Å; D708-K712 WeakPolarHBondContact O-CG 3.37Å; D708-K712 PolarHBondContact O-N 2.87Å
709R93.3Very high89.6Confident161 Ų16198.9 Ų98.961%0.60851%0.506SS*.Hα-helixtrans-66.4-45.4175.1-167.3-175.1-169.7152.43.8111.5S705 E706 I707 K712 I713S705-R709 PolarHBondContact O-N 2.94Å; S705-R709 VanDerWaalsContact O-N 3.09Å; E706-R709 WeakPolarHBondContact O-CB 3.42Å; E706-R709 PolarHBondContact O-N 3.48Å; I707-R709 VanDerWaalsContact C-N 3.28Å; I707-R709 PolarHBondContact O-N 3.49Å; R709-K712 WeakPolarHBondContact O-CB 3.28Å; R709-K712 PolarHBondContact O-N 3.24Å; R709-I713 WeakPolarHBondContact O-CG1 3.46Å; R709-I713 PolarHBondContact O-N 2.71Å; R709-I713 VanDerWaalsContact O-N 3.12Å
710L92.9Very high89Confident90 Ų90103.2 Ų103.247%0.47152%0.516SS..Hα-helixtrans-63.2-42.2176-68.5174000111.1E706 I707 K712 I713 V714E706-L710 WeakPolarHBondContact O-CG 3.33Å; E706-L710 PolarHBondContact O-N 3.46Å; I707-L710 PolarHBondContact O-N 3.31Å; L710-K712 VanDerWaalsContact C-N 3.31Å; L710-K712 PolarHBondContact O-N 2.96Å; L710-I713 PolarHBondContact O-N 3.19Å; L710-I713 VanDerWaalsContact O-N 3.12Å; L710-V714 WeakPolarHBondContact O-CG2 3.34Å; L710-V714 PolarHBondContact O-N 3.33Å
711L90.4Very high88.4Confident85 Ų85105.9 Ų105.945%0.44553%0.526SS..Hα-helixtrans-60.5-38.8175.3-75.4172.4000112I707 V714 H715I707-L711 HydrophobicContact CG2-CD1 3.96Å; I707-L711 HydrophobicContact CG2-CG 4.34Å; I707-L711 WeakPolarHBondContact O-CB 3.24Å; I707-L711 WeakPolarHBondContact O-CG 3.43Å; I707-L711 PolarHBondContact O-N 3.21Å; L711-V714 PolarHBondContact O-N 3.26Å; L711-H715 PolarHBondContact O-N 3.32Å; L711-H715 PolarHBondContact O-ND1 2.87Å
712K91Very high87.7Confident161 Ų161106.4 Ų106.470%0.753%0.526SS*.Hα-helixtrans-63.3-40.7173.3-79.8173.9-178.2167.90112.6D708 R709 L710 H715 A716D708-K712 WeakPolarHBondContact O-CG 3.37Å; D708-K712 PolarHBondContact O-N 2.87Å; R709-K712 WeakPolarHBondContact O-CB 3.28Å; R709-K712 PolarHBondContact O-N 3.24Å; L710-K712 VanDerWaalsContact C-N 3.31Å; L710-K712 PolarHBondContact O-N 2.96Å; K712-H715 PolarHBondContact O-N 2.99Å; K712-A716 PolarHBondContact O-N 3.43Å
713I91.7Very high87Confident87 Ų87103 Ų10345%0.44651%0.511SS..Hα-helixtrans-65.2-45177.3-66.4167.8000110R709 L710 H715 A716 M717R709-I713 WeakPolarHBondContact O-CG1 3.46Å; R709-I713 PolarHBondContact O-N 2.71Å; R709-I713 VanDerWaalsContact O-N 3.12Å; L710-I713 PolarHBondContact O-N 3.19Å; L710-I713 VanDerWaalsContact O-N 3.12Å; I713-H715 PolarHBondContact O-N 3.49Å; I713-A716 WeakPolarHBondContact O-CB 3.22Å; I713-A716 PolarHBondContact O-N 2.93Å; I713-A716 VanDerWaalsContact O-N 3.15Å; I713-M717 HydrophobicContact CG2-CG 4.36Å; I713-M717 HydrophobicContact CG2-SD 4.04Å; I713-M717 WeakPolarHBondContact O-CG 3.35Å; I713-M717 PolarHBondContact O-N 3.04Å
714V89.7Confident86.1Confident67 Ų67101.9 Ų101.941%0.40651%0.509SS..Hα-helixtrans-59-47.8176.5172.40000110.8L710 L711 A716 M717 E718L710-V714 WeakPolarHBondContact O-CG2 3.34Å; L710-V714 PolarHBondContact O-N 3.33Å; L711-V714 PolarHBondContact O-N 3.26Å; V714-A716 VanDerWaalsContact C-N 3.29Å; V714-A716 PolarHBondContact O-N 3.35Å; V714-M717 PolarHBondContact O-N 3.28Å; V714-M717 VanDerWaalsContact O-N 3.15Å; V714-E718 HydrophobicContact CG1-CG 4.32Å; V714-E718 WeakPolarHBondContact O-CG 3.45Å; V714-E718 PolarHBondContact O-N 3.12Å
715H84.3Confident85.6Confident123 Ų12398.9 Ų98.957%0.56950%0.504SS*.Hα-helixtrans-59.9-37.3176-79.892.1000112.8L711 K712 I713 K719L711-H715 PolarHBondContact O-N 3.32Å; L711-H715 PolarHBondContact O-ND1 2.87Å; K712-H715 PolarHBondContact O-N 2.99Å; I713-H715 PolarHBondContact O-N 3.49Å; H715-K719 WeakPolarHBondContact O-CB 3.37Å; H715-K719 PolarHBondContact O-N 2.95Å; H715-K719 VanDerWaalsContact O-N 3.1Å
716A87.5Confident84.8Confident55 Ų55102.1 Ų102.146%0.45551%0.506SS..Hα-helixtrans-66.7-42.7175.600000111.8K712 I713 V714 K719 E720K712-A716 PolarHBondContact O-N 3.43Å; I713-A716 WeakPolarHBondContact O-CB 3.22Å; I713-A716 PolarHBondContact O-N 2.93Å; I713-A716 VanDerWaalsContact O-N 3.15Å; V714-A716 VanDerWaalsContact C-N 3.29Å; V714-A716 PolarHBondContact O-N 3.35Å; A716-K719 PolarHBondContact O-N 3.39Å; A716-E720 PolarHBondContact O-N 3.2Å
717M85.1Confident83.8Confident118 Ų118103.6 Ų103.658%0.58151%0.513SS*.Hα-helixtrans-66.2-39.2176.8-70.4179.963.900112.6I713 V714 K719 E720 Q721I713-M717 HydrophobicContact CG2-CG 4.36Å; I713-M717 HydrophobicContact CG2-SD 4.04Å; I713-M717 WeakPolarHBondContact O-CG 3.35Å; I713-M717 PolarHBondContact O-N 3.04Å; V714-M717 PolarHBondContact O-N 3.28Å; V714-M717 VanDerWaalsContact O-N 3.15Å; M717-K719 VanDerWaalsContact C-N 3.31Å; M717-E720 PolarHBondContact O-N 2.92Å; M717-Q721 WeakPolarHBondContact O-CB 3.41Å; M717-Q721 PolarHBondContact O-N 2.88Å
718E79.1Confident82.8Confident107 Ų107103.3 Ų103.350%0.552%0.515SS..Hα-helixtrans-62.3-41.2174.4-75.7177.7160.600111V714 Q721 E722V714-E718 HydrophobicContact CG1-CG 4.32Å; V714-E718 WeakPolarHBondContact O-CG 3.45Å; V714-E718 PolarHBondContact O-N 3.12Å; E718-Q721 WeakPolarHBondContact O-CB 3.39Å; E718-Q721 PolarHBondContact O-N 3.46Å; E718-E722 PolarHBondContact O-N 3.35Å
719K83.5Confident81.8Confident134 Ų134102.8 Ų102.858%0.58351%0.512SS*.Hα-helixtrans-64.8-42.5176.1-165.7174.8-177.91790112.6H715 A716 M717 Q721 E722 D723H715-K719 WeakPolarHBondContact O-CB 3.37Å; H715-K719 PolarHBondContact O-N 2.95Å; H715-K719 VanDerWaalsContact O-N 3.1Å; A716-K719 PolarHBondContact O-N 3.39Å; M717-K719 VanDerWaalsContact C-N 3.31Å; K719-Q721 VanDerWaalsContact C-N 3.32Å; K719-Q721 PolarHBondContact O-N 3.36Å; K719-E722 PolarHBondContact O-N 3.41Å; K719-D723 PolarHBondContact O-N 3.48Å
720E80.7Confident80.6Confident148 Ų148101.2 Ų101.269%0.69251%0.512SS*.Hα-helixtrans-64-36.6173.6-73.4-169167.700112.3A716 M717 D723 G724A716-E720 PolarHBondContact O-N 3.2Å; M717-E720 PolarHBondContact O-N 2.92Å; E720-D723 PolarHBondContact O-N 3Å; E720-G724 PolarHBondContact O-N 2.91Å
721Q78Confident79.4Confident146 Ų146102.6 Ų102.668%0.68252%0.519SS*.Hα-helixtrans-64.7-41.8173.5-86.7-72.3-5.900112.3M717 E718 K719 G724 G725M717-Q721 WeakPolarHBondContact O-CB 3.41Å; M717-Q721 PolarHBondContact O-N 2.88Å; E718-Q721 WeakPolarHBondContact O-CB 3.39Å; E718-Q721 PolarHBondContact O-N 3.46Å; K719-Q721 VanDerWaalsContact C-N 3.32Å; K719-Q721 PolarHBondContact O-N 3.36Å; Q721-G724 PolarHBondContact O-N 3.48Å; Q721-G725 PolarHBondContact O-N 2.98Å
722E77.2Confident78.4Confident125 Ų125104.5 Ų104.558%0.58452%0.52SS*.Hα-helixtrans-64.1-39.4175-75.3-174.3171.200112.5E718 K719 R726E718-E722 PolarHBondContact O-N 3.35Å; K719-E722 PolarHBondContact O-N 3.41Å; E722-R726 WeakPolarHBondContact O-CG 3.4Å; E722-R726 PolarHBondContact O-N 3Å; E722-R726 PolarHBondContact O-NE 3.36Å
723D77.6Confident77.4Confident64 Ų64101.3 Ų101.334%0.34251%0.514SS..Hα-helixtrans-70.6-39.4177.4-71.6-25.6000111.8K719 E720 R726 H727K719-D723 PolarHBondContact O-N 3.48Å; E720-D723 PolarHBondContact O-N 3Å; D723-R726 PolarHBondContact O-N 3.05Å; D723-R726 IonicContact OD1-CZ 2.83Å; D723-R726 IonicContact OD1-NE 3.37Å; D723-R726 IonicContact OD1-NH1 3.86Å; D723-R726 IonicContact OD1-NH2 2.71Å; D723-R726 PolarHBondContact OD1-NH2 3.32Å; D723-H727 PolarHBondContact O-N 3.01Å; D723-H727 VanDerWaalsContact O-N 3.08Å; D723-H727 PolarHBondContact O-ND1 3.45Å
724G73.3Confident76.1Confident33 Ų33105.9 Ų105.934%0.3453%0.527SS..Hα-helixtrans-65.9-41.8172.900000112.6E720 Q721 R726 H727 V728E720-G724 PolarHBondContact O-N 2.91Å; Q721-G724 PolarHBondContact O-N 3.48Å; G724-R726 VanDerWaalsContact C-N 3.31Å; G724-R726 PolarHBondContact O-N 3.1Å; G724-H727 WeakPolarHBondContact O-CB 3.39Å; G724-H727 PolarHBondContact O-N 3.46Å; G724-V728 WeakPolarHBondContact O-CG2 3.47Å; G724-V728 PolarHBondContact O-N 3.47Å
725G77.3Confident74.7Confident33 Ų33108.7 Ų108.734%0.3454%0.537SS..Hα-helixtrans-61.9-37.6174.900000112.6Q721 N729Q721-G725 PolarHBondContact O-N 2.98Å; G725-N729 WeakPolarHBondContact O-CB 3.43Å; G725-N729 PolarHBondContact O-N 2.96Å
726R74.9Confident73.5Confident134 Ų134111.2 Ų111.251%0.50654%0.543SS..Hα-helixtrans-64-45.3171.5-80.1-178.3-93.8162.2-4.2111.9E722 D723 G724 V728 N729 E730E722-R726 WeakPolarHBondContact O-CG 3.4Å; E722-R726 PolarHBondContact O-N 3Å; E722-R726 PolarHBondContact O-NE 3.36Å; D723-R726 PolarHBondContact O-N 3.05Å; D723-R726 IonicContact OD1-CZ 2.83Å; D723-R726 IonicContact OD1-NE 3.37Å; D723-R726 IonicContact OD1-NH1 3.86Å; D723-R726 IonicContact OD1-NH2 2.71Å; D723-R726 PolarHBondContact OD1-NH2 3.32Å; G724-R726 VanDerWaalsContact C-N 3.31Å; G724-R726 PolarHBondContact O-N 3.1Å; R726-V728 PolarHBondContact O-N 3.44Å; R726-N729 WeakPolarHBondContact O-CB 3.39Å; R726-N729 PolarHBondContact O-N 2.89Å; R726-E730 PolarHBondContact O-N 2.94Å
727H70.8Confident72.3Confident122 Ų122112.7 Ų112.757%0.56555%0.546SS*.Hα-helixtrans-60.6-43.5175-92.980.6000113.2D723 G724 N729 E730 L731D723-H727 PolarHBondContact O-N 3.01Å; D723-H727 VanDerWaalsContact O-N 3.08Å; D723-H727 PolarHBondContact O-ND1 3.45Å; G724-H727 WeakPolarHBondContact O-CB 3.39Å; G724-H727 PolarHBondContact O-N 3.46Å; H727-N729 VanDerWaalsContact C-N 3.33Å; H727-N729 PolarHBondContact O-N 2.85Å; H727-E730 PolarHBondContact O-N 2.89Å; H727-L731 WeakPolarHBondContact O-CB 3.49Å; H727-L731 WeakPolarHBondContact O-CG 3.48Å; H727-L731 PolarHBondContact O-N 3.44Å
728V70.6Confident71.2Confident80 Ų80114 Ų11449%0.48555%0.549SS..Hα-helixtrans-66.6-38178.31740000110.8G724 R726 R732G724-V728 WeakPolarHBondContact O-CG2 3.47Å; G724-V728 PolarHBondContact O-N 3.47Å; R726-V728 PolarHBondContact O-N 3.44Å; V728-R732 WeakPolarHBondContact O-CB 3.44Å; V728-R732 PolarHBondContact O-N 3.32Å
729N69.2Low69.8Low85 Ų85111.7 Ų111.746%0.45554%0.542SS..Hα-helixtrans-62.3-46.9173.4-101.2-42.8000111.7G725 R726 H727 R732 V733G725-N729 WeakPolarHBondContact O-CB 3.43Å; G725-N729 PolarHBondContact O-N 2.96Å; R726-N729 WeakPolarHBondContact O-CB 3.39Å; R726-N729 PolarHBondContact O-N 2.89Å; H727-N729 VanDerWaalsContact C-N 3.33Å; H727-N729 PolarHBondContact O-N 2.85Å; N729-R732 PolarHBondContact O-N 2.88Å; N729-R732 PolarHBondContact OD1-NH2 3.23Å; N729-V733 WeakPolarHBondContact O-CG2 3.36Å; N729-V733 PolarHBondContact O-N 2.85Å
730E68.6Low68.4Low128 Ų128109.5 Ų109.560%0.59854%0.54SS*.Hα-helixtrans-61.3-44.6177.4-76.5-179.9174.200112.2R726 H727 R732 V733 Y734R726-E730 PolarHBondContact O-N 2.94Å; H727-E730 PolarHBondContact O-N 2.89Å; E730-R732 PolarHBondContact O-N 2.96Å; E730-V733 PolarHBondContact O-N 3.19Å; E730-Y734 PolarHBondContact O-N 3.01Å
731L67.8Low66.9Low119 Ų119111 Ų11162%0.62354%0.544SS*.Hα-helixtrans-63.3-40.1175.4-76.2169.9000112.2H727 Y734 M735H727-L731 WeakPolarHBondContact O-CB 3.49Å; H727-L731 WeakPolarHBondContact O-CG 3.48Å; H727-L731 PolarHBondContact O-N 3.44Å; L731-Y734 PolarHBondContact O-N 3.42Å; L731-M735 WeakPolarHBondContact O-CB 3.48Å; L731-M735 PolarHBondContact O-N 2.97Å
732R69.4Low65.3Low126 Ų126109.9 Ų109.948%0.47554%0.543SS..Hα-helixtrans-65.1-39.7177.1178.3169.346.1-118.83.3111.7V728 N729 E730 M735 Y736V728-R732 WeakPolarHBondContact O-CB 3.44Å; V728-R732 PolarHBondContact O-N 3.32Å; N729-R732 PolarHBondContact O-N 2.88Å; N729-R732 PolarHBondContact OD1-NH2 3.23Å; E730-R732 PolarHBondContact O-N 2.96Å; R732-M735 PolarHBondContact O-N 3.09Å; R732-Y736 WeakPolarHBondContact O-CB 3.42Å; R732-Y736 PolarHBondContact O-N 3.2Å
733V69.4Low63.7Low93 Ų93109.9 Ų109.956%0.56455%0.545SS*.Hα-helixtrans-64.5-44.5173.5172.60000110.5N729 E730 M735 Y736 V737N729-V733 WeakPolarHBondContact O-CG2 3.36Å; N729-V733 PolarHBondContact O-N 2.85Å; E730-V733 PolarHBondContact O-N 3.19Å; V733-M735 VanDerWaalsContact C-N 3.34Å; V733-M735 PolarHBondContact O-N 3.35Å; V733-Y736 PolarHBondContact O-N 2.71Å; V733-V737 WeakPolarHBondContact O-CG2 3.4Å; V733-V737 PolarHBondContact O-N 2.99Å
734Y64.1Low61.8Low183 Ų183111.4 Ų111.472%0.71857%0.567SS**Hα-helixtrans-59.4-44.4175.5-114.1-84000112.3E730 L731 V737 F738E730-Y734 PolarHBondContact O-N 3.01Å; L731-Y734 PolarHBondContact O-N 3.42Å; Y734-V737 PolarHBondContact O-N 3.01Å; Y734-F738 WeakPolarHBondContact O-CB 3.42Å; Y734-F738 PolarHBondContact O-N 3.42Å
735M60.6Low59.8Low126 Ų126113.7 Ų113.762%0.62158%0.582SS**Hα-helixtrans-65.5-41.6178-167177.374.500111.3L731 R732 V733 V737 F738 T739L731-M735 WeakPolarHBondContact O-CB 3.48Å; L731-M735 PolarHBondContact O-N 2.97Å; R732-M735 PolarHBondContact O-N 3.09Å; V733-M735 VanDerWaalsContact C-N 3.34Å; V733-M735 PolarHBondContact O-N 3.35Å; M735-V737 PolarHBondContact O-N 2.98Å; M735-F738 PolarHBondContact O-N 2.88Å; M735-T739 WeakPolarHBondContact O-CB 3.31Å; M735-T739 PolarHBondContact O-N 2.94Å; M735-T739 PolarHBondContact O-OG1 3.43Å
736Y58.6Low57.5Low176 Ų176118.1 Ų118.169%0.6961%0.605SS**Hα-helixtrans-61.9-43.6177.4-163.3-95.1000111.5R732 V733 T739 T740R732-Y736 WeakPolarHBondContact O-CB 3.42Å; R732-Y736 PolarHBondContact O-N 3.2Å; V733-Y736 PolarHBondContact O-N 2.71Å; Y736-T739 PolarHBondContact O-N 3.23Å; Y736-T740 WeakPolarHBondContact O-CB 3.39Å; Y736-T740 PolarHBondContact O-N 3.48Å; Y736-T740 PolarHBondContact O-OG1 2.99Å
737V62.3Low55.4Low87 Ų87121.5 Ų121.553%0.52762%0.624SS.*Hα-helixtrans-67.5-38.8176.61780000111.8V733 Y734 M735V733-V737 WeakPolarHBondContact O-CG2 3.4Å; V733-V737 PolarHBondContact O-N 2.99Å; Y734-V737 PolarHBondContact O-N 3.01Å; M735-V737 PolarHBondContact O-N 2.98Å
738F63Low53.4Low145 Ų145125.5 Ų125.564%0.63664%0.642SS**Hα-helixtrans-66.1-41.8176.9-156.8-91.5000111.8Y734 M735 K741 L742Y734-F738 WeakPolarHBondContact O-CB 3.42Å; Y734-F738 PolarHBondContact O-N 3.42Å; M735-F738 PolarHBondContact O-N 2.88Å; F738-K741 PolarHBondContact O-N 2.9Å; F738-L742 HydrophobicContact CD1-CD1 4.14Å; F738-L742 HydrophobicContact CE1-CD1 3.91Å
739T49.5Very low51.3Low58 Ų58124.9 Ų124.936%0.35665%0.652SS.*Hα-helixtrans-74-33.7-176.9-41.50000111.5M735 Y736 K741 L742 I743M735-T739 WeakPolarHBondContact O-CB 3.31Å; M735-T739 PolarHBondContact O-N 2.94Å; M735-T739 PolarHBondContact O-OG1 3.43Å; Y736-T739 PolarHBondContact O-N 3.23Å; T739-K741 PolarHBondContact O-N 3.32Å; T739-L742 PolarHBondContact O-N 2.85Å; T739-L742 VanDerWaalsContact O-N 3.12Å; T739-I743 HydrophobicContact CG2-CD1 3.55Å; T739-I743 HydrophobicContact CG2-CG1 4.25Å; T739-I743 WeakPolarHBondContact O-CG1 3.44Å; T739-I743 PolarHBondContact O-N 3.5Å
