A0A076N9K1_MOUSE Loading...

Truncated Kidins220 isoform m1

AlphaFold DB , UniProt , Accession A0A076N9K1, Species MOUSE (Mus musculus, Mouse), Gene Kidins220, Length 729 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1V47Very low41.4Very low199 Ų199154.6 Ų154.6100%1.20683%0.827SS**  059.10-167.50000111.4
2R39.8Very low41.1Very low248 Ų248148.3 Ų148.394%0.93683%0.825SS**  trans-161.745.2165.7-153.1173-68.5-161.31.9112.4
3A48.7Very low40.7Very low107 Ų107149.6 Ų149.688%0.88483%0.829SS**SBendtrans-147.542173.100000108.7
4A41.3Very low40.2Very low81 Ų81145.9 Ų145.967%0.66983%0.827SS**  trans-157.9138.1-174.400000108.9
5R42.3Very low39.6Very low247 Ų247149.7 Ų149.793%0.93283%0.825SS**  trans66.8127.3-154.9-49.5174.4180177.4-2109.2
6E41.6Very low39.7Very low165 Ų165147.3 Ų147.377%0.77182%0.818SS**  cis-134.6163.926.4-69.4-171.3119.200111.3
7Q42.2Very low39.7Very low158 Ų158145.9 Ų145.974%0.73882%0.818SS**  cis-150