740T53.7Low49.3Very low89 Ų89129.6 Ų129.655%0.54667%0.671SS.*Hα-helixtrans-63.3-27.1175.8-49.90000112.2Y736Y736-T740 WeakPolarHBondContact O-CB 3.39Å; Y736-T740 PolarHBondContact O-N 3.48Å; Y736-T740 PolarHBondContact O-OG1 2.99Å
741K49.7Very low47.4Very low178 Ų178134.6 Ų134.677%0.77469%0.685SS**Hα-helixtrans-78.6-19175.4-82.4-177.2176.7176.30114.8F738 T739F738-K741 PolarHBondContact O-N 2.9Å; T739-K741 PolarHBondContact O-N 3.32Å
742L44Very low45.5Very low124 Ų124133.3 Ų133.365%0.64969%0.686SS**Hα-helixtrans-98.3-16.9-176.9-78.3167.8000114.2F738 T739F738-L742 HydrophobicContact CD1-CD1 4.14Å; F738-L742 HydrophobicContact CE1-CD1 3.91Å; T739-L742 PolarHBondContact O-N 2.85Å; T739-L742 VanDerWaalsContact O-N 3.12Å
743I43.8Very low43.6Very low125 Ų125138.3 Ų138.364%0.64171%0.705SS**  trans-90.5-2.8-171.7-64.8175.4000113.4T739 A745T739-I743 HydrophobicContact CG2-CD1 3.55Å; T739-I743 HydrophobicContact CG2-CG1 4.25Å; T739-I743 WeakPolarHBondContact O-CG1 3.44Å; T739-I743 PolarHBondContact O-N 3.5Å; I743-A745 PolarHBondContact O-N 3.19Å
744A37.5Very low41.6Very low96 Ų96143.8 Ų143.879%0.79372%0.724SS**  trans-75.361.3170.500000112.3
745A31Very low39.6Very low81 Ų81141.5 Ų141.567%0.66972%0.718SS**  trans-150.6114.2166.300000110.6I743I743-A745 PolarHBondContact O-N 3.19Å
746P29.3Very low37.9Very low126 Ų126145.6 Ų145.682%0.81873%0.727SS**  trans-98.1122.9-171.134.2-29.2000112.6
747K31.3Very low36.6Very low205 Ų205141.9 Ų141.989%0.89172%0.723SS**  trans-154.7103156.8-67.5-163.1177.1178.50108.6
748Q27.5Very low34.9Very low206 Ų206146.6 Ų146.696%0.96374%0.744SS**  52.812196.9-86.5-163.2-14.700115.7
749G27.7Very low33.2Very low67 Ų67143.5 Ų143.569%0.69175%0.745SS**  trans132.585.5168.600000111.4
750E27Very low32.4Very low183 Ų183146.4 Ų146.486%0.85577%0.768SS**  80140.692.3-83.1-171.4168.400114.9
751R29.1Very low31.3Very low234 Ų234148.2 Ų148.288%0.88378%0.782SS**  trans90.8138.7173.9-61.2176.5174.7176.3-1.1114.7
752S28Very low31Very low92 Ų92144 Ų14464%0.64377%0.773SS**  cis-178.9134.4-9.9-104.50000105.3
753R28.2Very low30.8Very low231 Ų231144.5 Ų144.587%0.87278%0.784SS**  trans5190145.9-60.7179.9-171.9157.61.9117.5
754E27.4Very low30.8Very low207 Ų207143.8 Ų143.897%0.96778%0.778SS**  trans-93.2102.2141.6-73.2178.2177.100107.6
755F23.4Very low31.5Very low135 Ų135144.1 Ų144.159%0.59277%0.772SS**  trans-126113.6168.4178.3-116.5000104.4
756W25Very low32.7Very low212 Ų212147 Ų14780%0.80377%0.769SS**  -172.1140.3117.9-85.9108.6000110
757T30.6Very low34.1Very low99 Ų99147.1 Ų147.161%0.60776%0.762SS**  trans-68.3137.4-168.839.50000114.5A759T757-A759 PolarHBondContact O-N 3.46Å; T757-A759 VanDerWaalsContact O-N 3.11Å
758L26.1Very low35.6Very low186 Ų186143.1 Ų143.197%0.97475%0.75SS**  trans-43.299.9154.8-158.679.3000111.2
759A27.5Very low37.5Very low80 Ų80137 Ų13766%0.66173%0.728SS**  trans-138.8106.3172.800000110T757T757-A759 PolarHBondContact O-N 3.46Å; T757-A759 VanDerWaalsContact O-N 3.11Å
760S32.7Very low39.6Very low119 Ų119139.5 Ų139.583%0.83273%0.726SS**  trans52.779.9145.3-51.30000117.5
761C31.8Very low42Very low126 Ų126135.6 Ų135.685%0.85171%0.709SS**  trans-70.3130152.5-79.80000109
762P42.8Very low44.3Very low90 Ų90130.2 Ų130.258%0.58469%0.694SS**  trans-66154.6178.828.8-32.9000110.4E764P762-E764 VanDerWaalsContact C-N 3.31Å; P762-E764 HydrophobicContact CG-CG 4.46Å; P762-E764 PolarHBondContact O-N 3.34Å
763P40.2Very low46.9Very low135 Ų135128.7 Ų128.788%0.87768%0.682SS**  trans-68.790.5175.229.4-31.4000108.5
764E44.2Very low49.6Very low109 Ų109121.1 Ų121.151%0.50966%0.661SS.*  trans-75.4138-179.6-82.2-167.2156.800111.1P762 K766P762-E764 VanDerWaalsContact C-N 3.31Å; P762-E764 HydrophobicContact CG-CG 4.46Å; P762-E764 PolarHBondContact O-N 3.34Å; E764-K766 PolarHBondContact O-N 3.03Å; E764-K766 IonicContact OE1-NZ 2.74Å; E764-K766 VanDerWaalsContact OE2-CE 3.3Å; E764-K766 WeakPolarHBondContact OE2-CE 3.43Å; E764-K766 IonicContact OE2-NZ 3.71Å; E764-K766 PolarHBondContact OE2-NZ 2.83Å
765P50.8Low52.4Low103 Ų103114.5 Ų114.567%0.66963%0.634SS**THydrogen-bonded Turntrans-70.813.9-174.5-1.215.2000114.8I767 L768 C769P765-I767 VanDerWaalsContact C-N 3.32Å; P765-I767 PolarHBondContact O-N 3.46Å; P765-L768 WeakPolarHBondContact O-CB 3.33Å; P765-L768 PolarHBondContact O-N 3.06Å; P765-L768 VanDerWaalsContact O-N 3.17Å; P765-C769 PolarHBondContact O-N 3.21Å; P765-C769 VanDerWaalsContact O-N 3.1Å
766K56Low55.3Low141 Ų141112.5 Ų112.561%0.61363%0.628SS**Hα-helixtrans-68.6-28.8-175.4-71.3174.5-179.3154.30112.8E764 L768 C769 L770E764-K766 PolarHBondContact O-N 3.03Å; E764-K766 IonicContact OE1-NZ 2.74Å; E764-K766 VanDerWaalsContact OE2-CE 3.3Å; E764-K766 WeakPolarHBondContact OE2-CE 3.43Å; E764-K766 IonicContact OE2-NZ 3.71Å; E764-K766 PolarHBondContact OE2-NZ 2.83Å; K766-L768 VanDerWaalsContact C-N 3.31Å; K766-C769 PolarHBondContact O-N 3.32Å; K766-L770 WeakPolarHBondContact O-CB 3.45Å; K766-L770 PolarHBondContact O-N 2.93Å
767I60.2Low58.3Low129 Ų129108.6 Ų108.666%0.66262%0.618SS**Hα-helixtrans-63.5-42.2173-61.4175.2000109.9P765 L770 I771P765-I767 VanDerWaalsContact C-N 3.32Å; P765-I767 PolarHBondContact O-N 3.46Å; I767-L770 PolarHBondContact O-N 3.27Å; I767-I771 HydrophobicContact CG2-CD1 3.72Å; I767-I771 HydrophobicContact CG2-CG1 4.35Å; I767-I771 WeakPolarHBondContact O-CB 3.39Å; I767-I771 VanDerWaalsContact O-CG1 3.26Å; I767-I771 WeakPolarHBondContact O-CG1 3.43Å; I767-I771 PolarHBondContact O-N 3.15Å
768L61.7Low61.2Low122 Ų122110.3 Ų110.364%0.63962%0.617SS**Hα-helixtrans-67.1-39.1179.6-134.6147.8000110.9P765 K766 I771 Q772P765-L768 WeakPolarHBondContact O-CB 3.33Å; P765-L768 PolarHBondContact O-N 3.06Å; P765-L768 VanDerWaalsContact O-N 3.17Å; K766-L768 VanDerWaalsContact C-N 3.31Å; L768-I771 PolarHBondContact O-N 2.84Å; L768-Q772 WeakPolarHBondContact O-CB 3.23Å; L768-Q772 PolarHBondContact O-N 3.48Å
769C66.4Low64.3Low76 Ų76105 Ų10551%0.51459%0.59SS.*Hα-helixtrans-64.3-41.2172.7-173.40000112.8P765 K766 Q772 T773P765-C769 PolarHBondContact O-N 3.21Å; P765-C769 VanDerWaalsContact O-N 3.1Å; K766-C769 PolarHBondContact O-N 3.32Å; C769-Q772 PolarHBondContact O-N 2.85Å; C769-T773 PolarHBondContact O-N 3.34Å; C769-T773 PolarHBondContact O-OG1 2.88Å
770L73.6Confident67.3Low120 Ų120106.4 Ų106.463%0.62858%0.581SS**Hα-helixtrans-68.2-40.7177.7-164.872.6000111.7K766 I767 T773 V774K766-L770 WeakPolarHBondContact O-CB 3.45Å; K766-L770 PolarHBondContact O-N 2.93Å; I767-L770 PolarHBondContact O-N 3.27Å; L770-T773 VanDerWaalsContact CA-OG1 3.3Å; L770-T773 WeakPolarHBondContact CA-OG1 3.35Å; L770-T773 PolarHBondContact O-OG1 2.85Å; L770-V774 WeakPolarHBondContact O-CB 3.47Å; L770-V774 VanDerWaalsContact O-CG2 3.25Å; L770-V774 WeakPolarHBondContact O-CG2 3.43Å; L770-V774 PolarHBondContact O-N 3.48Å
771I75.7Confident70.1Confident101 Ų101107.4 Ų107.452%0.51857%0.567SS.*Hα-helixtrans-64.3-45.2173.7-68.2168.7000109.8I767 L768 T773 V774 V775I767-I771 HydrophobicContact CG2-CD1 3.72Å; I767-I771 HydrophobicContact CG2-CG1 4.35Å; I767-I771 WeakPolarHBondContact O-CB 3.39Å; I767-I771 VanDerWaalsContact O-CG1 3.26Å; I767-I771 WeakPolarHBondContact O-CG1 3.43Å; I767-I771 PolarHBondContact O-N 3.15Å; L768-I771 PolarHBondContact O-N 2.84Å; I771-T773 VanDerWaalsContact C-N 3.35Å; I771-T773 PolarHBondContact O-N 2.98Å; I771-V774 PolarHBondContact O-N 3.46Å; I771-V775 HydrophobicContact CG2-CG2 4.08Å; I771-V775 WeakPolarHBondContact O-CB 3.42Å; I771-V775 VanDerWaalsContact O-CG2 3.25Å; I771-V775 WeakPolarHBondContact O-CG2 3.33Å; I771-V775 PolarHBondContact O-N 3.03Å
772Q77.5Confident73Confident121 Ų121105.3 Ų105.357%0.56555%0.546SS*.Hα-helixtrans-64.4-38.1-179.8-172.8157.618.800112.5L768 C769 M776L768-Q772 WeakPolarHBondContact O-CB 3.23Å; L768-Q772 PolarHBondContact O-N 3.48Å; C769-Q772 PolarHBondContact O-N 2.85Å; Q772-M776 VanDerWaalsContact O-CB 3.31Å; Q772-M776 WeakPolarHBondContact O-CB 3.4Å; Q772-M776 WeakPolarHBondContact O-CG 3.4Å; Q772-M776 PolarHBondContact O-N 3.24Å
773T82.3Confident75.2Confident61 Ų61106.7 Ų106.737%0.37455%0.545SS..Hα-helixtrans-66.1-42.8172.736.10000111.8C769 L770 I771 M776 H777C769-T773 PolarHBondContact O-N 3.34Å; C769-T773 PolarHBondContact O-OG1 2.88Å; L770-T773 VanDerWaalsContact CA-OG1 3.3Å; L770-T773 WeakPolarHBondContact CA-OG1 3.35Å; L770-T773 PolarHBondContact O-OG1 2.85Å; I771-T773 VanDerWaalsContact C-N 3.35Å; I771-T773 PolarHBondContact O-N 2.98Å; T773-M776 PolarHBondContact O-N 3.32Å; T773-H777 PolarHBondContact O-CD2 2.94Å; T773-H777 PolarHBondContact O-N 2.96Å
774V85.9Confident77.6Confident72 Ų72105.4 Ų105.444%0.43653%0.527SS..Hα-helixtrans-64.6-41.7175.9171.70000112.1L770 I771 H777 K778L770-V774 WeakPolarHBondContact O-CB 3.47Å; L770-V774 VanDerWaalsContact O-CG2 3.25Å; L770-V774 WeakPolarHBondContact O-CG2 3.43Å; L770-V774 PolarHBondContact O-N 3.48Å; I771-V774 PolarHBondContact O-N 3.46Å; V774-H777 PolarHBondContact O-N 3.11Å; V774-K778 WeakPolarHBondContact O-CG 3.46Å; V774-K778 PolarHBondContact O-N 3.37Å
775V85.6Confident79.9Confident67 Ų67104.7 Ų104.741%0.40653%0.526SS..Hα-helixtrans-62.4-50.5175.6169.30000109.7I771 H777 K778 D779I771-V775 HydrophobicContact CG2-CG2 4.08Å; I771-V775 WeakPolarHBondContact O-CB 3.42Å; I771-V775 VanDerWaalsContact O-CG2 3.25Å; I771-V775 WeakPolarHBondContact O-CG2 3.33Å; I771-V775 PolarHBondContact O-N 3.03Å; V775-H777 VanDerWaalsContact C-N 3.28Å; V775-H777 PolarHBondContact O-N 3.35Å; V775-K778 CarbonylContact O-C 3.59Å; V775-K778 WeakPolarHBondContact O-CA 3.5Å; V775-K778 WeakPolarHBondContact O-CB 3.19Å; V775-K778 PolarHBondContact O-N 3.33Å; V775-D779 WeakPolarHBondContact CG1-OD2 3.44Å; V775-D779 VanDerWaalsContact O-CG 3.28Å; V775-D779 PolarHBondContact O-N 2.88Å
776M85.9Confident81.8Confident94 Ų94104.6 Ų104.646%0.46352%0.517SS..Hα-helixtrans-57.3-37.8175.7-84.4-159.458.900113.8Q772 T773 K780Q772-M776 VanDerWaalsContact O-CB 3.31Å; Q772-M776 WeakPolarHBondContact O-CB 3.4Å; Q772-M776 WeakPolarHBondContact O-CG 3.4Å; Q772-M776 PolarHBondContact O-N 3.24Å; T773-M776 PolarHBondContact O-N 3.32Å; M776-K780 WeakPolarHBondContact O-CB 3.28Å; M776-K780 VanDerWaalsContact O-CG 3.31Å; M776-K780 WeakPolarHBondContact O-CG 3.39Å; M776-K780 PolarHBondContact O-N 2.82Å
777H87.4Confident83.4Confident130 Ų130103.5 Ų103.560%0.60251%0.514SS*.Hα-helixtrans-68.5-36175.4-81.4-63.7000112.5T773 V774 V775 R781T773-H777 PolarHBondContact O-CD2 2.94Å; T773-H777 PolarHBondContact O-N 2.96Å; V774-H777 PolarHBondContact O-N 3.11Å; V775-H777 VanDerWaalsContact C-N 3.28Å; V775-H777 PolarHBondContact O-N 3.35Å; H777-R781 WeakPolarHBondContact O-CB 3.32Å; H777-R781 PolarHBondContact O-N 2.87Å
778K91.6Very high85Confident134 Ų13499.4 Ų99.458%0.58350%0.499SS*.Hα-helixtrans-69.7-41.5174.4-73.9-176.7175.4-170.30111.5V774 V775 R781 I782V774-K778 WeakPolarHBondContact O-CG 3.46Å; V774-K778 PolarHBondContact O-N 3.37Å; V775-K778 CarbonylContact O-C 3.59Å; V775-K778 WeakPolarHBondContact O-CA 3.5Å; V775-K778 WeakPolarHBondContact O-CB 3.19Å; V775-K778 PolarHBondContact O-N 3.33Å; K778-R781 CarbonylContact O-C 3.59Å; K778-R781 WeakPolarHBondContact O-CB 3.46Å; K778-R781 PolarHBondContact O-N 3.21Å; K778-R781 VanDerWaalsContact O-N 3.16Å; K778-I782 VanDerWaalsContact O-CG1 3.23Å; K778-I782 WeakPolarHBondContact O-CG1 3.26Å; K778-I782 PolarHBondContact O-N 3.25Å
779D90.5Very high86.4Confident76 Ų7699 Ų9941%0.40650%0.497SS..Hα-helixtrans-62.8-47.1177.9-63.6-24.8000110.7V775 R781 I782 E783V775-D779 WeakPolarHBondContact CG1-OD2 3.44Å; V775-D779 VanDerWaalsContact O-CG 3.28Å; V775-D779 PolarHBondContact O-N 2.88Å; D779-R781 VanDerWaalsContact C-N 3.28Å; D779-R781 PolarHBondContact O-N 2.69Å; D779-I782 WeakPolarHBondContact O-CB 3.29Å; D779-I782 PolarHBondContact O-N 2.89Å; D779-I782 VanDerWaalsContact O-N 3.1Å; D779-E783 WeakPolarHBondContact O-CG 3.27Å; D779-E783 PolarHBondContact O-N 2.84Å
780K91.3Very high87.6Confident108 Ų108101.8 Ų101.847%0.4750%0.501SS..Hα-helixtrans-58.6-39.7172.5-73.3177.9-179.8-174.50112.7M776 I782 E783 E784M776-K780 WeakPolarHBondContact O-CB 3.28Å; M776-K780 VanDerWaalsContact O-CG 3.31Å; M776-K780 WeakPolarHBondContact O-CG 3.39Å; M776-K780 PolarHBondContact O-N 2.82Å; K780-I782 VanDerWaalsContact C-N 3.33Å; K780-E783 PolarHBondContact O-N 3.12Å; K780-E784 WeakPolarHBondContact O-CG 3.46Å; K780-E784 PolarHBondContact O-N 3.49Å
781R91.9Very high88.5Confident140 Ų140101.7 Ų101.753%0.52850%0.497SS..Hα-helixtrans-68.4-34.7177.3-176.755.5174.9176.73.1112H777 K778 D779 E784 L785H777-R781 WeakPolarHBondContact O-CB 3.32Å; H777-R781 PolarHBondContact O-N 2.87Å; K778-R781 CarbonylContact O-C 3.59Å; K778-R781 WeakPolarHBondContact O-CB 3.46Å; K778-R781 PolarHBondContact O-N 3.21Å; K778-R781 VanDerWaalsContact O-N 3.16Å; D779-R781 VanDerWaalsContact C-N 3.28Å; D779-R781 PolarHBondContact O-N 2.69Å; R781-E784 WeakPolarHBondContact CD-OE2 3.5Å; R781-E784 IonicContact CZ-OE2 3.88Å; R781-E784 IonicContact NH1-OE2 2.73Å; R781-E784 PolarHBondContact NH1-OE2 2.97Å; R781-L785 HydrophobicContact CG-CD1 4.33Å; R781-L785 WeakPolarHBondContact O-CB 3.43Å; R781-L785 VanDerWaalsContact O-CG 3.25Å; R781-L785 WeakPolarHBondContact O-CG 3.35Å; R781-L785 PolarHBondContact O-N 2.97Å; R781-L785 VanDerWaalsContact O-N 3.11Å
782I90.7Very high89.1Confident83 Ų83100 Ų10043%0.42649%0.494SS..Hα-helixtrans-67.6-46.5174-69.9162.5000109.2K778 D779 K780 E784 L785 E786K778-I782 VanDerWaalsContact O-CG1 3.23Å; K778-I782 WeakPolarHBondContact O-CG1 3.26Å; K778-I782 PolarHBondContact O-N 3.25Å; D779-I782 WeakPolarHBondContact O-CB 3.29Å; D779-I782 PolarHBondContact O-N 2.89Å; D779-I782 VanDerWaalsContact O-N 3.1Å; K780-I782 VanDerWaalsContact C-N 3.33Å; I782-E784 PolarHBondContact O-N 3.28Å; I782-L785 CarbonylContact O-C 3.6Å; I782-L785 PolarHBondContact O-N 3.11Å; I782-L785 VanDerWaalsContact O-N 3.11Å; I782-E786 HydrophobicContact CG2-CG 4.16Å; I782-E786 WeakPolarHBondContact CG2-OE1 3.36Å; I782-E786 WeakPolarHBondContact O-CB 3.47Å; I782-E786 WeakPolarHBondContact O-CG 3.32Å; I782-E786 PolarHBondContact O-N 3.3Å
783E90.3Very high89.7Confident118 Ų11898.6 Ų98.655%0.55149%0.493SS*.Hα-helixtrans-55.6-47.7174.9-72.8172-179.100111.6D779 K780 L785 E786 E787D779-E783 WeakPolarHBondContact O-CG 3.27Å; D779-E783 PolarHBondContact O-N 2.84Å; K780-E783 PolarHBondContact O-N 3.12Å; E783-L785 VanDerWaalsContact C-N 3.34Å; E783-L785 PolarHBondContact O-N 3.42Å; E783-E786 PolarHBondContact O-N 2.93Å; E783-E787 WeakPolarHBondContact O-CB 3.34Å; E783-E787 PolarHBondContact O-N 2.94Å
784E90.5Very high90.2Very high109 Ų10998.4 Ų98.451%0.50950%0.495SS..Hα-helixtrans-58.7-41.8175-75.2171.8-171.700113K780 R781 I782 A788K780-E784 WeakPolarHBondContact O-CG 3.46Å; K780-E784 PolarHBondContact O-N 3.49Å; R781-E784 WeakPolarHBondContact CD-OE2 3.5Å; R781-E784 IonicContact CZ-OE2 3.88Å; R781-E784 IonicContact NH1-OE2 2.73Å; R781-E784 PolarHBondContact NH1-OE2 2.97Å; I782-E784 PolarHBondContact O-N 3.28Å; E784-A788 WeakPolarHBondContact O-CB 3.43Å; E784-A788 PolarHBondContact O-N 2.84Å
785L92.8Very high90.2Very high94 Ų9498.4 Ų98.449%0.49249%0.492SS..Hα-helixtrans-72.7-34.7179.3-72.4172.7000111.9R781 I782 E783 L789R781-L785 HydrophobicContact CG-CD1 4.33Å; R781-L785 WeakPolarHBondContact O-CB 3.43Å; R781-L785 VanDerWaalsContact O-CG 3.25Å; R781-L785 WeakPolarHBondContact O-CG 3.35Å; R781-L785 PolarHBondContact O-N 2.97Å; R781-L785 VanDerWaalsContact O-N 3.11Å; I782-L785 CarbonylContact O-C 3.6Å; I782-L785 PolarHBondContact O-N 3.11Å; I782-L785 VanDerWaalsContact O-N 3.11Å; E783-L785 VanDerWaalsContact C-N 3.34Å; E783-L785 PolarHBondContact O-N 3.42Å; L785-L789 VanDerWaalsContact O-CB 3.27Å; L785-L789 WeakPolarHBondContact O-CB 3.36Å; L785-L789 PolarHBondContact O-N 2.71Å
786E91.1Very high90.5Very high100 Ų10098.6 Ų98.647%0.46749%0.493SS..Hα-helixtrans-67.8-39.1173.5-74-179.7178.200111.4I782 E783 L789 K790I782-E786 HydrophobicContact CG2-CG 4.16Å; I782-E786 WeakPolarHBondContact CG2-OE1 3.36Å; I782-E786 WeakPolarHBondContact O-CB 3.47Å; I782-E786 WeakPolarHBondContact O-CG 3.32Å; I782-E786 PolarHBondContact O-N 3.3Å; E783-E786 PolarHBondContact O-N 2.93Å; E786-L789 PolarHBondContact O-N 3.11Å; E786-K790 VanDerWaalsContact O-CG 3.24Å; E786-K790 WeakPolarHBondContact O-CG 3.29Å; E786-K790 PolarHBondContact O-N 2.83Å
787E89.4Confident90.6Very high118 Ų11896.2 Ų96.255%0.55149%0.488SS*.Hα-helixtrans-62.2-50.5172.3-160.698.4-146.900110.6E783 L789 K790 E791E783-E787 WeakPolarHBondContact O-CB 3.34Å; E783-E787 PolarHBondContact O-N 2.94Å; E787-L789 VanDerWaalsContact C-N 3.27Å; E787-L789 PolarHBondContact O-N 3.33Å; E787-K790 WeakPolarHBondContact O-CB 3.41Å; E787-K790 PolarHBondContact O-N 3.42Å; E787-K790 VanDerWaalsContact O-N 3.14Å; E787-E791 PolarHBondContact O-N 3.05Å
788A92.8Very high90.7Very high43 Ų4395.6 Ų95.636%0.35549%0.485SS..Hα-helixtrans-62.1-33.9177.500000112.9E784 S792E784-A788 WeakPolarHBondContact O-CB 3.43Å; E784-A788 PolarHBondContact O-N 2.84Å; A788-S792 WeakPolarHBondContact O-CB 3.3Å; A788-S792 PolarHBondContact O-N 3.3Å; A788-S792 PolarHBondContact O-OG 2.87Å
789L91.3Very high90.6Very high114 Ų11497.4 Ų97.460%0.59749%0.489SS*.Hα-helixtrans-69-43.3174.6-173.965.6000111.3L785 E786 E787 S792 V793L785-L789 VanDerWaalsContact O-CB 3.27Å; L785-L789 WeakPolarHBondContact O-CB 3.36Å; L785-L789 PolarHBondContact O-N 2.71Å; E786-L789 PolarHBondContact O-N 3.11Å; E787-L789 VanDerWaalsContact C-N 3.27Å; E787-L789 PolarHBondContact O-N 3.33Å; L789-S792 PolarHBondContact O-N 3.28Å; L789-V793 WeakPolarHBondContact O-CG2 3.43Å; L789-V793 PolarHBondContact O-N 3.06Å
790K92.5Very high90.7Very high135 Ų135100.2 Ų100.259%0.58750%0.499SS*.Hα-helixtrans-60.3-45175-73.2167.6-170.7170.10111.3E786 E787 V793 S794E786-K790 VanDerWaalsContact O-CG 3.24Å; E786-K790 WeakPolarHBondContact O-CG 3.29Å; E786-K790 PolarHBondContact O-N 2.83Å; E787-K790 WeakPolarHBondContact O-CB 3.41Å; E787-K790 PolarHBondContact O-N 3.42Å; E787-K790 VanDerWaalsContact O-N 3.14Å; K790-V793 PolarHBondContact O-N 3.48Å; K790-S794 PolarHBondContact O-N 2.95Å
791E91.8Very high90.7Very high118 Ų11899.8 Ų99.855%0.55150%0.501SS*.Hα-helixtrans-60.6-45.4174.6-71.3-176.9176.300111.7E787 V793 S794 I795E787-E791 PolarHBondContact O-N 3.05Å; E791-V793 VanDerWaalsContact C-N 3.33Å; E791-V793 PolarHBondContact O-N 3.36Å; E791-S794 PolarHBondContact O-N 2.87Å; E791-I795 WeakPolarHBondContact O-CB 3.49Å; E791-I795 WeakPolarHBondContact O-CD1 3.35Å; E791-I795 WeakPolarHBondContact O-CG1 3.38Å; E791-I795 PolarHBondContact O-N 3.44Å
792S87.4Confident90.7Very high66 Ų6695.5 Ų95.546%0.46250%0.496SS..Hα-helixtrans-61.9-38.8178.6-61.60000112.8A788 L789 T796A788-S792 WeakPolarHBondContact O-CB 3.3Å; A788-S792 PolarHBondContact O-N 3.3Å; A788-S792 PolarHBondContact O-OG 2.87Å; L789-S792 PolarHBondContact O-N 3.28Å; S792-T796 WeakPolarHBondContact O-CB 3.45Å; S792-T796 PolarHBondContact O-N 3.42Å; S792-T796 PolarHBondContact O-OG1 3.29Å
793V91.9Very high90.8Very high90 Ų9095.2 Ų95.255%0.54550%0.498SS..Hα-helixtrans-68.9-43.3174.8172.70000110.9L789 K790 E791 I795 T796 A797L789-V793 WeakPolarHBondContact O-CG2 3.43Å; L789-V793 PolarHBondContact O-N 3.06Å; K790-V793 PolarHBondContact O-N 3.48Å; E791-V793 VanDerWaalsContact C-N 3.33Å; E791-V793 PolarHBondContact O-N 3.36Å; V793-I795 PolarHBondContact O-N 3.18Å; V793-T796 PolarHBondContact O-N 3.04Å; V793-A797 PolarHBondContact O-N 3.08Å
794S91.5Very high90.9Very high57 Ų5792.3 Ų92.340%0.39949%0.494SS..Hα-helixtrans-59.2-47.7175.6-164.40000111.4K790 E791 T796 A797 E798K790-S794 PolarHBondContact O-N 2.95Å; E791-S794 PolarHBondContact O-N 2.87Å; S794-T796 VanDerWaalsContact C-N 3.28Å; S794-T796 PolarHBondContact O-N 3.16Å; S794-A797 PolarHBondContact O-N 2.89Å; S794-E798 WeakPolarHBondContact O-CB 3.47Å; S794-E798 WeakPolarHBondContact O-CG 3.42Å; S794-E798 PolarHBondContact O-N 2.68Å; S794-E798 PolarHBondContact OG-OE1 2.86Å
795I86.7Confident91Very high73 Ų7392.9 Ų92.937%0.37450%0.497SS..Hα-helixtrans-61-38.7177.7-67.9164.6000110.9E791 V793 R799E791-I795 WeakPolarHBondContact O-CB 3.49Å; E791-I795 WeakPolarHBondContact O-CD1 3.35Å; E791-I795 WeakPolarHBondContact O-CG1 3.38Å; E791-I795 PolarHBondContact O-N 3.44Å; V793-I795 PolarHBondContact O-N 3.18Å; I795-R799 HydrophobicContact CG2-CG 4.47Å; I795-R799 WeakPolarHBondContact O-CB 3.42Å; I795-R799 WeakPolarHBondContact O-CG 3.43Å; I795-R799 PolarHBondContact O-N 3.32Å
796T90.5Very high90.9Very high70 Ų7094.3 Ų94.343%0.42950%0.501SS..Hα-helixtrans-67.9-44.8177.8-56.10000111.2S792 V793 S794 E798 R799 E800S792-T796 WeakPolarHBondContact O-CB 3.45Å; S792-T796 PolarHBondContact O-N 3.42Å; S792-T796 PolarHBondContact O-OG1 3.29Å; V793-T796 PolarHBondContact O-N 3.04Å; S794-T796 VanDerWaalsContact C-N 3.28Å; S794-T796 PolarHBondContact O-N 3.16Å; T796-E798 PolarHBondContact O-N 3.35Å; T796-R799 PolarHBondContact O-N 2.93Å; T796-E800 WeakPolarHBondContact O-CG 3.41Å; T796-E800 PolarHBondContact O-N 2.96Å
797A88.9Confident90.9Very high44 Ų4495.8 Ų95.836%0.36451%0.505SS..Hα-helixtrans-62.1-43.217600000112.1V793 S794 E800 I801V793-A797 PolarHBondContact O-N 3.08Å; S794-A797 PolarHBondContact O-N 2.89Å; A797-E800 PolarHBondContact O-N 3.35Å; A797-I801 VanDerWaalsContact O-CG1 3.3Å; A797-I801 WeakPolarHBondContact O-CG1 3.27Å; A797-I801 PolarHBondContact O-N 3.39Å
798E89Confident91.1Very high117 Ų11795.9 Ų95.955%0.54751%0.506SS..Hα-helixtrans-62.1-42.8174.9-74.8170.8-148.200112S794 T796 I801 A802S794-E798 WeakPolarHBondContact O-CB 3.47Å; S794-E798 WeakPolarHBondContact O-CG 3.42Å; S794-E798 PolarHBondContact O-N 2.68Å; S794-E798 PolarHBondContact OG-OE1 2.86Å; T796-E798 PolarHBondContact O-N 3.35Å; E798-I801 PolarHBondContact O-N 3Å; E798-A802 WeakPolarHBondContact O-CB 3.5Å; E798-A802 PolarHBondContact O-N 3.18Å
799R90.6Very high91.1Very high173 Ų17398.3 Ų98.365%0.65351%0.512SS*.Hα-helixtrans-62-42.6174.6-76.3171.4-178.5-176.13.2111.8I795 T796 A802 V803I795-R799 HydrophobicContact CG2-CG 4.47Å; I795-R799 WeakPolarHBondContact O-CB 3.42Å; I795-R799 WeakPolarHBondContact O-CG 3.43Å; I795-R799 PolarHBondContact O-N 3.32Å; T796-R799 PolarHBondContact O-N 2.93Å; R799-A802 PolarHBondContact O-N 3.02Å; R799-V803 WeakPolarHBondContact O-CB 3.47Å; R799-V803 VanDerWaalsContact O-CG2 3.28Å; R799-V803 WeakPolarHBondContact O-CG2 3.46Å; R799-V803 PolarHBondContact O-N 3.03Å
800E91.2Very high91.1Very high134 Ų13495 Ų9563%0.62650%0.498SS*.Hα-helixtrans-64.2-42.3177.7-75.5-178177.500112T796 A797 V803 A804T796-E800 WeakPolarHBondContact O-CG 3.41Å; T796-E800 PolarHBondContact O-N 2.96Å; A797-E800 PolarHBondContact O-N 3.35Å; E800-V803 PolarHBondContact O-N 2.84Å; E800-A804 WeakPolarHBondContact O-CB 3.25Å; E800-A804 PolarHBondContact O-N 3.03Å
801I91.6Very high91Very high99 Ų9993.8 Ų93.851%0.50849%0.494SS..Hα-helixtrans-62.4-45.8174.3-66.8165.6000110.5A797 E798 V803 A804 Q805A797-I801 VanDerWaalsContact O-CG1 3.3Å; A797-I801 WeakPolarHBondContact O-CG1 3.27Å; A797-I801 PolarHBondContact O-N 3.39Å; E798-I801 PolarHBondContact O-N 3Å; I801-V803 VanDerWaalsContact C-N 3.33Å; I801-V803 PolarHBondContact O-N 3.16Å; I801-A804 PolarHBondContact O-N 2.92Å; I801-Q805 HydrophobicContact CG2-CG 4.38Å; I801-Q805 WeakPolarHBondContact O-CB 3.35Å; I801-Q805 WeakPolarHBondContact O-CG 3.45Å; I801-Q805 PolarHBondContact O-N 3.39Å
802A92.7Very high91Very high51 Ų5193.1 Ų93.142%0.42149%0.491SS..Hα-helixtrans-61.6-40.5177.900000112.1E798 R799 Q805 H806E798-A802 WeakPolarHBondContact O-CB 3.5Å; E798-A802 PolarHBondContact O-N 3.18Å; R799-A802 PolarHBondContact O-N 3.02Å; A802-Q805 PolarHBondContact O-N 3.44Å; A802-H806 WeakPolarHBondContact O-CB 3.25Å; A802-H806 PolarHBondContact O-N 3.42Å
803V92.7Very high91.1Very high76 Ų7694.8 Ų94.846%0.46149%0.494SS..Hα-helixtrans-65.5-41.1174.9169.60000111.3R799 E800 I801 H806 K807R799-V803 WeakPolarHBondContact O-CB 3.47Å; R799-V803 VanDerWaalsContact O-CG2 3.28Å; R799-V803 WeakPolarHBondContact O-CG2 3.46Å; R799-V803 PolarHBondContact O-N 3.03Å; E800-V803 PolarHBondContact O-N 2.84Å; I801-V803 VanDerWaalsContact C-N 3.33Å; I801-V803 PolarHBondContact O-N 3.16Å; V803-H806 PolarHBondContact O-N 3.26Å; V803-K807 HydrophobicContact CG1-CD 4.18Å; V803-K807 HydrophobicContact CG1-CG 4.5Å; V803-K807 WeakPolarHBondContact O-CB 3.44Å; V803-K807 WeakPolarHBondContact O-CG 3.19Å; V803-K807 PolarHBondContact O-N 3.14Å
804A92.8Very high91.2Very high57 Ų5796.5 Ų96.547%0.47150%0.497SS..Hα-helixtrans-64-44.2176.400000111.8E800 I801 K807 Q808E800-A804 WeakPolarHBondContact O-CB 3.25Å; E800-A804 PolarHBondContact O-N 3.03Å; I801-A804 PolarHBondContact O-N 2.92Å; A804-K807 PolarHBondContact O-N 2.91Å; A804-Q808 PolarHBondContact O-N 3.05Å
805Q91.1Very high91.2Very high122 Ų122100.6 Ų100.657%0.5751%0.509SS*.Hα-helixtrans-61.5-44.5174.8-72.2176.1-6.300111.6I801 A802 K807 Q808 L809I801-Q805 HydrophobicContact CG2-CG 4.38Å; I801-Q805 WeakPolarHBondContact O-CB 3.35Å; I801-Q805 WeakPolarHBondContact O-CG 3.45Å; I801-Q805 PolarHBondContact O-N 3.39Å; A802-Q805 PolarHBondContact O-N 3.44Å; Q805-K807 PolarHBondContact O-N 3.42Å; Q805-Q808 PolarHBondContact O-N 3.47Å; Q805-L809 PolarHBondContact O-N 3.48Å
806H91.2Very high91.5Very high124 Ų124103.2 Ų103.257%0.57451%0.514SS*.Hα-helixtrans-63.6-41.5176.5-169.7-64000111.7A802 V803 L809 C810A802-H806 WeakPolarHBondContact O-CB 3.25Å; A802-H806 PolarHBondContact O-N 3.42Å; V803-H806 PolarHBondContact O-N 3.26Å; H806-L809 PolarHBondContact O-N 2.9Å; H806-C810 PolarHBondContact CE1-SG 2.9Å; H806-C810 PolarHBondContact ND1-SG 3.49Å; H806-C810 PolarHBondContact O-N 3.36Å; H806-C810 PolarHBondContact O-SG 2.94Å; H806-C810 VanDerWaalsContact O-SG 3.35Å
807K92.2Very high91.2Very high130 Ų130102 Ų10257%0.56551%0.509SS*.Hα-helixtrans-61-45174.8-77.5176.1179.6178.60111.3V803 A804 Q805 L809 C810 H811V803-K807 HydrophobicContact CG1-CD 4.18Å; V803-K807 HydrophobicContact CG1-CG 4.5Å; V803-K807 WeakPolarHBondContact O-CB 3.44Å; V803-K807 WeakPolarHBondContact O-CG 3.19Å; V803-K807 PolarHBondContact O-N 3.14Å; A804-K807 PolarHBondContact O-N 2.91Å; Q805-K807 PolarHBondContact O-N 3.42Å; K807-L809 VanDerWaalsContact C-N 3.34Å; K807-L809 PolarHBondContact O-N 2.85Å; K807-C810 PolarHBondContact O-N 2.95Å; K807-H811 PolarHBondContact O-N 3.26Å; K807-H811 PolarHBondContact O-ND1 3.24Å
808Q91.8Very high91.2Very high121 Ų121102.7 Ų102.757%0.56552%0.515SS*.Hα-helixtrans-61.1-43.3177.3-174.5179.8-5.600111.6A804 Q805 H811 Q812A804-Q808 PolarHBondContact O-N 3.05Å; Q805-Q808 PolarHBondContact O-N 3.47Å; Q808-H811 PolarHBondContact O-N 3.01Å; Q808-Q812 WeakPolarHBondContact O-CG 3.41Å; Q808-Q812 PolarHBondContact O-N 2.99Å
809L93.1Very high91.3Very high94 Ų9498.8 Ų98.849%0.49251%0.506SS..Hα-helixtrans-63.6-41.7176.6-17367.1000112Q805 H806 K807 H811 Q812 L813Q805-L809 PolarHBondContact O-N 3.48Å; H806-L809 PolarHBondContact O-N 2.9Å; K807-L809 VanDerWaalsContact C-N 3.34Å; K807-L809 PolarHBondContact O-N 2.85Å; L809-H811 PolarHBondContact O-N 3.42Å; L809-Q812 PolarHBondContact O-N 3.1Å; L809-L813 HydrophobicContact CG-CD1 4.31Å; L809-L813 WeakPolarHBondContact O-CG 3.38Å; L809-L813 PolarHBondContact O-N 2.88Å
810C91.6Very high91.3Very high43 Ų4395.3 Ų95.329%0.29150%0.497SS..Hα-helixtrans-58.4-47.1173.9-75.10000112H806 K807 Q812 L813 E814H806-C810 PolarHBondContact CE1-SG 2.9Å; H806-C810 PolarHBondContact ND1-SG 3.49Å; H806-C810 PolarHBondContact O-N 3.36Å; H806-C810 PolarHBondContact O-SG 2.94Å; H806-C810 VanDerWaalsContact O-SG 3.35Å; K807-C810 PolarHBondContact O-N 2.95Å; C810-Q812 VanDerWaalsContact C-N 3.31Å; C810-Q812 PolarHBondContact O-N 3.25Å; C810-L813 PolarHBondContact O-N 2.87Å; C810-E814 WeakPolarHBondContact O-CB 3.48Å; C810-E814 WeakPolarHBondContact O-CG 3.46Å; C810-E814 PolarHBondContact O-N 3.2Å
811H90.5Very high91.3Very high111 Ų11195.1 Ų95.151%0.51449%0.494SS..Hα-helixtrans-61.3-39.5177.9-73.975.3000111.8K807 Q808 L809 E814 Q815K807-H811 PolarHBondContact O-N 3.26Å; K807-H811 PolarHBondContact O-ND1 3.24Å; Q808-H811 PolarHBondContact O-N 3.01Å; L809-H811 PolarHBondContact O-N 3.42Å; H811-E814 PolarHBondContact O-N 3.24Å; H811-Q815 WeakPolarHBondContact O-CG 3.43Å; H811-Q815 PolarHBondContact O-N 2.95Å
812Q92.1Very high91.2Very high104 Ų10493.2 Ų93.249%0.48649%0.493SS..Hα-helixtrans-64.6-42.7175.6-71.6176.92.300112.2Q808 L809 C810 Q815 R816Q808-Q812 WeakPolarHBondContact O-CG 3.41Å; Q808-Q812 PolarHBondContact O-N 2.99Å; L809-Q812 PolarHBondContact O-N 3.1Å; C810-Q812 VanDerWaalsContact C-N 3.31Å; C810-Q812 PolarHBondContact O-N 3.25Å; Q812-Q815 PolarHBondContact O-N 2.93Å; Q812-R816 WeakPolarHBondContact O-CB 3.25Å; Q812-R816 PolarHBondContact O-N 3.17Å
813L90Very high91.2Very high101 Ų10197.1 Ų97.153%0.52950%0.503SS..Hα-helixtrans-68.1-37.6177.3-70.3176.1000112.2L809 C810 R816 S817L809-L813 HydrophobicContact CG-CD1 4.31Å; L809-L813 WeakPolarHBondContact O-CG 3.38Å; L809-L813 PolarHBondContact O-N 2.88Å; C810-L813 PolarHBondContact O-N 2.87Å; L813-R816 PolarHBondContact O-N 2.99Å; L813-S817 VanDerWaalsContact O-CB 3.31Å; L813-S817 WeakPolarHBondContact O-CB 3.28Å; L813-S817 PolarHBondContact O-N 2.92Å
814E92.4Very high91.1Very high126 Ų12699 Ų9959%0.58951%0.51SS*.Hα-helixtrans-64.4-44.1174.8-76.1173.5-179.200111.7C810 H811 R816 S817 A818C810-E814 WeakPolarHBondContact O-CB 3.48Å; C810-E814 WeakPolarHBondContact O-CG 3.46Å; C810-E814 PolarHBondContact O-N 3.2Å; H811-E814 PolarHBondContact O-N 3.24Å; E814-R816 PolarHBondContact O-N 3.5Å; E814-S817 PolarHBondContact O-N 3.33Å; E814-A818 WeakPolarHBondContact O-CB 3.39Å; E814-A818 PolarHBondContact O-N 3.03Å
815Q91.8Very high91.1Very high143 Ų143103.4 Ų103.467%0.66852%0.518SS*.Hα-helixtrans-61-43.8173.8-73.9177.113.700111.7H811 Q812 A818 G819H811-Q815 WeakPolarHBondContact O-CG 3.43Å; H811-Q815 PolarHBondContact O-N 2.95Å; Q812-Q815 PolarHBondContact O-N 2.93Å; Q815-A818 PolarHBondContact O-N 3.4Å; Q815-G819 PolarHBondContact O-N 2.9Å
816R92.8Very high91.1Very high127 Ų12799.7 Ų99.748%0.47951%0.508SS..Hα-helixtrans-64.5-42.9176.7-170.8173.3175.8166.4-1.9111.8Q812 L813 E814 G819 Q820Q812-R816 WeakPolarHBondContact O-CB 3.25Å; Q812-R816 PolarHBondContact O-N 3.17Å; L813-R816 PolarHBondContact O-N 2.99Å; E814-R816 PolarHBondContact O-N 3.5Å; R816-G819 PolarHBondContact O-N 3.27Å; R816-Q820 WeakPolarHBondContact O-CG 3.48Å; R816-Q820 PolarHBondContact O-N 3.16Å
817S85.2Confident91.2Very high45 Ų4598.4 Ų98.432%0.31551%0.505SS..Hα-helixtrans-64-41.3176.3-174.70000111.8L813 E814 Q820 K821L813-S817 VanDerWaalsContact O-CB 3.31Å; L813-S817 WeakPolarHBondContact O-CB 3.28Å; L813-S817 PolarHBondContact O-N 2.92Å; E814-S817 PolarHBondContact O-N 3.33Å; S817-Q820 PolarHBondContact O-N 2.84Å; S817-K821 WeakPolarHBondContact O-CB 3.48Å; S817-K821 VanDerWaalsContact O-CG 3.29Å; S817-K821 WeakPolarHBondContact O-CG 3.47Å; S817-K821 PolarHBondContact O-N 3.08Å
818A89.4Confident91.2Very high59 Ų5997.2 Ų97.249%0.48850%0.501SS..Hα-helixtrans-62.7-43.5175.100000111.7E814 Q815 K821 A822E814-A818 WeakPolarHBondContact O-CB 3.39Å; E814-A818 PolarHBondContact O-N 3.03Å; Q815-A818 PolarHBondContact O-N 3.4Å; A818-K821 PolarHBondContact O-N 2.99Å; A818-A822 PolarHBondContact O-N 2.81Å
819G90.4Very high91.2Very high35 Ų3597.9 Ų97.936%0.36150%0.504SS..Hα-helixtrans-60.7-45.1174.300000113Q815 R816 A822 Q823Q815-G819 PolarHBondContact O-N 2.9Å; R816-G819 PolarHBondContact O-N 3.27Å; G819-A822 PolarHBondContact O-N 2.9Å; G819-Q823 WeakPolarHBondContact O-CG 3.47Å; G819-Q823 PolarHBondContact O-N 3.33Å
820Q90.4Very high91.2Very high99 Ų9998.6 Ų98.646%0.46351%0.505SS..Hα-helixtrans-64.7-39.4176.2-72.5177.7-4700112.4R816 S817 A822 Q823 L824R816-Q820 WeakPolarHBondContact O-CG 3.48Å; R816-Q820 PolarHBondContact O-N 3.16Å; S817-Q820 PolarHBondContact O-N 2.84Å; Q820-A822 VanDerWaalsContact C-N 3.33Å; Q820-A822 PolarHBondContact O-N 2.91Å; Q820-Q823 PolarHBondContact O-N 3.34Å; Q820-L824 WeakPolarHBondContact O-CG 3.48Å; Q820-L824 PolarHBondContact O-N 3Å
821K91.9Very high91.3Very high131 Ų131100.6 Ų100.657%0.5752%0.516SS*.Hα-helixtrans-63.1-38.2174.2-75.1173.2-177.4176.70112S817 A818 K825S817-K821 WeakPolarHBondContact O-CB 3.48Å; S817-K821 VanDerWaalsContact O-CG 3.29Å; S817-K821 WeakPolarHBondContact O-CG 3.47Å; S817-K821 PolarHBondContact O-N 3.08Å; A818-K821 PolarHBondContact O-N 2.99Å; K821-K825 WeakPolarHBondContact O-CG 3.35Å; K821-K825 PolarHBondContact O-N 3.08Å; K821-K825 VanDerWaalsContact O-N 3.1Å
822A89.6Confident91.4Very high59 Ų5999.6 Ų99.649%0.48851%0.514SS..Hα-helixtrans-66.6-42.1175.100000111.8A818 G819 Q820 K825 A826A818-A822 PolarHBondContact O-N 2.81Å; G819-A822 PolarHBondContact O-N 2.9Å; Q820-A822 VanDerWaalsContact C-N 3.33Å; Q820-A822 PolarHBondContact O-N 2.91Å; A822-K825 PolarHBondContact O-N 3.47Å; A822-A826 PolarHBondContact O-N 3.43Å
823Q91.7Very high91.4Very high132 Ų132100.1 Ų100.162%0.61752%0.517SS*.Hα-helixtrans-62.7-42.3174.9-71.8174.6-6.100112.4G819 Q820 K825 A826 L827G819-Q823 WeakPolarHBondContact O-CG 3.47Å; G819-Q823 PolarHBondContact O-N 3.33Å; Q820-Q823 PolarHBondContact O-N 3.34Å; Q823-K825 VanDerWaalsContact C-N 3.35Å; Q823-K825 PolarHBondContact O-N 2.86Å; Q823-A826 PolarHBondContact O-N 3.48Å; Q823-L827 WeakPolarHBondContact O-CG 3.5Å; Q823-L827 PolarHBondContact O-N 2.94Å
824L90.9Very high91.6Very high117 Ų117100.4 Ų100.461%0.61352%0.519SS*.Hα-helixtrans-62.5-40175.6-77.8170.8000112.3Q820 L827 Q828Q820-L824 WeakPolarHBondContact O-CG 3.48Å; Q820-L824 PolarHBondContact O-N 3Å; L824-L827 PolarHBondContact O-N 3.2Å; L824-Q828 WeakPolarHBondContact O-CB 3.49Å; L824-Q828 PolarHBondContact O-N 2.93Å
825K92.7Very high91.6Very high149 Ų14996.8 Ų96.865%0.64851%0.507SS*.Hα-helixtrans-63-44.9173.8-74.7-179.2179.4-174.40112K821 A822 Q823 L827 Q828 E829K821-K825 WeakPolarHBondContact O-CG 3.35Å; K821-K825 PolarHBondContact O-N 3.08Å; K821-K825 VanDerWaalsContact O-N 3.1Å; A822-K825 PolarHBondContact O-N 3.47Å; Q823-K825 VanDerWaalsContact C-N 3.35Å; Q823-K825 PolarHBondContact O-N 2.86Å; K825-L827 PolarHBondContact O-N 2.91Å; K825-Q828 WeakPolarHBondContact O-CB 3.33Å; K825-Q828 PolarHBondContact O-N 3.45Å; K825-E829 WeakPolarHBondContact O-CG 3.29Å; K825-E829 PolarHBondContact O-N 2.97Å
826A92.4Very high91.5Very high43 Ų4393 Ų9336%0.35550%0.497SS..Hα-helixtrans-63.6-39.7177.700000112.5A822 Q823 E829 Q830A822-A826 PolarHBondContact O-N 3.43Å; Q823-A826 PolarHBondContact O-N 3.48Å; A826-E829 PolarHBondContact O-N 3.33Å; A826-Q830 WeakPolarHBondContact O-CG 3.48Å; A826-Q830 PolarHBondContact O-N 3.18Å; A826-Q830 VanDerWaalsContact O-N 3.09Å
827L91.9Very high91.6Very high98 Ų9891.3 Ų91.351%0.51349%0.494SS..Hα-helixtrans-66.8-38.6174.3-74.6170.8000111.9Q823 L824 K825 Q830 V831Q823-L827 WeakPolarHBondContact O-CG 3.5Å; Q823-L827 PolarHBondContact O-N 2.94Å; L824-L827 PolarHBondContact O-N 3.2Å; K825-L827 PolarHBondContact O-N 2.91Å; L827-Q830 PolarHBondContact O-N 3.23Å; L827-V831 WeakPolarHBondContact O-CG2 3.47Å; L827-V831 PolarHBondContact O-N 3.33Å
828Q93.1Very high91.9Very high104 Ų10494.2 Ų94.249%0.48651%0.506SS..Hα-helixtrans-62.1-45.1174.6-175.861.347.300111.5L824 K825 Q830 V831 D832L824-Q828 WeakPolarHBondContact O-CB 3.49Å; L824-Q828 PolarHBondContact O-N 2.93Å; K825-Q828 WeakPolarHBondContact O-CB 3.33Å; K825-Q828 PolarHBondContact O-N 3.45Å; Q828-Q830 VanDerWaalsContact C-N 3.3Å; Q828-Q830 PolarHBondContact O-N 3.35Å; Q828-V831 PolarHBondContact O-N 2.89Å; Q828-V831 VanDerWaalsContact O-N 3.17Å; Q828-D832 PolarHBondContact NE2-OD1 3.19Å; Q828-D832 VanDerWaalsContact O-CG 3.3Å; Q828-D832 PolarHBondContact O-N 3.02Å
829E92.2Very high92Very high135 Ų13598.1 Ų98.163%0.63151%0.512SS*.Hα-helixtrans-60-38.8175.6-72.6169.7-169.500111.9K825 A826 D832 Q833K825-E829 WeakPolarHBondContact O-CG 3.29Å; K825-E829 PolarHBondContact O-N 2.97Å; A826-E829 PolarHBondContact O-N 3.33Å; E829-D832 PolarHBondContact O-N 3.21Å; E829-Q833 WeakPolarHBondContact O-CB 3.46Å; E829-Q833 PolarHBondContact O-N 3Å
830Q92.8Very high92.1Very high109 Ų109101.8 Ų101.851%0.50952%0.519SS..Hα-helixtrans-65.4-41.4174.2-73.117610.500112.5A826 L827 Q828 Q833 L834A826-Q830 WeakPolarHBondContact O-CG 3.48Å; A826-Q830 PolarHBondContact O-N 3.18Å; A826-Q830 VanDerWaalsContact O-N 3.09Å; L827-Q830 PolarHBondContact O-N 3.23Å; Q828-Q830 VanDerWaalsContact C-N 3.3Å; Q828-Q830 PolarHBondContact O-N 3.35Å; Q830-Q833 PolarHBondContact O-N 2.96Å; Q830-L834 WeakPolarHBondContact O-CG 3.48Å; Q830-L834 PolarHBondContact O-N 3.21Å
831V92.3Very high92.1Very high85 Ų85102.1 Ų102.152%0.51552%0.524SS..Hα-helixtrans-64.2-42.4175.9170.20000110.9L827 Q828 Q833 L834 S835L827-V831 WeakPolarHBondContact O-CG2 3.47Å; L827-V831 PolarHBondContact O-N 3.33Å; Q828-V831 PolarHBondContact O-N 2.89Å; Q828-V831 VanDerWaalsContact O-N 3.17Å; V831-Q833 VanDerWaalsContact C-N 3.34Å; V831-Q833 PolarHBondContact O-N 3.3Å; V831-L834 PolarHBondContact O-N 3.49Å; V831-S835 WeakPolarHBondContact O-CB 3.4Å; V831-S835 PolarHBondContact O-N 3.33Å
832D93.9Very high92.1Very high90 Ų90100.1 Ų100.148%0.48152%0.517SS..Hα-helixtrans-65.1-39.3177.1-66.9-22.8000111.1Q828 E829 S835 S836Q828-D832 PolarHBondContact NE2-OD1 3.19Å; Q828-D832 VanDerWaalsContact O-CG 3.3Å; Q828-D832 PolarHBondContact O-N 3.02Å; E829-D832 PolarHBondContact O-N 3.21Å; D832-S835 PolarHBondContact O-N 3.21Å; D832-S836 PolarHBondContact O-N 3.05Å
833Q92.4Very high92.2Very high115 Ų115102.5 Ų102.554%0.53752%0.518SS..Hα-helixtrans-62.4-49.1173.8-172.5176.917.700111.6E829 Q830 V831 S835 S836 Q837E829-Q833 WeakPolarHBondContact O-CB 3.46Å; E829-Q833 PolarHBondContact O-N 3Å; Q830-Q833 PolarHBondContact O-N 2.96Å; V831-Q833 VanDerWaalsContact C-N 3.34Å; V831-Q833 PolarHBondContact O-N 3.3Å; Q833-S835 VanDerWaalsContact C-N 3.33Å; Q833-S835 PolarHBondContact O-N 3.42Å; Q833-S836 PolarHBondContact O-N 3.21Å; Q833-S836 PolarHBondContact O-OG 2.85Å; Q833-Q837 WeakPolarHBondContact O-CG 3.29Å; Q833-Q837 PolarHBondContact O-N 3.18Å
834L93.5Very high92.3Very high108 Ų10899.1 Ų99.157%0.56550%0.503SS*.Hα-helixtrans-63.3-38.5177.4-71.6173.4000111.9Q830 V831 S836 Q837 L838Q830-L834 WeakPolarHBondContact O-CG 3.48Å; Q830-L834 PolarHBondContact O-N 3.21Å; V831-L834 PolarHBondContact O-N 3.49Å; L834-S836 VanDerWaalsContact C-N 3.34Å; L834-S836 PolarHBondContact O-N 2.97Å; L834-Q837 PolarHBondContact O-N 2.9Å; L834-L838 WeakPolarHBondContact O-CB 3.37Å; L834-L838 PolarHBondContact O-N 3.21Å
835S92.9Very high92.3Very high49 Ų49101.5 Ų101.534%0.34350%0.504SS..Hα-helixtrans-62-41.3174.4-172.60000111.7V831 D832 Q833 L838 K839V831-S835 WeakPolarHBondContact O-CB 3.4Å; V831-S835 PolarHBondContact O-N 3.33Å; D832-S835 PolarHBondContact O-N 3.21Å; Q833-S835 VanDerWaalsContact C-N 3.33Å; Q833-S835 PolarHBondContact O-N 3.42Å; S835-L838 PolarHBondContact O-N 3.34Å; S835-K839 WeakPolarHBondContact O-CG 3.34Å; S835-K839 PolarHBondContact O-N 3.44Å
836S90.2Very high92.2Very high65 Ų6599.5 Ų99.546%0.45550%0.496SS..Hα-helixtrans-66.3-41.3175.8750000112.5D832 Q833 L834 K839 Q840D832-S836 PolarHBondContact O-N 3.05Å; Q833-S836 PolarHBondContact O-N 3.21Å; Q833-S836 PolarHBondContact O-OG 2.85Å; L834-S836 VanDerWaalsContact C-N 3.34Å; L834-S836 PolarHBondContact O-N 2.97Å; S836-K839 PolarHBondContact O-N 3.31Å; S836-Q840 PolarHBondContact O-N 3.37Å
837Q93.8Very high92.2Very high90 Ų90102.2 Ų102.242%0.42150%0.502SS..Hα-helixtrans-63.9-42.3175.7-72.9177-11.800111.7Q833 L834 K839 Q840 L841Q833-Q837 WeakPolarHBondContact O-CG 3.29Å; Q833-Q837 PolarHBondContact O-N 3.18Å; L834-Q837 PolarHBondContact O-N 2.9Å; Q837-K839 PolarHBondContact O-N 3.19Å; Q837-Q840 PolarHBondContact O-N 3.39Å; Q837-L841 WeakPolarHBondContact O-CG 3.2Å; Q837-L841 PolarHBondContact O-N 2.72Å
838L91.8Very high92.2Very high107 Ų107103.6 Ų103.656%0.5650%0.503SS*.Hα-helixtrans-62-43.3176.3-176.165000111.3L834 S835 Q840 L841 M842L834-L838 WeakPolarHBondContact O-CB 3.37Å; L834-L838 PolarHBondContact O-N 3.21Å; S835-L838 PolarHBondContact O-N 3.34Å; L838-Q840 PolarHBondContact O-N 2.93Å; L838-L841 PolarHBondContact O-N 2.84Å; L838-M842 HydrophobicContact CG-SD 4.28Å; L838-M842 WeakPolarHBondContact O-CB 3.37Å; L838-M842 VanDerWaalsContact O-CG 3.24Å; L838-M842 WeakPolarHBondContact O-CG 3.34Å; L838-M842 PolarHBondContact O-N 3.36Å
839K92.3Very high92Very high141 Ų141102.3 Ų102.361%0.61350%0.498SS*.Hα-helixtrans-61.1-43.2175.3-73.6172.2-175.7173.60111.9S835 S836 Q837 M842 Q843S835-K839 WeakPolarHBondContact O-CG 3.34Å; S835-K839 PolarHBondContact O-N 3.44Å; S836-K839 PolarHBondContact O-N 3.31Å; Q837-K839 PolarHBondContact O-N 3.19Å; K839-M842 PolarHBondContact O-N 3.42Å; K839-Q843 PolarHBondContact O-N 2.82Å
840Q91.2Very high91.8Very high112 Ų112101.5 Ų101.552%0.52349%0.493SS..Hα-helixtrans-62.8-47.6176.6-174.8-177.7-16.500111.5S836 Q837 L838 M842 Q843 E844S836-Q840 PolarHBondContact O-N 3.37Å; Q837-Q840 PolarHBondContact O-N 3.39Å; L838-Q840 PolarHBondContact O-N 2.93Å; Q840-M842 VanDerWaalsContact C-N 3.31Å; Q840-M842 PolarHBondContact O-N 2.85Å; Q840-Q843 PolarHBondContact O-N 3.18Å; Q840-Q843 VanDerWaalsContact O-N 3.15Å; Q840-E844 PolarHBondContact NE2-OE1 3.38Å; Q840-E844 WeakPolarHBondContact O-CG 3.27Å; Q840-E844 PolarHBondContact O-N 3.28Å
841L91.1Very high91.8Very high106 Ų10699.7 Ų99.756%0.55549%0.49SS*.Hα-helixtrans-63.4-36.2177.9-72173.7000112.4Q837 L838 R845Q837-L841 WeakPolarHBondContact O-CG 3.2Å; Q837-L841 PolarHBondContact O-N 2.72Å; L838-L841 PolarHBondContact O-N 2.84Å; L841-R845 VanDerWaalsContact O-CB 3.31Å; L841-R845 WeakPolarHBondContact O-CB 3.35Å; L841-R845 PolarHBondContact O-N 2.91Å
842M92Very high91.5Very high88 Ų8899 Ų9943%0.43348%0.483SS..Hα-helixtrans-64.1-42.2173.3-75.2179.569.800111.8L838 K839 Q840 R845 Q846L838-M842 HydrophobicContact CG-SD 4.28Å; L838-M842 WeakPolarHBondContact O-CB 3.37Å; L838-M842 VanDerWaalsContact O-CG 3.24Å; L838-M842 WeakPolarHBondContact O-CG 3.34Å; L838-M842 PolarHBondContact O-N 3.36Å; K839-M842 PolarHBondContact O-N 3.42Å; Q840-M842 VanDerWaalsContact C-N 3.31Å; Q840-M842 PolarHBondContact O-N 2.85Å; M842-R845 PolarHBondContact O-N 3.37Å; M842-Q846 WeakPolarHBondContact O-CG 3.45Å; M842-Q846 PolarHBondContact O-N 2.99Å
843Q92.2Very high91.1Very high109 Ų10998.4 Ų98.451%0.50948%0.477SS..Hα-helixtrans-65-47.9175.4-176.9-179-16.400111.3K839 Q840 R845 Q846 E847K839-Q843 PolarHBondContact O-N 2.82Å; Q840-Q843 PolarHBondContact O-N 3.18Å; Q840-Q843 VanDerWaalsContact O-N 3.15Å; Q843-R845 VanDerWaalsContact C-N 3.26Å; Q843-R845 PolarHBondContact O-N 2.89Å; Q843-Q846 WeakPolarHBondContact O-CB 3.35Å; Q843-Q846 PolarHBondContact O-N 2.83Å; Q843-E847 HydrophobicContact CG-CG 4.45Å; Q843-E847 WeakPolarHBondContact CG-OE1 3.33Å; Q843-E847 PolarHBondContact NE2-OE1 2.74Å; Q843-E847 WeakPolarHBondContact O-CG 3.38Å; Q843-E847 PolarHBondContact O-N 3.49Å
844E93.4Very high90.9Very high62 Ų6296.4 Ų96.429%0.2947%0.473SS..Hα-helixtrans-59.7-36.9176.6-72.8178.2-164.100111.9Q840 K848Q840-E844 PolarHBondContact NE2-OE1 3.38Å; Q840-E844 WeakPolarHBondContact O-CG 3.27Å; Q840-E844 PolarHBondContact O-N 3.28Å; E844-K848 WeakPolarHBondContact O-CB 3.21Å; E844-K848 VanDerWaalsContact O-CG 3.24Å; E844-K848 WeakPolarHBondContact O-CG 3.34Å; E844-K848 PolarHBondContact O-N 3.34Å
845R90.9Very high90.7Very high167 Ų16796.2 Ų96.263%0.6347%0.472SS*.Hα-helixtrans-64.7-43.5173.8-170-170.577.9-174.94.9111.5L841 M842 Q843 K848 E849L841-R845 VanDerWaalsContact O-CB 3.31Å; L841-R845 WeakPolarHBondContact O-CB 3.35Å; L841-R845 PolarHBondContact O-N 2.91Å; M842-R845 PolarHBondContact O-N 3.37Å; Q843-R845 VanDerWaalsContact C-N 3.26Å; Q843-R845 PolarHBondContact O-N 2.89Å; R845-K848 PolarHBondContact O-N 2.82Å; R845-E849 WeakPolarHBondContact O-CB 3.47Å; R845-E849 PolarHBondContact O-N 2.87Å
846Q90.4Very high90.3Very high107 Ų10798.7 Ų98.750%0.547%0.474SS..Hα-helixtrans-64.8-44.2176.9-74.4177.4-11.800111.7M842 Q843 K848 E849 H850M842-Q846 WeakPolarHBondContact O-CG 3.45Å; M842-Q846 PolarHBondContact O-N 2.99Å; Q843-Q846 WeakPolarHBondContact O-CB 3.35Å; Q843-Q846 PolarHBondContact O-N 2.83Å; Q846-K848 PolarHBondContact O-N 2.81Å; Q846-E849 PolarHBondContact O-N 3.28Å; Q846-H850 PolarHBondContact O-CD2 2.93Å; Q846-H850 PolarHBondContact O-N 3.05Å
847E92.4Very high90Very high100 Ų100102 Ų10247%0.46748%0.483SS..Hα-helixtrans-60.1-46175.5-71.6172.9-173.500111.2Q843 E849 H850 T851Q843-E847 HydrophobicContact CG-CG 4.45Å; Q843-E847 WeakPolarHBondContact CG-OE1 3.33Å; Q843-E847 PolarHBondContact NE2-OE1 2.74Å; Q843-E847 WeakPolarHBondContact O-CG 3.38Å; Q843-E847 PolarHBondContact O-N 3.49Å; E847-E849 PolarHBondContact O-N 3.31Å; E847-H850 PolarHBondContact O-N 3.39Å; E847-T851 WeakPolarHBondContact O-CG2 3.32Å; E847-T851 PolarHBondContact O-N 3.44Å; E847-T851 PolarHBondContact O-OG1 2.98Å
848K91.2Very high89.8Confident126 Ų126102.4 Ų102.455%0.54849%0.485SS..Hα-helixtrans-61.4-44.8175.7-75172.6-175.4167.90112E844 R845 Q846 H850 T851 I852E844-K848 WeakPolarHBondContact O-CB 3.21Å; E844-K848 VanDerWaalsContact O-CG 3.24Å; E844-K848 WeakPolarHBondContact O-CG 3.34Å; E844-K848 PolarHBondContact O-N 3.34Å; R845-K848 PolarHBondContact O-N 2.82Å; Q846-K848 PolarHBondContact O-N 2.81Å; K848-H850 VanDerWaalsContact C-N 3.33Å; K848-H850 PolarHBondContact O-N 3.26Å; K848-T851 WeakPolarHBondContact CA-OG1 3.4Å; K848-T851 PolarHBondContact O-N 3.3Å; K848-T851 PolarHBondContact O-OG1 3.45Å; K848-I852 WeakPolarHBondContact O-CG1 3.46Å; K848-I852 PolarHBondContact O-N 2.94Å
849E90Very high89.6Confident78 Ų78104.3 Ų104.336%0.36449%0.485SS..Hα-helixtrans-59.5-43.6175.7-176.656.9-146.500111.5R845 Q846 E847 I852 Q853R845-E849 WeakPolarHBondContact O-CB 3.47Å; R845-E849 PolarHBondContact O-N 2.87Å; Q846-E849 PolarHBondContact O-N 3.28Å; E847-E849 PolarHBondContact O-N 3.31Å; E849-I852 PolarHBondContact O-N 3.17Å; E849-Q853 VanDerWaalsContact O-CG 3.28Å; E849-Q853 WeakPolarHBondContact O-CG 3.35Å; E849-Q853 PolarHBondContact O-N 3.07Å; E849-Q853 PolarHBondContact OE1-NE2 3.08Å
850H88.2Confident89.3Confident117 Ų117100.9 Ų100.954%0.54247%0.47SS..Hα-helixtrans-60.9-44.9173.8-74.1-53.5000112.3Q846 E847 K848 I852 Q853 T854Q846-H850 PolarHBondContact O-CD2 2.93Å; Q846-H850 PolarHBondContact O-N 3.05Å; E847-H850 PolarHBondContact O-N 3.39Å; K848-H850 VanDerWaalsContact C-N 3.33Å; K848-H850 PolarHBondContact O-N 3.26Å; H850-I852 VanDerWaalsContact C-N 3.34Å; H850-I852 PolarHBondContact O-N 3.49Å; H850-Q853 PolarHBondContact O-N 3.34Å; H850-T854 WeakPolarHBondContact O-CG2 3.28Å; H850-T854 PolarHBondContact O-N 2.85Å; H850-T854 PolarHBondContact O-OG1 2.81Å
851T91.1Very high89.2Confident72 Ų72103.6 Ų103.644%0.44248%0.476SS..Hα-helixtrans-64.4-36.3177.2610000112.9E847 K848 T854 L855E847-T851 WeakPolarHBondContact O-CG2 3.32Å; E847-T851 PolarHBondContact O-N 3.44Å; E847-T851 PolarHBondContact O-OG1 2.98Å; K848-T851 WeakPolarHBondContact CA-OG1 3.4Å; K848-T851 PolarHBondContact O-N 3.3Å; K848-T851 PolarHBondContact O-OG1 3.45Å; T851-T854 WeakPolarHBondContact CA-OG1 3.38Å; T851-T854 PolarHBondContact O-N 3.03Å; T851-T854 PolarHBondContact O-OG1 3.12Å; T851-L855 WeakPolarHBondContact O-CB 3.49Å; T851-L855 VanDerWaalsContact O-CG 3.24Å; T851-L855 WeakPolarHBondContact O-CG 3.48Å; T851-L855 PolarHBondContact O-N 2.89Å
852I87.1Confident89.1Confident70 Ų70104.4 Ų104.436%0.35948%0.476SS..Hα-helixtrans-68.1-39.9176.1-71168.1000109.8K848 E849 H850 L855 R856K848-I852 WeakPolarHBondContact O-CG1 3.46Å; K848-I852 PolarHBondContact O-N 2.94Å; E849-I852 PolarHBondContact O-N 3.17Å; H850-I852 VanDerWaalsContact C-N 3.34Å; H850-I852 PolarHBondContact O-N 3.49Å; I852-L855 PolarHBondContact O-N 3.44Å; I852-R856 HydrophobicContact CG2-CG 4.4Å; I852-R856 WeakPolarHBondContact O-CB 3.28Å; I852-R856 VanDerWaalsContact O-CG 3.22Å; I852-R856 WeakPolarHBondContact O-CG 3.44Å; I852-R856 PolarHBondContact O-N 3.11Å
853Q85.3Confident88.8Confident78 Ų78103.1 Ų103.136%0.36447%0.471SS..Hα-helixtrans-63.5-43.4175.8-73.2173.710.100112.1E849 H850 R856 M857E849-Q853 VanDerWaalsContact O-CG 3.28Å; E849-Q853 WeakPolarHBondContact O-CG 3.35Å; E849-Q853 PolarHBondContact O-N 3.07Å; E849-Q853 PolarHBondContact OE1-NE2 3.08Å; H850-Q853 PolarHBondContact O-N 3.34Å; Q853-R856 PolarHBondContact O-N 3.28Å; Q853-M857 WeakPolarHBondContact O-CG 3.23Å; Q853-M857 PolarHBondContact O-N 2.87Å
854T88.1Confident88.6Confident72 Ų72101.5 Ų101.544%0.44246%0.463SS..Hα-helixtrans-63.4-46.1176.156.40000111.4H850 T851 R856 M857 E858H850-T854 WeakPolarHBondContact O-CG2 3.28Å; H850-T854 PolarHBondContact O-N 2.85Å; H850-T854 PolarHBondContact O-OG1 2.81Å; T851-T854 WeakPolarHBondContact CA-OG1 3.38Å; T851-T854 PolarHBondContact O-N 3.03Å; T851-T854 PolarHBondContact O-OG1 3.12Å; T854-R856 VanDerWaalsContact C-N 3.3Å; T854-R856 PolarHBondContact O-N 3.04Å; T854-M857 PolarHBondContact O-N 3.5Å; T854-M857 VanDerWaalsContact O-N 3.11Å; T854-E858 WeakPolarHBondContact O-CG 3.41Å; T854-E858 PolarHBondContact O-N 3.19Å
855L89.2Confident88.5Confident104 Ų104101.5 Ų101.555%0.54547%0.465SS..Hα-helixtrans-62.2-36.3176.7-71.5171.8000112.4T851 I852 E858 R859T851-L855 WeakPolarHBondContact O-CB 3.49Å; T851-L855 VanDerWaalsContact O-CG 3.24Å; T851-L855 WeakPolarHBondContact O-CG 3.48Å; T851-L855 PolarHBondContact O-N 2.89Å; I852-L855 PolarHBondContact O-N 3.44Å; L855-E858 PolarHBondContact O-N 3.37Å; L855-R859 WeakPolarHBondContact O-CB 3.47Å; L855-R859 PolarHBondContact O-N 3.14Å
856R84Confident88.5Confident102 Ų10295.9 Ų95.939%0.38545%0.454SS..Hα-helixtrans-64.1-41.5173.8-77.8172.2174.5167.2-0.6111.6I852 Q853 T854 K860I852-R856 HydrophobicContact CG2-CG 4.4Å; I852-R856 WeakPolarHBondContact O-CB 3.28Å; I852-R856 VanDerWaalsContact O-CG 3.22Å; I852-R856 WeakPolarHBondContact O-CG 3.44Å; I852-R856 PolarHBondContact O-N 3.11Å; Q853-R856 PolarHBondContact O-N 3.28Å; T854-R856 VanDerWaalsContact C-N 3.3Å; T854-R856 PolarHBondContact O-N 3.04Å; R856-K860 WeakPolarHBondContact O-CG 3.44Å; R856-K860 PolarHBondContact O-N 3.16Å; R856-K860 VanDerWaalsContact O-N 3.08Å
857M84.4Confident88.5Confident134 Ų13491.4 Ų91.466%0.6643%0.434SS*.Hα-helixtrans-67.3-41.7175.7-68.2-178-173.500112Q853 T854 K860 R861Q853-M857 WeakPolarHBondContact O-CG 3.23Å; Q853-M857 PolarHBondContact O-N 2.87Å; T854-M857 PolarHBondContact O-N 3.5Å; T854-M857 VanDerWaalsContact O-N 3.11Å; M857-K860 WeakPolarHBondContact O-CB 3.07Å; M857-K860 PolarHBondContact O-N 3.39Å; M857-R861 PolarHBondContact O-N 3.43Å
858E88.9Confident88.4Confident98 Ų9890 Ų9046%0.45843%0.426SS..Hα-helixtrans-62.7-46.8175.8-73.2172179.400111.5T854 L855 K860 R861 H862T854-E858 WeakPolarHBondContact O-CG 3.41Å; T854-E858 PolarHBondContact O-N 3.19Å; L855-E858 PolarHBondContact O-N 3.37Å; E858-K860 VanDerWaalsContact C-N 3.29Å; E858-K860 PolarHBondContact O-N 2.98Å; E858-R861 WeakPolarHBondContact O-CB 3.27Å; E858-R861 PolarHBondContact O-N 3.49Å; E858-R861 VanDerWaalsContact O-N 3.16Å; E858-H862 PolarHBondContact O-CD2 3.01Å; E858-H862 PolarHBondContact O-N 3.3Å
859R88.9Confident88.5Confident147 Ų14789.8 Ų89.856%0.55543%0.43SS*.Hα-helixtrans-56.2-44.4174-179.8-174.5172.4-146.5-2.5111.5L855 H862 L863L855-R859 WeakPolarHBondContact O-CB 3.47Å; L855-R859 PolarHBondContact O-N 3.14Å; R859-H862 PolarHBondContact O-N 3.01Å; R859-L863 HydrophobicContact CG-CD1 4.14Å; R859-L863 WeakPolarHBondContact O-CG 3.32Å; R859-L863 PolarHBondContact O-N 2.78Å
860K85.9Confident88.6Confident70 Ų7091.3 Ų91.330%0.30444%0.436SS..Hα-helixtrans-58.9-49.5175.9-79.1-178.4177-168.40111.2R856 M857 E858 H862 L863 E864 Q928R856-K860 WeakPolarHBondContact O-CG 3.44Å; R856-K860 PolarHBondContact O-N 3.16Å; R856-K860 VanDerWaalsContact O-N 3.08Å; M857-K860 WeakPolarHBondContact O-CB 3.07Å; M857-K860 PolarHBondContact O-N 3.39Å; E858-K860 VanDerWaalsContact C-N 3.29Å; E858-K860 PolarHBondContact O-N 2.98Å; K860-H862 PolarHBondContact O-N 3.43Å; K860-L863 PolarHBondContact O-N 2.92Å; K860-E864 WeakPolarHBondContact O-CG 3.36Å; K860-E864 PolarHBondContact O-N 3.15Å; K860-Q928 VanDerWaalsContact CG-OE1 3.31Å
861R89Confident88.9Confident168 Ų16887.9 Ų87.963%0.63442%0.42SS*.Hα-helixtrans-57.8-47177.2-177.8-178.7176.8174.21.3112.2M857 E858 L863 E864 D865M857-R861 PolarHBondContact O-N 3.43Å; E858-R861 WeakPolarHBondContact O-CB 3.27Å; E858-R861 PolarHBondContact O-N 3.49Å; E858-R861 VanDerWaalsContact O-N 3.16Å; R861-L863 VanDerWaalsContact C-N 3.33Å; R861-L863 PolarHBondContact O-N 2.88Å; R861-E864 PolarHBondContact O-N 3.33Å; R861-D865 IonicContact NE-OD2 3.11Å; R861-D865 WeakPolarHBondContact O-CB 3.38Å; R861-D865 PolarHBondContact O-N 2.83Å
862H88.8Confident89Confident124 Ų12490 Ų9057%0.57443%0.425SS*.Hα-helixtrans-63.2-38.3178.7-68.9-50.5000112.7E858 R859 K860 A866E858-H862 PolarHBondContact O-CD2 3.01Å; E858-H862 PolarHBondContact O-N 3.3Å; R859-H862 PolarHBondContact O-N 3.01Å; K860-H862 PolarHBondContact O-N 3.43Å; H862-A866 VanDerWaalsContact O-CB 3.25Å; H862-A866 WeakPolarHBondContact O-CB 3.35Å; H862-A866 PolarHBondContact O-N 3.32Å
863L86.5Confident89.4Confident61 Ų6190 Ų9032%0.31943%0.431SS..Hα-helixtrans-67.1-40.9175.1-72.7171.1000111.7R859 K860 R861 M867 I924R859-L863 HydrophobicContact CG-CD1 4.14Å; R859-L863 WeakPolarHBondContact O-CG 3.32Å; R859-L863 PolarHBondContact O-N 2.78Å; K860-L863 PolarHBondContact O-N 2.92Å; R861-L863 VanDerWaalsContact C-N 3.33Å; R861-L863 PolarHBondContact O-N 2.88Å; L863-M867 VanDerWaalsContact O-CG 3.25Å; L863-M867 WeakPolarHBondContact O-CG 3.5Å; L863-M867 PolarHBondContact O-N 2.87Å; L863-I924 HydrophobicContact CD1-CG2 4.5Å
864E86.7Confident89.9Confident74 Ų7487.4 Ų87.435%0.34642%0.419SS..Hα-helixtrans-62.5-47.1174.9-74.5178.4-167.900112.1K860 R861 M867 K868K860-E864 WeakPolarHBondContact O-CG 3.36Å; K860-E864 PolarHBondContact O-N 3.15Å; R861-E864 PolarHBondContact O-N 3.33Å; E864-M867 PolarHBondContact O-N 3.38Å; E864-K868 WeakPolarHBondContact O-CG 3.48Å; E864-K868 PolarHBondContact O-N 3.46Å
865D91.1Very high90.2Very high63 Ų6388.1 Ų88.134%0.33742%0.42SS..Hα-helixtrans-66-39-179.7-68.1-17.9000111.1R861 M867 K868 L869R861-D865 IonicContact NE-OD2 3.11Å; R861-D865 WeakPolarHBondContact O-CB 3.38Å; R861-D865 PolarHBondContact O-N 2.83Å; D865-M867 VanDerWaalsContact C-N 3.34Å; D865-M867 PolarHBondContact O-N 3.33Å; D865-K868 PolarHBondContact O-N 2.92Å; D865-K868 IonicContact OD1-NZ 3.34Å; D865-K868 PolarHBondContact OD1-NZ 2.92Å; D865-L869 WeakPolarHBondContact O-CB 3.47Å; D865-L869 PolarHBondContact O-N 3.37Å
866A92Very high90.4Very high48 Ų4885.7 Ų85.740%0.39742%0.415SS..Hα-helixtrans-63.8-36.8173.400000113H862 K870H862-A866 VanDerWaalsContact O-CB 3.25Å; H862-A866 WeakPolarHBondContact O-CB 3.35Å; H862-A866 PolarHBondContact O-N 3.32Å; A866-K870 WeakPolarHBondContact O-CG 3.48Å; A866-K870 PolarHBondContact O-N 3.33Å
867M89Confident90.9Very high14 Ų1482.1 Ų82.17%0.06941%0.408CS..Hα-helixtrans-73-37.9176.1-68.6-58.1-72.400112L863 E864 D865 K870 E871 V917 Q920 R921L863-M867 VanDerWaalsContact O-CG 3.25Å; L863-M867 WeakPolarHBondContact O-CG 3.5Å; L863-M867 PolarHBondContact O-N 2.87Å; E864-M867 PolarHBondContact O-N 3.38Å; D865-M867 VanDerWaalsContact C-N 3.34Å; D865-M867 PolarHBondContact O-N 3.33Å; M867-K870 PolarHBondContact O-N 2.95Å; M867-K870 HydrophobicContact SD-CD 4.21Å; M867-E871 PolarHBondContact O-N 3.3Å; M867-V917 HydrophobicContact CE-CG1 3.69Å; M867-V917 WeakPolarHBondContact CE-O 3.47Å; M867-Q920 HydrophobicContact CE-CB 4.1Å; M867-R921 HydrophobicContact CB-CG 4.21Å; M867-R921 HydrophobicContact CE-CB 3.77Å
868K90.5Very high91.4Very high71 Ų7176.3 Ų76.331%0.30938%0.379SS..Hα-helixtrans-61.5-45.3172.4-71.2171.1-164.2155.90111.4E864 D865 K870 E871 E872E864-K868 WeakPolarHBondContact O-CG 3.48Å; E864-K868 PolarHBondContact O-N 3.46Å; D865-K868 PolarHBondContact O-N 2.92Å; D865-K868 IonicContact OD1-NZ 3.34Å; D865-K868 PolarHBondContact OD1-NZ 2.92Å; K868-K870 VanDerWaalsContact C-N 3.26Å; K868-K870 PolarHBondContact O-N 3.34Å; K868-E871 WeakPolarHBondContact O-CA 3.41Å; K868-E871 WeakPolarHBondContact O-CB 3.21Å; K868-E871 PolarHBondContact O-N 2.89Å; K868-E872 WeakPolarHBondContact O-CB 3.43Å; K868-E872 WeakPolarHBondContact O-CG 3.49Å; K868-E872 PolarHBondContact O-N 2.84Å
869L94Very high91.6Very high121 Ų12173.4 Ų73.463%0.63438%0.375SS*.Hα-helixtrans-62.5-35.4178.6-148.485.8000112D865 S873D865-L869 WeakPolarHBondContact O-CB 3.47Å; D865-L869 PolarHBondContact O-N 3.37Å; L869-S873 WeakPolarHBondContact O-CB 3.46Å; L869-S873 PolarHBondContact O-N 3.43Å; L869-S873 PolarHBondContact O-OG 3.31Å
870K92.9Very high91.8Very high109 Ų10972.1 Ų72.147%0.47438%0.375SS..Hα-helixtrans-67.2-40172.4-76.6177.6-178.7174.30112.2A866 M867 K868 S873 L874 V917A866-K870 WeakPolarHBondContact O-CG 3.48Å; A866-K870 PolarHBondContact O-N 3.33Å; M867-K870 PolarHBondContact O-N 2.95Å; M867-K870 HydrophobicContact SD-CD 4.21Å; K868-K870 VanDerWaalsContact C-N 3.26Å; K868-K870 PolarHBondContact O-N 3.34Å; K870-S873 WeakPolarHBondContact CA-OG 3.33Å; K870-S873 PolarHBondContact O-OG 2.97Å; K870-L874 WeakPolarHBondContact O-CB 3.46Å; K870-L874 VanDerWaalsContact O-CG 3.28Å; K870-L874 WeakPolarHBondContact O-CG 3.26Å; K870-L874 PolarHBondContact O-N 2.98Å; K870-L874 VanDerWaalsContact O-N 3.12Å; K870-V917 HydrophobicContact CB-CG1 4.15Å
871E93.3Very high92.2Very high46 Ų4671.1 Ų71.122%0.21537%0.371CS..Hα-helixtrans-64.8-49.4176.4-167.8177.2174.600111M867 K868 S873 L874 L875 L914 R921M867-E871 PolarHBondContact O-N 3.3Å; K868-E871 WeakPolarHBondContact O-CA 3.41Å; K868-E871 WeakPolarHBondContact O-CB 3.21Å; K868-E871 PolarHBondContact O-N 2.89Å; E871-S873 PolarHBondContact O-N 2.92Å; E871-L874 PolarHBondContact O-N 3.37Å; E871-L875 HydrophobicContact CG-CD1 4.26Å; E871-L875 WeakPolarHBondContact O-CB 3.28Å; E871-L875 WeakPolarHBondContact O-CG 3.31Å; E871-L875 PolarHBondContact O-N 3.5Å; E871-L914 HydrophobicContact CG-CD1 3.79Å; E871-R921 IonicContact OE2-NH1 3.81Å; E871-R921 PolarHBondContact OE2-NH1 3.02Å
872E93.8Very high92.4Very high116 Ų11665.9 Ų65.954%0.54236%0.356SS..Hα-helixtrans-61.7-42.7178.3-72.1171.9-173.800112.3K868 L875 A876K868-E872 WeakPolarHBondContact O-CB 3.43Å; K868-E872 WeakPolarHBondContact O-CG 3.49Å; K868-E872 PolarHBondContact O-N 2.84Å; E872-L875 PolarHBondContact O-N 3.44Å; E872-A876 WeakPolarHBondContact O-CB 3.4Å; E872-A876 PolarHBondContact O-N 2.82Å
873S94.9Very high92.6Very high69 Ų6962.6 Ų62.648%0.48335%0.35SS..Hα-helixtrans-67.2-36.6176.654.70000112.9L869 K870 E871 A877L869-S873 WeakPolarHBondContact O-CB 3.46Å; L869-S873 PolarHBondContact O-N 3.43Å; L869-S873 PolarHBondContact O-OG 3.31Å; K870-S873 WeakPolarHBondContact CA-OG 3.33Å; K870-S873 PolarHBondContact O-OG 2.97Å; E871-S873 PolarHBondContact O-N 2.92Å; S873-A877 WeakPolarHBondContact O-CB 3.46Å; S873-A877 PolarHBondContact O-N 2.87Å
874L95.4Very high92.7Very high24 Ų2464.3 Ų64.313%0.12636%0.356CS..Hα-helixtrans-68.4-41.2173-74.4173.7000111.8K870 E871 A877 I878 L910 R913 L914 V917K870-L874 WeakPolarHBondContact O-CB 3.46Å; K870-L874 VanDerWaalsContact O-CG 3.28Å; K870-L874 WeakPolarHBondContact O-CG 3.26Å; K870-L874 PolarHBondContact O-N 2.98Å; K870-L874 VanDerWaalsContact O-N 3.12Å; E871-L874 PolarHBondContact O-N 3.37Å; L874-A877 PolarHBondContact O-N 3.36Å; L874-I878 WeakPolarHBondContact O-CB 3.28Å; L874-I878 WeakPolarHBondContact O-CD1 3.37Å; L874-I878 WeakPolarHBondContact O-CG1 3.33Å; L874-I878 PolarHBondContact O-N 3.22Å; L874-L910 HydrophobicContact CD2-CD2 4.1Å; L874-R913 HydrophobicContact CD1-CB 4.49Å; L874-R913 HydrophobicContact CD1-CG 4.15Å; L874-R913 HydrophobicContact CD2-CB 4.36Å; L874-R913 HydrophobicContact CD2-CG 4.16Å; L874-L914 HydrophobicContact CB-CD1 4.06Å; L874-L914 HydrophobicContact CD1-CB 4.26Å; L874-L914 HydrophobicContact CD1-CD1 4.25Å; L874-V917 HydrophobicContact CD1-CB 4.27Å; L874-V917 HydrophobicContact CD1-CG2 3.83Å
875L94.4Very high92.8Very high87 Ų8761.3 Ų61.346%0.45534%0.342SS..Hα-helixtrans-64.7-40.9175.6-74.2171.9000111.8E871 E872 I878 G879 L914E871-L875 HydrophobicContact CG-CD1 4.26Å; E871-L875 WeakPolarHBondContact O-CB 3.28Å; E871-L875 WeakPolarHBondContact O-CG 3.31Å; E871-L875 PolarHBondContact O-N 3.5Å; E872-L875 PolarHBondContact O-N 3.44Å; L875-I878 PolarHBondContact O-N 3.05Å; L875-G879 PolarHBondContact O-N 2.77Å; L875-L914 HydrophobicContact CD2-CD2 3.73Å; L875-L914 HydrophobicContact CG-CD1 4.5Å; L875-L914 HydrophobicContact CG-CD2 4.32Å
876A94.3Very high92.7Very high54 Ų5461 Ų6145%0.44635%0.348SS..Hα-helixtrans-61.6-47.8174.800000111.1E872 I878 G879 E880E872-A876 WeakPolarHBondContact O-CB 3.4Å; E872-A876 PolarHBondContact O-N 2.82Å; A876-I878 VanDerWaalsContact C-N 3.32Å; A876-I878 PolarHBondContact O-N 3.4Å; A876-G879 PolarHBondContact O-N 3.47Å; A876-G879 VanDerWaalsContact O-N 3.15Å; A876-E880 WeakPolarHBondContact O-CG 3.18Å; A876-E880 PolarHBondContact O-N 3.4Å
877A95.1Very high92.4Very high27 Ų2764 Ų6422%0.22336%0.357CS..Hα-helixtrans-61.6-38.7176.400000112.3S873 L874 E880 K881 L910S873-A877 WeakPolarHBondContact O-CB 3.46Å; S873-A877 PolarHBondContact O-N 2.87Å; L874-A877 PolarHBondContact O-N 3.36Å; A877-E880 PolarHBondContact O-N 2.94Å; A877-K881 VanDerWaalsContact O-CG 3.3Å; A877-K881 WeakPolarHBondContact O-CG 3.41Å; A877-K881 PolarHBondContact O-N 3.41Å; A877-K881 VanDerWaalsContact O-N 3.09Å; A877-L910 HydrophobicContact CB-CD1 3.95Å
878I94.4Very high92.2Very high12 Ų1264.9 Ų64.96%0.06236%0.362CS..Hα-helixtrans-64.7-45.5173.9-70.7161.7000110.5L874 L875 A876 E880 K881 D882 K907 L910 L911 L914L874-I878 WeakPolarHBondContact O-CB 3.28Å; L874-I878 WeakPolarHBondContact O-CD1 3.37Å; L874-I878 WeakPolarHBondContact O-CG1 3.33Å; L874-I878 PolarHBondContact O-N 3.22Å; L875-I878 PolarHBondContact O-N 3.05Å; A876-I878 VanDerWaalsContact C-N 3.32Å; A876-I878 PolarHBondContact O-N 3.4Å; I878-E880 VanDerWaalsContact C-N 3.31Å; I878-E880 PolarHBondContact O-N 3.3Å; I878-K881 PolarHBondContact O-N 3.5Å; I878-K881 VanDerWaalsContact O-N 3.11Å; I878-D882 PolarHBondContact O-N 3.24Å; I878-K907 HydrophobicContact CG2-CG 4.33Å; I878-L910 HydrophobicContact CD1-CB 4.1Å; I878-L910 HydrophobicContact CG1-CB 3.58Å; I878-L910 HydrophobicContact CG1-CD1 4.15Å; I878-L911 HydrophobicContact CD1-CD2 3.82Å; I878-L911 HydrophobicContact CD1-CG 4.12Å; I878-L914 HydrophobicContact CD1-CB 4.48Å; I878-L914 HydrophobicContact CD1-CD2 4Å
879G92.6Very high91.9Very high37 Ų3767.1 Ų67.138%0.38137%0.374SS..Hα-helixtrans-59.9-38.9177.200000112.8L875 A876 D882 A883L875-G879 PolarHBondContact O-N 2.77Å; A876-G879 PolarHBondContact O-N 3.47Å; A876-G879 VanDerWaalsContact O-N 3.15Å; G879-D882 PolarHBondContact O-N 3.13Å; G879-A883 WeakPolarHBondContact O-CB 3.32Å; G879-A883 PolarHBondContact O-N 2.92Å
880E93.4Very high91.3Very high119 Ų11965.4 Ų65.456%0.55637%0.372SS*.Hα-helixtrans-62.7-45.6172-74.4176.1-176.500111.6A876 A877 I878 D882 A883 H884A876-E880 WeakPolarHBondContact O-CG 3.18Å; A876-E880 PolarHBondContact O-N 3.4Å; A877-E880 PolarHBondContact O-N 2.94Å; I878-E880 VanDerWaalsContact C-N 3.31Å; I878-E880 PolarHBondContact O-N 3.3Å; E880-D882 VanDerWaalsContact C-N 3.3Å; E880-D882 PolarHBondContact O-N 2.98Å; E880-A883 PolarHBondContact O-N 3.42Å; E880-H884 PolarHBondContact O-CD2 3.09Å; E880-H884 PolarHBondContact O-N 3.11Å
881K93.4Very high90.5Very high49 Ų4963 Ų6321%0.21337%0.369CS..Hα-helixtrans-61.6-39.7175.3-61.8-62.2167.1-179.60111.6A877 I878 H884 I885 L903 K907 L910A877-K881 VanDerWaalsContact O-CG 3.3Å; A877-K881 WeakPolarHBondContact O-CG 3.41Å; A877-K881 PolarHBondContact O-N 3.41Å; A877-K881 VanDerWaalsContact O-N 3.09Å; I878-K881 PolarHBondContact O-N 3.5Å; I878-K881 VanDerWaalsContact O-N 3.11Å; K881-H884 PolarHBondContact O-N 2.79Å; K881-I885 WeakPolarHBondContact O-CB 3.24Å; K881-I885 WeakPolarHBondContact O-CD1 3.45Å; K881-I885 VanDerWaalsContact O-CG1 3.23Å; K881-I885 WeakPolarHBondContact O-CG1 3.36Å; K881-I885 PolarHBondContact O-N 3.32Å; K881-L903 HydrophobicContact CD-CD2 3.72Å; K881-K907 HydrophobicContact CB-CB 4.36Å; K881-L910 HydrophobicContact CG-CD1 4.04Å
882D94Very high89.3Confident59 Ų5970.8 Ų70.832%0.31641%0.405SS..Hα-helixtrans-66.2-40.6176.5-79.6-29.1000112.5I878 G879 E880 I885 A886 K907I878-D882 PolarHBondContact O-N 3.24Å; G879-D882 PolarHBondContact O-N 3.13Å; E880-D882 VanDerWaalsContact C-N 3.3Å; E880-D882 PolarHBondContact O-N 2.98Å; D882-I885 PolarHBondContact O-N 3.41Å; D882-A886 WeakPolarHBondContact O-CB 3.45Å; D882-A886 PolarHBondContact O-N 3.33Å; D882-K907 VanDerWaalsContact OD1-CD 3.27Å; D882-K907 WeakPolarHBondContact OD1-CD 3.34Å; D882-K907 WeakPolarHBondContact OD1-CE 3.21Å; D882-K907 IonicContact OD1-NZ 2.81Å; D882-K907 PolarHBondContact OD1-NZ 2.87Å; D882-K907 IonicContact OD2-NZ 2.72Å; D882-K907 PolarHBondContact OD2-NZ 3.01Å
883A92.5Very high88.2Confident55 Ų5567.9 Ų67.946%0.45540%0.398SS..Hα-helixtrans-62.8-42.1173.400000111.6G879 E880 A886 L887G879-A883 WeakPolarHBondContact O-CB 3.32Å; G879-A883 PolarHBondContact O-N 2.92Å; E880-A883 PolarHBondContact O-N 3.42Å; A883-A886 PolarHBondContact O-N 2.85Å; A883-L887 WeakPolarHBondContact O-CB 3.3Å; A883-L887 VanDerWaalsContact O-CG 3.32Å; A883-L887 WeakPolarHBondContact O-CG 3.39Å; A883-L887 PolarHBondContact O-N 3.37Å
884H88.3Confident86.8Confident96 Ų9673.3 Ų73.344%0.44442%0.416SS..Hα-helixtrans-65.3-41.7175.6-70.5-53.6000112.7E880 K881 L887 L888 L903E880-H884 PolarHBondContact O-CD2 3.09Å; E880-H884 PolarHBondContact O-N 3.11Å; K881-H884 PolarHBondContact O-N 2.79Å; H884-L887 PolarHBondContact O-N 2.99Å; H884-L888 WeakPolarHBondContact O-CB 3.49Å; H884-L888 WeakPolarHBondContact O-CG 3.49Å; H884-L888 PolarHBondContact O-N 3.34Å; H884-L903 HydrophobicContact CB-CD1 3.73Å
885I89.3Confident85.6Confident11 Ų1179.9 Ų79.96%0.05644%0.443CS..Hα-helixtrans-61.2-49175.1-71.3163.1000109.7K881 D882 L887 L888 E889 V900 L903 Q904 K907K881-I885 WeakPolarHBondContact O-CB 3.24Å; K881-I885 WeakPolarHBondContact O-CD1 3.45Å; K881-I885 VanDerWaalsContact O-CG1 3.23Å; K881-I885 WeakPolarHBondContact O-CG1 3.36Å; K881-I885 PolarHBondContact O-N 3.32Å; D882-I885 PolarHBondContact O-N 3.41Å; I885-L887 VanDerWaalsContact C-N 3.32Å; I885-L887 PolarHBondContact O-N 3.14Å; I885-L888 PolarHBondContact O-N 2.8Å; I885-L888 VanDerWaalsContact O-N 3.14Å; I885-E889 VanDerWaalsContact CG2-CD 3.46Å; I885-E889 HydrophobicContact CG2-CG 4.02Å; I885-E889 VanDerWaalsContact CG2-OE1 3.25Å; I885-E889 WeakPolarHBondContact CG2-OE1 3.49Å; I885-E889 WeakPolarHBondContact O-CB 3.4Å; I885-E889 VanDerWaalsContact O-CG 3.31Å; I885-E889 WeakPolarHBondContact O-CG 3.15Å; I885-E889 PolarHBondContact O-N 2.9Å; I885-V900 HydrophobicContact CG2-CG1 4.13Å; I885-L903 HydrophobicContact CD1-CB 4.05Å; I885-L903 HydrophobicContact CG1-CB 3.68Å; I885-L903 HydrophobicContact CG1-CD1 4.18Å; I885-Q904 HydrophobicContact CD1-CG 3.82Å; I885-Q904 HydrophobicContact CG1-CG 4.5Å; I885-K907 HydrophobicContact CD1-CD 4.36Å
886A88.7Confident84.7Confident56 Ų5676.1 Ų76.146%0.46342%0.424SS..Hα-helixtrans-59.4-40.6178.800000112.7D882 A883 S890D882-A886 WeakPolarHBondContact O-CB 3.45Å; D882-A886 PolarHBondContact O-N 3.33Å; A883-A886 PolarHBondContact O-N 2.85Å; A886-S890 WeakPolarHBondContact O-CB 3.48Å; A886-S890 PolarHBondContact O-N 3.04Å
887L85.7Confident84.1Confident111 Ų11177.5 Ų77.558%0.58143%0.427SS*.Hα-helixtrans-65.7-41.3175.5-73.9171.9000112.3A883 H884 I885 S890 S891A883-L887 WeakPolarHBondContact O-CB 3.3Å; A883-L887 VanDerWaalsContact O-CG 3.32Å; A883-L887 WeakPolarHBondContact O-CG 3.39Å; A883-L887 PolarHBondContact O-N 3.37Å; H884-L887 PolarHBondContact O-N 2.99Å; I885-L887 VanDerWaalsContact C-N 3.32Å; I885-L887 PolarHBondContact O-N 3.14Å; L887-S890 PolarHBondContact O-N 2.99Å; L887-S890 PolarHBondContact O-OG 2.63Å; L887-S891 PolarHBondContact O-N 3.47Å; L887-S891 PolarHBondContact O-OG 3.12Å
888L85Confident83.5Confident33 Ų3383.3 Ų83.317%0.17345%0.449CS..Hα-helixtrans-72.7-36.6178.4-75.5169.2000112.8H884 I885 S890 S891 S896 E899 V900 L903H884-L888 WeakPolarHBondContact O-CB 3.49Å; H884-L888 WeakPolarHBondContact O-CG 3.49Å; H884-L888 PolarHBondContact O-N 3.34Å; I885-L888 PolarHBondContact O-N 2.8Å; I885-L888 VanDerWaalsContact O-N 3.14Å; L888-S890 VanDerWaalsContact C-N 3.29Å; L888-S890 PolarHBondContact O-N 2.77Å; L888-S891 WeakPolarHBondContact O-CB 3.32Å; L888-S891 PolarHBondContact O-N 2.82Å; L888-S891 VanDerWaalsContact O-N 3.08Å; L888-S896 WeakPolarHBondContact O-CB 3.08Å; L888-S896 PolarHBondContact O-OG 3.14Å; L888-E899 HydrophobicContact CD1-CB 3.94Å; L888-E899 WeakPolarHBondContact CD2-OE2 3.33Å; L888-V900 HydrophobicContact CB-CG2 3.43Å; L888-V900 VanDerWaalsContact CB-CG2 3.43Å; L888-V900 HydrophobicContact CD1-CG2 4.16Å; L888-V900 HydrophobicContact CG-CG2 4.46Å; L888-L903 HydrophobicContact CD1-CD1 3.47Å; L888-L903 VanDerWaalsContact CD1-CD1 3.47Å
889E84.1Confident83.1Confident119 Ų11987.6 Ų87.656%0.55647%0.469SS*.Hα-helixtrans-66.4-32174.3-74177.5170.300111.7I885 S891 V900I885-E889 VanDerWaalsContact CG2-CD 3.46Å; I885-E889 HydrophobicContact CG2-CG 4.02Å; I885-E889 VanDerWaalsContact CG2-OE1 3.25Å; I885-E889 WeakPolarHBondContact CG2-OE1 3.49Å; I885-E889 WeakPolarHBondContact O-CB 3.4Å; I885-E889 VanDerWaalsContact O-CG 3.31Å; I885-E889 WeakPolarHBondContact O-CG 3.15Å; I885-E889 PolarHBondContact O-N 2.9Å; E889-S891 VanDerWaalsContact C-N 3.26Å; E889-S891 PolarHBondContact O-N 3.14Å; E889-V900 HydrophobicContact CG-CG1 4.28Å; E889-V900 HydrophobicContact CG-CG2 4.06Å
890S82.2Confident82.9Confident84 Ų8486.3 Ų86.359%0.58745%0.454SS*.Hα-helixtrans-72.1-20.9171.877.70000113.4A886 L887 L888A886-S890 WeakPolarHBondContact O-CB 3.48Å; A886-S890 PolarHBondContact O-N 3.04Å; L887-S890 PolarHBondContact O-N 2.99Å; L887-S890 PolarHBondContact O-OG 2.63Å; L888-S890 VanDerWaalsContact C-N 3.29Å; L888-S890 PolarHBondContact O-N 2.77Å
891S75.7Confident82.7Confident60 Ų6084.8 Ų84.842%0.4245%0.447SS..SBendtrans-88.7108.2178.9-60.70000109.6L887 L888 E889 S893 S896L887-S891 PolarHBondContact O-N 3.47Å; L887-S891 PolarHBondContact O-OG 3.12Å; L888-S891 WeakPolarHBondContact O-CB 3.32Å; L888-S891 PolarHBondContact O-N 2.82Å; L888-S891 VanDerWaalsContact O-N 3.08Å; E889-S891 VanDerWaalsContact C-N 3.26Å; E889-S891 PolarHBondContact O-N 3.14Å; S891-S893 PolarHBondContact O-N 3.02Å; S891-S896 PolarHBondContact O-OG 3.42Å
892Q67.9Low82.5Confident208 Ų20887.1 Ų87.197%0.97246%0.459SS*.  trans-71.456.4-177.2-64.5178-3.300113.8
893S71.3Confident82.4Confident56 Ų5685.4 Ų85.439%0.39245%0.449SS..  trans-115.3138.8-178.1168.10000110.9S891 K895 S896S891-S893 PolarHBondContact O-N 3.02Å; S893-K895 PolarHBondContact O-N 2.86Å; S893-K895 PolarHBondContact OG-N 3.25Å; S893-K895 VanDerWaalsContact OG-N 3.14Å; S893-S896 PolarHBondContact O-N 2.94Å; S893-S896 VanDerWaalsContact O-N 3.15Å; S893-S896 PolarHBondContact O-OG 3.21Å
894Q65.8Low82.4Confident183 Ų18386.3 Ų86.386%0.85544%0.444SS*.Hα-helixtrans-62.7-30.1171.1-101177.2-6800112.7S896 V897Q894-S896 VanDerWaalsContact C-N 3.28Å; Q894-S896 PolarHBondContact O-N 3.05Å; Q894-V897 PolarHBondContact O-N 3.39Å
895K69.2Low82.6Confident161 Ų16188 Ų8870%0.745%0.446SS*.Hα-helixtrans-70.1-25176.3-65.6-174.9177.9-178.30112.4S893 V897 E899S893-K895 PolarHBondContact O-N 2.86Å; S893-K895 PolarHBondContact OG-N 3.25Å; S893-K895 VanDerWaalsContact OG-N 3.14Å; K895-V897 VanDerWaalsContact C-N 3.26Å; K895-V897 PolarHBondContact O-N 3.37Å; K895-E899 WeakPolarHBondContact O-CG 3.17Å; K895-E899 PolarHBondContact O-N 3.36Å
896S76.9Confident82.8Confident9 Ų990.3 Ų90.36%0.06346%0.457CS..Hα-helixtrans-70.5-23.7177.666.20000112.2L888 S891 S893 Q894 V900L888-S896 WeakPolarHBondContact O-CB 3.08Å; L888-S896 PolarHBondContact O-OG 3.14Å; S891-S896 PolarHBondContact O-OG 3.42Å; S893-S896 PolarHBondContact O-N 2.94Å; S893-S896 VanDerWaalsContact O-N 3.15Å; S893-S896 PolarHBondContact O-OG 3.21Å; Q894-S896 VanDerWaalsContact C-N 3.28Å; Q894-S896 PolarHBondContact O-N 3.05Å; S896-V900 VanDerWaalsContact O-CB 3.24Å; S896-V900 WeakPolarHBondContact O-CB 3.5Å; S896-V900 WeakPolarHBondContact O-CG2 3.23Å; S896-V900 PolarHBondContact O-N 2.64Å
897V81Confident83Confident82 Ų8290.1 Ų90.150%0.49745%0.446SS..Hα-helixtrans-66.7-49.3178.3-176.90000111.8Q894 K895 E899 V900 E901Q894-V897 PolarHBondContact O-N 3.39Å; K895-V897 VanDerWaalsContact C-N 3.26Å; K895-V897 PolarHBondContact O-N 3.37Å; V897-E899 VanDerWaalsContact C-N 3.33Å; V897-E899 PolarHBondContact O-N 2.89Å; V897-V900 PolarHBondContact O-N 2.9Å; V897-E901 WeakPolarHBondContact O-CG 3.49Å; V897-E901 PolarHBondContact O-N 2.89Å
898E82.7Confident83.4Confident149 Ų14989 Ų8970%0.69644%0.441SS*.Hα-helixtrans-64.7-38.3179.2-67179.5-178.600111.8E901 H902E898-E901 PolarHBondContact O-N 2.88Å; E898-H902 PolarHBondContact O-N 3.46Å
899E86Confident83.9Confident102 Ų10293.6 Ų93.648%0.47746%0.459SS..Hα-helixtrans-67.2-40.5175.5-70.2176.5-169.900112L888 K895 V897 H902 L903L888-E899 HydrophobicContact CD1-CB 3.94Å; L888-E899 WeakPolarHBondContact CD2-OE2 3.33Å; K895-E899 WeakPolarHBondContact O-CG 3.17Å; K895-E899 PolarHBondContact O-N 3.36Å; V897-E899 VanDerWaalsContact C-N 3.33Å; V897-E899 PolarHBondContact O-N 2.89Å; E899-H902 PolarHBondContact O-N 3Å; E899-L903 WeakPolarHBondContact O-CG 3.35Å; E899-L903 PolarHBondContact O-N 3.44Å
900V87.7Confident84.5Confident11 Ų1189.9 Ų89.97%0.06744%0.443CS..Hα-helixtrans-61.4-47.5173.4165.30000110.7I885 L888 E889 S896 V897 H902 L903 Q904I885-V900 HydrophobicContact CG2-CG1 4.13Å; L888-V900 HydrophobicContact CB-CG2 3.43Å; L888-V900 VanDerWaalsContact CB-CG2 3.43Å; L888-V900 HydrophobicContact CD1-CG2 4.16Å; L888-V900 HydrophobicContact CG-CG2 4.46Å; E889-V900 HydrophobicContact CG-CG1 4.28Å; E889-V900 HydrophobicContact CG-CG2 4.06Å; S896-V900 VanDerWaalsContact O-CB 3.24Å; S896-V900 WeakPolarHBondContact O-CB 3.5Å; S896-V900 WeakPolarHBondContact O-CG2 3.23Å; S896-V900 PolarHBondContact O-N 2.64Å; V897-V900 PolarHBondContact O-N 2.9Å; V900-H902 VanDerWaalsContact C-N 3.27Å; V900-H902 PolarHBondContact O-N 3.36Å; V900-L903 PolarHBondContact O-N 3.46Å; V900-Q904 HydrophobicContact CG1-CG 4.26Å; V900-Q904 WeakPolarHBondContact O-CB 3.27Å; V900-Q904 VanDerWaalsContact O-CG 3.28Å; V900-Q904 WeakPolarHBondContact O-CG 3.48Å; V900-Q904 PolarHBondContact O-N 3.2Å
901E88.4Confident85.1Confident87 Ų8788.8 Ų88.841%0.40743%0.43SS..Hα-helixtrans-60-38.8176.3-73.4-171.8-179.200111.9V897 E898 R905V897-E901 WeakPolarHBondContact O-CG 3.49Å; V897-E901 PolarHBondContact O-N 2.89Å; E898-E901 PolarHBondContact O-N 2.88Å; E901-R905 VanDerWaalsContact O-CG 3.31Å; E901-R905 WeakPolarHBondContact O-CG 3.4Å; E901-R905 PolarHBondContact O-N 3.45Å; E901-R905 PolarHBondContact O-NH1 3.24Å; E901-R905 IonicContact OE2-CZ 3.46Å; E901-R905 IonicContact OE2-NH1 3.88Å; E901-R905 IonicContact OE2-NH2 2.93Å; E901-R905 PolarHBondContact OE2-NH2 3.3Å
902H90.3Very high86Confident98 Ų9892.7 Ų92.745%0.45444%0.435SS..Hα-helixtrans-65.7-44.1176.2177.7-98.9000112E898 E899 V900 R905 Q906E898-H902 PolarHBondContact O-N 3.46Å; E899-H902 PolarHBondContact O-N 3Å; V900-H902 VanDerWaalsContact C-N 3.27Å; V900-H902 PolarHBondContact O-N 3.36Å; H902-R905 PolarHBondContact O-N 2.85Å; H902-Q906 PolarHBondContact CE1-NE2 3.31Å; H902-Q906 WeakPolarHBondContact O-CG 3.44Å; H902-Q906 PolarHBondContact O-N 3.2Å
903L91.4Very high87.2Confident22 Ų2288 Ų8812%0.11541%0.409CS..Hα-helixtrans-65.6-37.4175.6-71.4171.4000112.3K881 H884 I885 L888 E899 V900 Q906 K907K881-L903 HydrophobicContact CD-CD2 3.72Å; H884-L903 HydrophobicContact CB-CD1 3.73Å; I885-L903 HydrophobicContact CD1-CB 4.05Å; I885-L903 HydrophobicContact CG1-CB 3.68Å; I885-L903 HydrophobicContact CG1-CD1 4.18Å; L888-L903 HydrophobicContact CD1-CD1 3.47Å; L888-L903 VanDerWaalsContact CD1-CD1 3.47Å; E899-L903 WeakPolarHBondContact O-CG 3.35Å; E899-L903 PolarHBondContact O-N 3.44Å; V900-L903 PolarHBondContact O-N 3.46Å; L903-Q906 PolarHBondContact O-N 2.93Å; L903-K907 WeakPolarHBondContact O-CB 3.49Å; L903-K907 PolarHBondContact O-N 3.39Å
904Q92.6Very high88.3Confident75 Ų7586.3 Ų86.335%0.3540%0.395SS..Hα-helixtrans-61.4-45.8173.3-75.2169.6-8.500111.2I885 V900 Q906 K907 D908I885-Q904 HydrophobicContact CD1-CG 3.82Å; I885-Q904 HydrophobicContact CG1-CG 4.5Å; V900-Q904 HydrophobicContact CG1-CG 4.26Å; V900-Q904 WeakPolarHBondContact O-CB 3.27Å; V900-Q904 VanDerWaalsContact O-CG 3.28Å; V900-Q904 WeakPolarHBondContact O-CG 3.48Å; V900-Q904 PolarHBondContact O-N 3.2Å; Q904-Q906 VanDerWaalsContact C-N 3.27Å; Q904-Q906 PolarHBondContact O-N 2.8Å; Q904-K907 WeakPolarHBondContact O-CB 3.37Å; Q904-K907 PolarHBondContact O-N 3.25Å; Q904-D908 PolarHBondContact O-N 3.05Å
905R92.7Very high89.7Confident131 Ų13185 Ų8549%0.49439%0.387SS..Hα-helixtrans-60.7-35.7174.1-69.5177.2-160.11050.5112.5E901 H902 K909E901-R905 VanDerWaalsContact O-CG 3.31Å; E901-R905 WeakPolarHBondContact O-CG 3.4Å; E901-R905 PolarHBondContact O-N 3.45Å; E901-R905 PolarHBondContact O-NH1 3.24Å; E901-R905 IonicContact OE2-CZ 3.46Å; E901-R905 IonicContact OE2-NH1 3.88Å; E901-R905 IonicContact OE2-NH2 2.93Å; E901-R905 PolarHBondContact OE2-NH2 3.3Å; H902-R905 PolarHBondContact O-N 2.85Å; R905-K909 WeakPolarHBondContact O-CG 3.31Å; R905-K909 PolarHBondContact O-N 3.45Å
906Q93Very high90.8Very high59 Ų5981.7 Ų81.728%0.27637%0.374SS..Hα-helixtrans-70.1-43.9174.7-71.1-171-10.700111.9H902 L903 Q904 D908 K909 L910H902-Q906 PolarHBondContact CE1-NE2 3.31Å; H902-Q906 WeakPolarHBondContact O-CG 3.44Å; H902-Q906 PolarHBondContact O-N 3.2Å; L903-Q906 PolarHBondContact O-N 2.93Å; Q904-Q906 VanDerWaalsContact C-N 3.27Å; Q904-Q906 PolarHBondContact O-N 2.8Å; Q906-D908 VanDerWaalsContact C-N 3.33Å; Q906-D908 PolarHBondContact O-N 2.94Å; Q906-K909 WeakPolarHBondContact O-CB 3.4Å; Q906-K909 PolarHBondContact O-N 3.15Å; Q906-K909 VanDerWaalsContact O-N 3.15Å; Q906-L910 PolarHBondContact O-N 3.46Å
907K93.8Very high91.5Very high52 Ų5281.5 Ų81.523%0.22637%0.372CS..Hα-helixtrans-56.8-46173.5176.1-172.8175.71740111.3I878 K881 D882 I885 L903 Q904 K909 L910 L911I878-K907 HydrophobicContact CG2-CG 4.33Å; K881-K907 HydrophobicContact CB-CB 4.36Å; D882-K907 VanDerWaalsContact OD1-CD 3.27Å; D882-K907 WeakPolarHBondContact OD1-CD 3.34Å; D882-K907 WeakPolarHBondContact OD1-CE 3.21Å; D882-K907 IonicContact OD1-NZ 2.81Å; D882-K907 PolarHBondContact OD1-NZ 2.87Å; D882-K907 IonicContact OD2-NZ 2.72Å; D882-K907 PolarHBondContact OD2-NZ 3.01Å; I885-K907 HydrophobicContact CD1-CD 4.36Å; L903-K907 WeakPolarHBondContact O-CB 3.49Å; L903-K907 PolarHBondContact O-N 3.39Å; Q904-K907 WeakPolarHBondContact O-CB 3.37Å; Q904-K907 PolarHBondContact O-N 3.25Å; K907-K909 VanDerWaalsContact C-N 3.25Å; K907-K909 PolarHBondContact O-N 3.36Å; K907-L910 CarbonylContact O-C 3.34Å; K907-L910 WeakPolarHBondContact O-CB 3.46Å; K907-L910 PolarHBondContact O-N 3.15Å; K907-L911 HydrophobicContact CG-CD1 4.07Å; K907-L911 HydrophobicContact CG-CG 4.43Å; K907-L911 PolarHBondContact O-N 2.77Å
908D94.7Very high92Very high89 Ų8980.1 Ų80.148%0.47636%0.362SS..Hα-helixtrans-63.5-31.4178.3-71.6-20.4000112.7Q904 Q906 R912Q904-D908 PolarHBondContact O-N 3.05Å; Q906-D908 VanDerWaalsContact C-N 3.33Å; Q906-D908 PolarHBondContact O-N 2.94Å; D908-R912 WeakPolarHBondContact O-CG 3.43Å; D908-R912 PolarHBondContact O-N 3.2Å; D908-R912 VanDerWaalsContact O-N 3.12Å; D908-R912 PolarHBondContact O-NE 3.41Å
909K95.3Very high92.4Very high129 Ų12975.3 Ų75.356%0.56135%0.348SS*.Hα-helixtrans-67.8-44.2170.6-72.1170.8-178.1-177.70111.2R905 Q906 K907 R912 R913R905-K909 WeakPolarHBondContact O-CG 3.31Å; R905-K909 PolarHBondContact O-N 3.45Å; Q906-K909 WeakPolarHBondContact O-CB 3.4Å; Q906-K909 PolarHBondContact O-N 3.15Å; Q906-K909 VanDerWaalsContact O-N 3.15Å; K907-K909 VanDerWaalsContact C-N 3.25Å; K907-K909 PolarHBondContact O-N 3.36Å; K909-R912 VanDerWaalsContact CG-NH2 3.35Å; K909-R912 PolarHBondContact O-N 3.37Å; K909-R913 PolarHBondContact O-N 2.72Å
910L95.5Very high92.5Very high41 Ų4174.4 Ų74.422%0.21534%0.344CS..Hα-helixtrans-65-40.3177.1-67.6174.3000112.1L874 A877 I878 K881 Q906 K907 R912 R913 L914L874-L910 HydrophobicContact CD2-CD2 4.1Å; A877-L910 HydrophobicContact CB-CD1 3.95Å; I878-L910 HydrophobicContact CD1-CB 4.1Å; I878-L910 HydrophobicContact CG1-CB 3.58Å; I878-L910 HydrophobicContact CG1-CD1 4.15Å; K881-L910 HydrophobicContact CG-CD1 4.04Å; Q906-L910 PolarHBondContact O-N 3.46Å; K907-L910 CarbonylContact O-C 3.34Å; K907-L910 WeakPolarHBondContact O-CB 3.46Å; K907-L910 PolarHBondContact O-N 3.15Å; L910-R912 VanDerWaalsContact C-N 3.35Å; L910-R912 PolarHBondContact O-N 2.96Å; L910-R913 CarbonylContact O-C 3.57Å; L910-R913 WeakPolarHBondContact O-CB 3.35Å; L910-R913 PolarHBondContact O-N 3.06Å; L910-R913 VanDerWaalsContact O-N 3.14Å; L910-L914 WeakPolarHBondContact O-CB 3.27Å; L910-L914 PolarHBondContact O-N 2.98Å
911L94.9Very high92.6Very high60 Ų6078.2 Ų78.231%0.31436%0.357SS..Hα-helixtrans-63.1-39.4174.9-78170.8000112.2I878 K907 R913 L914 K915I878-L911 HydrophobicContact CD1-CD2 3.82Å; I878-L911 HydrophobicContact CD1-CG 4.12Å; K907-L911 HydrophobicContact CG-CD1 4.07Å; K907-L911 HydrophobicContact CG-CG 4.43Å; K907-L911 PolarHBondContact O-N 2.77Å; L911-R913 VanDerWaalsContact C-N 3.35Å; L911-L914 PolarHBondContact O-N 3.28Å; L911-K915 WeakPolarHBondContact O-CG 3.29Å; L911-K915 PolarHBondContact O-N 3.33Å
912R94.7Very high92.4Very high142 Ų14279 Ų7954%0.53636%0.363SS..Hα-helixtrans-62.9-43.5171.5-79.5-176.3-72.5147.1-12.7111.3D908 K909 L910 L914 K915 E916D908-R912 WeakPolarHBondContact O-CG 3.43Å; D908-R912 PolarHBondContact O-N 3.2Å; D908-R912 VanDerWaalsContact O-N 3.12Å; D908-R912 PolarHBondContact O-NE 3.41Å; K909-R912 VanDerWaalsContact CG-NH2 3.35Å; K909-R912 PolarHBondContact O-N 3.37Å; L910-R912 VanDerWaalsContact C-N 3.35Å; L910-R912 PolarHBondContact O-N 2.96Å; R912-L914 VanDerWaalsContact C-N 3.33Å; R912-L914 PolarHBondContact O-N 3.47Å; R912-K915 PolarHBondContact O-N 3.4Å; R912-E916 WeakPolarHBondContact O-CG 3.3Å; R912-E916 PolarHBondContact O-N 2.79Å
913R93.8Very high92.2Very high110 Ų11078.6 Ų78.642%0.41536%0.364SS..Hα-helixtrans-63.5-38.1177.5-166.962.8-177.4136.35.2112.6L874 K909 L910 L911 E916 V917L874-R913 HydrophobicContact CD1-CB 4.49Å; L874-R913 HydrophobicContact CD1-CG 4.15Å; L874-R913 HydrophobicContact CD2-CB 4.36Å; L874-R913 HydrophobicContact CD2-CG 4.16Å; K909-R913 PolarHBondContact O-N 2.72Å; L910-R913 CarbonylContact O-C 3.57Å; L910-R913 WeakPolarHBondContact O-CB 3.35Å; L910-R913 PolarHBondContact O-N 3.06Å; L910-R913 VanDerWaalsContact O-N 3.14Å; L911-R913 VanDerWaalsContact C-N 3.35Å; R913-E916 WeakPolarHBondContact CD-OE2 3.06Å; R913-E916 IonicContact CZ-OE2 3.44Å; R913-E916 IonicContact NE-OE2 3.73Å; R913-E916 IonicContact NH1-OE2 3.88Å; R913-E916 PolarHBondContact NH1-OE2 3.15Å; R913-E916 WeakPolarHBondContact O-CB 3.36Å; R913-E916 PolarHBondContact O-N 3.26Å; R913-V917 WeakPolarHBondContact O-CG2 3.45Å; R913-V917 PolarHBondContact O-N 3.38Å
914L94.9Very high91.7Very high20 Ų2080.2 Ų80.211%0.10537%0.372CS..Hα-helixtrans-62.6-44.3174.3-178.764.5000111.6E871 L874 L875 I878 L910 L911 R912 E916 V917 N918E871-L914 HydrophobicContact CG-CD1 3.79Å; L874-L914 HydrophobicContact CB-CD1 4.06Å; L874-L914 HydrophobicContact CD1-CB 4.26Å; L874-L914 HydrophobicContact CD1-CD1 4.25Å; L875-L914 HydrophobicContact CD2-CD2 3.73Å; L875-L914 HydrophobicContact CG-CD1 4.5Å; L875-L914 HydrophobicContact CG-CD2 4.32Å; I878-L914 HydrophobicContact CD1-CB 4.48Å; I878-L914 HydrophobicContact CD1-CD2 4Å; L910-L914 WeakPolarHBondContact O-CB 3.27Å; L910-L914 PolarHBondContact O-N 2.98Å; L911-L914 PolarHBondContact O-N 3.28Å; R912-L914 VanDerWaalsContact C-N 3.33Å; R912-L914 PolarHBondContact O-N 3.47Å; L914-E916 VanDerWaalsContact C-N 3.34Å; L914-E916 PolarHBondContact O-N 3.14Å; L914-V917 PolarHBondContact O-N 2.96Å; L914-N918 PolarHBondContact O-N 3.07Å
915K94Very high91.1Very high156 Ų15682.8 Ų82.868%0.67838%0.382SS*.Hα-helixtrans-61.3-41.4174.5-72.5178179.7-177.80112.1L911 R912 N918 A919L911-K915 WeakPolarHBondContact O-CG 3.29Å; L911-K915 PolarHBondContact O-N 3.33Å; R912-K915 PolarHBondContact O-N 3.4Å; K915-N918 PolarHBondContact O-N 3.26Å; K915-A919 WeakPolarHBondContact O-CB 3.44Å; K915-A919 PolarHBondContact O-N 3.2Å
916E93.3Very high90.5Very high91 Ų9180.6 Ų80.643%0.42538%0.381SS..Hα-helixtrans-63.4-44175.3-70.6166.4-163.800112.1R912 R913 L914 A919 Q920R912-E916 WeakPolarHBondContact O-CG 3.3Å; R912-E916 PolarHBondContact O-N 2.79Å; R913-E916 WeakPolarHBondContact CD-OE2 3.06Å; R913-E916 IonicContact CZ-OE2 3.44Å; R913-E916 IonicContact NE-OE2 3.73Å; R913-E916 IonicContact NH1-OE2 3.88Å; R913-E916 PolarHBondContact NH1-OE2 3.15Å; R913-E916 WeakPolarHBondContact O-CB 3.36Å; R913-E916 PolarHBondContact O-N 3.26Å; L914-E916 VanDerWaalsContact C-N 3.34Å; L914-E916 PolarHBondContact O-N 3.14Å; E916-A919 PolarHBondContact O-N 3.33Å; E916-Q920 WeakPolarHBondContact O-CB 3.31Å; E916-Q920 VanDerWaalsContact O-CG 3.28Å; E916-Q920 WeakPolarHBondContact O-CG 3.37Å; E916-Q920 PolarHBondContact O-N 3.3Å
917V91.7Very high89.7Confident5 Ų583.1 Ų83.13%0.0339%0.392CS..Hα-helixtrans-63.3-41.31771690000111M867 K870 L874 R913 L914 Q920 R921M867-V917 HydrophobicContact CE-CG1 3.69Å; M867-V917 WeakPolarHBondContact CE-O 3.47Å; K870-V917 HydrophobicContact CB-CG1 4.15Å; L874-V917 HydrophobicContact CD1-CB 4.27Å; L874-V917 HydrophobicContact CD1-CG2 3.83Å; R913-V917 WeakPolarHBondContact O-CG2 3.45Å; R913-V917 PolarHBondContact O-N 3.38Å; L914-V917 PolarHBondContact O-N 2.96Å; V917-Q920 PolarHBondContact O-N 2.92Å; V917-R921 PolarHBondContact O-N 2.91Å
918N91.2Very high88.7Confident53 Ų5381.8 Ų81.828%0.28339%0.387SS..Hα-helixtrans-66.7-38.1176.2-76.8-5000112.4L914 K915 R921 I922L914-N918 PolarHBondContact O-N 3.07Å; K915-N918 PolarHBondContact O-N 3.26Å; N918-R921 PolarHBondContact O-N 2.98Å; N918-I922 WeakPolarHBondContact O-CG1 3.39Å; N918-I922 PolarHBondContact O-N 2.82Å
919A91Very high87.5Confident49 Ų4979 Ų7941%0.40538%0.379SS..Hα-helixtrans-64.4-42.6172.100000111.8K915 E916 R921 I922 N923K915-A919 WeakPolarHBondContact O-CB 3.44Å; K915-A919 PolarHBondContact O-N 3.2Å; E916-A919 PolarHBondContact O-N 3.33Å; A919-R921 VanDerWaalsContact C-N 3.32Å; A919-R921 PolarHBondContact O-N 3.27Å; A919-I922 PolarHBondContact O-N 3.33Å; A919-N923 PolarHBondContact O-N 3.19Å
920Q87.9Confident86.2Confident82 Ų8277.3 Ų77.338%0.38338%0.376SS..Hα-helixtrans-61.8-39.3175.5-74.2177.32.500112.1M867 E916 V917 I922 N923 I924M867-Q920 HydrophobicContact CE-CB 4.1Å; E916-Q920 WeakPolarHBondContact O-CB 3.31Å; E916-Q920 VanDerWaalsContact O-CG 3.28Å; E916-Q920 WeakPolarHBondContact O-CG 3.37Å; E916-Q920 PolarHBondContact O-N 3.3Å; V917-Q920 PolarHBondContact O-N 2.92Å; Q920-I922 VanDerWaalsContact C-N 3.33Å; Q920-I922 PolarHBondContact O-N 3.02Å; Q920-N923 PolarHBondContact O-N 2.86Å; Q920-I924 VanDerWaalsContact O-CG1 3.29Å; Q920-I924 WeakPolarHBondContact O-CG1 3.4Å; Q920-I924 PolarHBondContact O-N 2.91Å
921R89.1Confident84.7Confident92 Ų9279.9 Ų79.935%0.34739%0.387SS..Hα-helixtrans-60-42.9177.1-174.4178173.8-168.7-5.7111.8M867 E871 V917 N918 A919 F925M867-R921 HydrophobicContact CB-CG 4.21Å; M867-R921 HydrophobicContact CE-CB 3.77Å; E871-R921 IonicContact OE2-NH1 3.81Å; E871-R921 PolarHBondContact OE2-NH1 3.02Å; V917-R921 PolarHBondContact O-N 2.91Å; N918-R921 PolarHBondContact O-N 2.98Å; A919-R921 VanDerWaalsContact C-N 3.32Å; A919-R921 PolarHBondContact O-N 3.27Å; R921-F925 PolarHBondContact O-N 3.13Å
922I84.2Confident83.3Confident103 Ų10380.6 Ų80.653%0.52839%0.391SS..Hα-helixtrans-67.2-44.8177.1-64.3168.2000110.6N918 A919 Q920 I924 F925 N926N918-I922 WeakPolarHBondContact O-CG1 3.39Å; N918-I922 PolarHBondContact O-N 2.82Å; A919-I922 PolarHBondContact O-N 3.33Å; Q920-I922 VanDerWaalsContact C-N 3.33Å; Q920-I922 PolarHBondContact O-N 3.02Å; I922-I924 PolarHBondContact O-N 3.43Å; I922-F925 PolarHBondContact O-N 2.77Å; I922-N926 PolarHBondContact O-N 3.46Å
923N86.1Confident81.9Confident89 Ų8978.5 Ų78.548%0.47639%0.39SS..Hα-helixtrans-62.6-45-179.5-73.61.7000112.5A919 Q920 F925 N926 E927A919-N923 PolarHBondContact O-N 3.19Å; Q920-N923 PolarHBondContact O-N 2.86Å; N923-F925 PolarHBondContact O-N 2.88Å; N923-N926 PolarHBondContact O-N 3.08Å; N923-E927 WeakPolarHBondContact O-CB 3.44Å; N923-E927 WeakPolarHBondContact O-CG 3.25Å; N923-E927 PolarHBondContact O-N 2.95Å
924I81.7Confident80.5Confident57 Ų5778.7 Ų78.729%0.29240%0.396SS..Hα-helixtrans-61.2-35.6178.2-67.6166.7000110.8L863 Q920 I922 Q928L863-I924 HydrophobicContact CD1-CG2 4.5Å; Q920-I924 VanDerWaalsContact O-CG1 3.29Å; Q920-I924 WeakPolarHBondContact O-CG1 3.4Å; Q920-I924 PolarHBondContact O-N 2.91Å; I922-I924 PolarHBondContact O-N 3.43Å; I924-Q928 WeakPolarHBondContact O-CB 3.24Å; I924-Q928 WeakPolarHBondContact O-CG 3.48Å; I924-Q928 PolarHBondContact O-N 3.47Å
925F79.3Confident78.9Confident128 Ų12881.7 Ų81.756%0.56141%0.411SS*.Hα-helixtrans-69.8-42177.8-163.5-93.5000112R921 I922 N923 Q928 G929R921-F925 PolarHBondContact O-N 3.13Å; I922-F925 PolarHBondContact O-N 2.77Å; N923-F925 PolarHBondContact O-N 2.88Å; F925-Q928 PolarHBondContact O-N 3.48Å; F925-G929 PolarHBondContact O-N 3.42Å; F925-G929 VanDerWaalsContact O-N 3.1Å
926N80.3Confident77.4Confident86 Ų8677.5 Ų77.546%0.4640%0.399SS..Hα-helixtrans-67.6-47.3177.3-68.1-12.1000111.7I922 N923 Q928 G929 D930I922-N926 PolarHBondContact O-N 3.46Å; N923-N926 PolarHBondContact O-N 3.08Å; N926-Q928 PolarHBondContact O-N 3.48Å; N926-G929 WeakPolarHBondContact O-CA 3.28Å; N926-G929 PolarHBondContact O-N 2.93Å; N926-D930 PolarHBondContact O-N 3.21Å
927E77.3Confident75.9Confident111 Ų11177 Ų7752%0.51940%0.402SS..Hα-helixtrans-59.2-35.3177.7-74.2175-174.100112N923 Q931N923-E927 WeakPolarHBondContact O-CB 3.44Å; N923-E927 WeakPolarHBondContact O-CG 3.25Å; N923-E927 PolarHBondContact O-N 2.95Å; E927-Q931 WeakPolarHBondContact O-CB 3.42Å; E927-Q931 VanDerWaalsContact O-CG 3.27Å; E927-Q931 WeakPolarHBondContact O-CG 3.5Å; E927-Q931 PolarHBondContact O-N 3.46Å
928Q71.3Confident74.4Confident25 Ų2582 Ų8212%0.11743%0.425CS..Hα-helixtrans-74.7-27.7175.1-74.4-179.220.300113.8K860 I924 F925 N926 L932K860-Q928 VanDerWaalsContact CG-OE1 3.31Å; I924-Q928 WeakPolarHBondContact O-CB 3.24Å; I924-Q928 WeakPolarHBondContact O-CG 3.48Å; I924-Q928 PolarHBondContact O-N 3.47Å; F925-Q928 PolarHBondContact O-N 3.48Å; N926-Q928 PolarHBondContact O-N 3.48Å; Q928-L932 WeakPolarHBondContact O-CB 3.45Å; Q928-L932 PolarHBondContact O-N 3.41Å
929G69.3Low72.9Confident29 Ų2985.9 Ų85.930%0.29945%0.445SS..Hα-helixtrans-66.6-50.6169.400000110.6F925 N926 Q931 L932 D933F925-G929 PolarHBondContact O-N 3.42Å; F925-G929 VanDerWaalsContact O-N 3.1Å; N926-G929 WeakPolarHBondContact O-CA 3.28Å; N926-G929 PolarHBondContact O-N 2.93Å; G929-Q931 PolarHBondContact O-N 3.37Å; G929-L932 WeakPolarHBondContact O-CA 3.31Å; G929-L932 VanDerWaalsContact O-CB 3.29Å; G929-L932 WeakPolarHBondContact O-CB 3.38Å; G929-L932 PolarHBondContact O-N 3.4Å; G929-D933 PolarHBondContact O-N 3.45Å
930D67.9Low71.4Confident94 Ų9491.1 Ų91.150%0.50346%0.459SS..Hα-helixtrans-62.3-40.5-179.3-66.6-19.4000112.2N926 L932 D933 Q934N926-D930 PolarHBondContact O-N 3.21Å; D930-L932 VanDerWaalsContact C-N 3.28Å; D930-L932 PolarHBondContact O-N 2.72Å; D930-D933 PolarHBondContact O-N 3.15Å; D930-Q934 WeakPolarHBondContact O-CB 3.35Å; D930-Q934 VanDerWaalsContact O-CG 3.29Å; D930-Q934 WeakPolarHBondContact O-CG 3.49Å; D930-Q934 PolarHBondContact O-N 3.47Å
931Q65.7Low69.8Low96 Ų9691.2 Ų91.245%0.44947%0.465SS..Hα-helixtrans-63.7-33.4173.6-76.1175.812.800112.4E927 G929 L935E927-Q931 WeakPolarHBondContact O-CB 3.42Å; E927-Q931 VanDerWaalsContact O-CG 3.27Å; E927-Q931 WeakPolarHBondContact O-CG 3.5Å; E927-Q931 PolarHBondContact O-N 3.46Å; G929-Q931 PolarHBondContact O-N 3.37Å; Q931-L935 WeakPolarHBondContact O-CB 3.06Å; Q931-L935 VanDerWaalsContact O-CG 3.23Å; Q931-L935 WeakPolarHBondContact O-CG 3.24Å; Q931-L935 PolarHBondContact O-N 2.82Å
932L64.2Low68Low75 Ų7590.9 Ų90.939%0.39348%0.477SS..Hα-helixtrans-70.6-42.3176.9-156.596000111Q928 G929 D930 T936Q928-L932 WeakPolarHBondContact O-CB 3.45Å; Q928-L932 PolarHBondContact O-N 3.41Å; G929-L932 WeakPolarHBondContact O-CA 3.31Å; G929-L932 VanDerWaalsContact O-CB 3.29Å; G929-L932 WeakPolarHBondContact O-CB 3.38Å; G929-L932 PolarHBondContact O-N 3.4Å; D930-L932 VanDerWaalsContact C-N 3.28Å; D930-L932 PolarHBondContact O-N 2.72Å; L932-T936 WeakPolarHBondContact O-CB 3.49Å; L932-T936 WeakPolarHBondContact O-CG2 3.33Å; L932-T936 PolarHBondContact O-N 2.79Å; L932-T936 PolarHBondContact O-OG1 3.27Å
933D65.7Low66.4Low98 Ų9889.8 Ų89.852%0.52448%0.478SS..Hα-helixtrans-68.1-41.5177.5-74.3-11.3000111.1G929 D930 T936 T937G929-D933 PolarHBondContact O-N 3.45Å; D930-D933 PolarHBondContact O-N 3.15Å; D933-T936 VanDerWaalsContact CA-OG1 3.31Å; D933-T936 WeakPolarHBondContact CA-OG1 3.3Å; D933-T936 PolarHBondContact O-N 3.35Å; D933-T936 PolarHBondContact O-OG1 2.99Å; D933-T937 WeakPolarHBondContact O-CG2 3.41Å; D933-T937 PolarHBondContact O-N 2.77Å; D933-T937 PolarHBondContact O-OG1 2.93Å
934Q64.9Low64.7Low114 Ų11487.8 Ų87.853%0.53347%0.474SS..Hα-helixtrans-60.2-51.5173.2-76.2173.511.400111.5D930 T936 T937 E938D930-Q934 WeakPolarHBondContact O-CB 3.35Å; D930-Q934 VanDerWaalsContact O-CG 3.29Å; D930-Q934 WeakPolarHBondContact O-CG 3.49Å; D930-Q934 PolarHBondContact O-N 3.47Å; Q934-T936 VanDerWaalsContact C-N 3.31Å; Q934-T936 PolarHBondContact O-N 3.37Å; Q934-T937 WeakPolarHBondContact CA-OG1 3.43Å; Q934-T937 PolarHBondContact O-N 3.4Å; Q934-T937 VanDerWaalsContact O-N 3.12Å; Q934-T937 PolarHBondContact O-OG1 3.45Å; Q934-E938 WeakPolarHBondContact O-CG 3.22Å; Q934-E938 PolarHBondContact O-N 3.19Å
935L60.5Low63.2Low83 Ų8390.4 Ų90.444%0.43549%0.492SS..Hα-helixtrans-62.8-36.3179.1-73.3171.7000112.5Q931 E938 L939Q931-L935 WeakPolarHBondContact O-CB 3.06Å; Q931-L935 VanDerWaalsContact O-CG 3.23Å; Q931-L935 WeakPolarHBondContact O-CG 3.24Å; Q931-L935 PolarHBondContact O-N 2.82Å; L935-E938 PolarHBondContact O-N 3.45Å; L935-L939 WeakPolarHBondContact O-CB 3.31Å; L935-L939 PolarHBondContact O-N 2.75Å
936T62.1Low61.7Low67 Ų6788.2 Ų88.241%0.41150%0.498SS..Hα-helixtrans-71.2-32.9175.447.50000112.5L932 D933 Q934 K940L932-T936 WeakPolarHBondContact O-CB 3.49Å; L932-T936 WeakPolarHBondContact O-CG2 3.33Å; L932-T936 PolarHBondContact O-N 2.79Å; L932-T936 PolarHBondContact O-OG1 3.27Å; D933-T936 VanDerWaalsContact CA-OG1 3.31Å; D933-T936 WeakPolarHBondContact CA-OG1 3.3Å; D933-T936 PolarHBondContact O-N 3.35Å; D933-T936 PolarHBondContact O-OG1 2.99Å; Q934-T936 VanDerWaalsContact C-N 3.31Å; Q934-T936 PolarHBondContact O-N 3.37Å; T936-K940 WeakPolarHBondContact O-CG 3.31Å; T936-K940 PolarHBondContact O-N 3.49Å; T936-K940 VanDerWaalsContact O-N 3.09Å
937T61.8Low60.1Low81 Ų8186.7 Ų86.750%0.49750%0.498SS..Hα-helixtrans-67.9-42.9170.856.50000112.2D933 Q934 L939 K940 T941D933-T937 WeakPolarHBondContact O-CG2 3.41Å; D933-T937 PolarHBondContact O-N 2.77Å; D933-T937 PolarHBondContact O-OG1 2.93Å; Q934-T937 WeakPolarHBondContact CA-OG1 3.43Å; Q934-T937 PolarHBondContact O-N 3.4Å; Q934-T937 VanDerWaalsContact O-N 3.12Å; Q934-T937 PolarHBondContact O-OG1 3.45Å; T937-L939 VanDerWaalsContact C-N 3.31Å; T937-L939 PolarHBondContact O-N 3.34Å; T937-K940 PolarHBondContact O-N 3.42Å; T937-T941 WeakPolarHBondContact O-CG2 3.48Å; T937-T941 PolarHBondContact O-N 2.81Å; T937-T941 PolarHBondContact O-OG1 3.25Å
938E60.8Low58.3Low110 Ų11088 Ų8851%0.51451%0.508SS..Hα-helixtrans-63-36.2175.9-72.4179.1176.600112.3Q934 L935 T941 S942Q934-E938 WeakPolarHBondContact O-CG 3.22Å; Q934-E938 PolarHBondContact O-N 3.19Å; L935-E938 PolarHBondContact O-N 3.45Å; E938-T941 WeakPolarHBondContact CA-OG1 3.27Å; E938-T941 PolarHBondContact O-OG1 3.14Å; E938-S942 WeakPolarHBondContact O-CB 3.37Å; E938-S942 PolarHBondContact O-OG 3.25Å; E938-S942 PolarHBondContact O-N 3.31Å
939L58.8Low57.1Low134 Ų13494.2 Ų94.270%0.70254%0.542SS*.Hα-helixtrans-68.2-40.6174.8-140.695.7000111.8L935 T937 S943L935-L939 WeakPolarHBondContact O-CB 3.31Å; L935-L939 PolarHBondContact O-N 2.75Å; T937-L939 VanDerWaalsContact C-N 3.31Å; T937-L939 PolarHBondContact O-N 3.34Å; L939-S943 WeakPolarHBondContact O-CB 3.49Å; L939-S943 PolarHBondContact O-N 3.18Å
940K59.5Low55.7Low160 Ų160100.8 Ų100.870%0.69657%0.565SS**Hα-helixtrans-67.6-40.4176.7-79.7178.9178.7177.20112T936 T937 S943 A944T936-K940 WeakPolarHBondContact O-CG 3.31Å; T936-K940 PolarHBondContact O-N 3.49Å; T936-K940 VanDerWaalsContact O-N 3.09Å; T937-K940 PolarHBondContact O-N 3.42Å; K940-S943 PolarHBondContact O-N 3.16Å; K940-A944 WeakPolarHBondContact O-CB 3.35Å; K940-A944 PolarHBondContact O-N 3.42Å
941T55.5Low54.5Low84 Ų84103.4 Ų103.452%0.51558%0.579SS.*Hα-helixtrans-67.6-39.7176.553.50000111.3T937 E938 S943 A944 V945T937-T941 WeakPolarHBondContact O-CG2 3.48Å; T937-T941 PolarHBondContact O-N 2.81Å; T937-T941 PolarHBondContact O-OG1 3.25Å; E938-T941 WeakPolarHBondContact CA-OG1 3.27Å; E938-T941 PolarHBondContact O-OG1 3.14Å; T941-S943 VanDerWaalsContact C-N 3.31Å; T941-S943 PolarHBondContact O-N 3.32Å; T941-A944 PolarHBondContact O-N 2.71Å; T941-V945 PolarHBondContact O-N 3.12Å; T941-V945 WeakPolarHBondContact O-CG2 3.41Å
942S51.9Low53.5Low84 Ų84106.6 Ų106.659%0.58760%0.599SS**Hα-helixtrans-63.3-36.7174.5-560000112.4E938E938-S942 WeakPolarHBondContact O-CB 3.37Å; E938-S942 PolarHBondContact O-OG 3.25Å; E938-S942 PolarHBondContact O-N 3.31Å
943S50.5Low52.6Low80 Ų80110.7 Ų110.756%0.55962%0.621SS**Hα-helixtrans-71.7-36.3172.7179.20000112.8L939 K940 T941 A946 A947L939-S943 WeakPolarHBondContact O-CB 3.49Å; L939-S943 PolarHBondContact O-N 3.18Å; K940-S943 PolarHBondContact O-N 3.16Å; T941-S943 VanDerWaalsContact C-N 3.31Å; T941-S943 PolarHBondContact O-N 3.32Å; S943-A946 PolarHBondContact O-N 3.39Å; S943-A947 PolarHBondContact O-N 3.25Å
944A49.8Very low51.3Low48 Ų48109.1 Ų109.140%0.39763%0.629SS.*Hα-helixtrans-69.5-36179.900000111.4K940 T941 A946 A947 N948K940-A944 WeakPolarHBondContact O-CB 3.35Å; K940-A944 PolarHBondContact O-N 3.42Å; T941-A944 PolarHBondContact O-N 2.71Å; A944-A946 PolarHBondContact O-N 3.39Å; A944-A947 PolarHBondContact O-N 3.07Å; A944-N948 WeakPolarHBondContact O-CB 3.02Å; A944-N948 PolarHBondContact O-N 3.15Å
945V50.9Low50.4Low111 Ų111112.8 Ų112.867%0.67365%0.646SS**Hα-helixtrans-60.8-26.4172.6175.50000111.8T941T941-V945 PolarHBondContact O-N 3.12Å; T941-V945 WeakPolarHBondContact O-CG2 3.41Å
946A46.9Very low49.8Very low83 Ų83116.3 Ų116.369%0.68667%0.665SS**Hα-helixtrans-84.9-15.8173.400000114.3S943 A944S943-A946 PolarHBondContact O-N 3.39Å; A944-A946 PolarHBondContact O-N 3.39Å
947A45.7Very low49Very low54 Ų54118.3 Ų118.345%0.44668%0.677SS.*Hα-helixtrans-101.2-17.8178.600000113.2S943 A944 D949 Q950S943-A947 PolarHBondContact O-N 3.25Å; A944-A947 PolarHBondContact O-N 3.07Å; A947-D949 PolarHBondContact O-N 2.85Å; A947-Q950 PolarHBondContact O-N 3.12Å
948N41Very low48.1Very low138 Ų138124 Ų12474%0.73870%0.698SS**THydrogen-bonded Turntrans-78.51.8-175-125.155000114.9A944 Q950A944-N948 WeakPolarHBondContact O-CB 3.02Å; A944-N948 PolarHBondContact O-N 3.15Å; N948-Q950 VanDerWaalsContact C-N 3.35Å
949D45Very low47.2Very low155 Ų155121.4 Ų121.483%0.82970%0.701SS**THydrogen-bonded Turntrans-94.115.7172.2-75.4-21.6000112.6A947A947-D949 PolarHBondContact O-N 2.85Å
950Q40.9Very low46.5Very low168 Ų168121.6 Ų121.679%0.78570%0.701SS**SBendtrans-124.1-0.3-175.6-103.1171.8-11.200118.4A947 N948A947-Q950 PolarHBondContact O-N 3.12Å; N948-Q950 VanDerWaalsContact C-N 3.35Å
951D42.7Very low45.5Very low148 Ų148126.3 Ų126.379%0.79172%0.715SS**SBendtrans-13019.9-172-73.5-32.2000116.9
952D44.8Very low44.8Very low163 Ų163129.3 Ų129.387%0.87275%0.748SS**SBendtrans-107.67.4-179.6-125.17.5000116.3
953D44.6Very low44.5Very low161 Ų161131.6 Ų131.686%0.86176%0.756SS**SBendtrans-112.122.2175.8-70.9-45.3000113.5
954G38.9Very low44.2Very low66 Ų66134.3 Ų134.368%0.6877%0.767SS**  trans-85.1-13.6-173.900000117.1
955E46.3Very low43.9Very low191 Ų191139.1 Ų139.189%0.89379%0.787SS**SBendtrans-95.4-4.4-168.7-69.6-160163.300116.6
956D46.5Very low43.5Very low157 Ų157140.8 Ų140.884%0.8479%0.794SS**SBendtrans-110.88.4-175.3-81.4-21.7000116.3
957V46Very low43.2Very low108 Ų108144.4 Ų144.466%0.65580%0.801SS**SBendtrans-103.4-6.4-175.7-166.40000114.9G959V957-G959 PolarHBondContact O-N 3.38Å; V957-G959 VanDerWaalsContact O-N 3.15Å
958E43.9Very low43.1Very low200 Ų200150.4 Ų150.494%0.93582%0.824SS**THydrogen-bonded Turntrans-76.45.8175.3-74.7-161.6158.400114.7
959G41.7Very low43.2Very low56 Ų56151.3 Ų151.358%0.57783%0.83SS**THydrogen-bonded Turntrans-94.3-3.7-179.800000117.8V957V957-G959 PolarHBondContact O-N 3.38Å; V957-G959 VanDerWaalsContact O-N 3.15Å
960I42.8Very low43.1Very low139 Ų139151 Ų15171%0.71383%0.831SS**SBendtrans-114.65-170.4-56.1-179.9000113.9
961W40.1Very low43.3Very low259 Ų259149.6 Ų149.698%0.98183%0.834SS**  trans-109.520.4166.6-70.882.7000113.9
962A41.1Very low43.3Very low147 Ų147149.7 Ų149.7100%1.21584%0.838SS**  trans-110.10155.600000108.4

Retrieved 962 of 962 residues in 1552.2 ms (Link to these results)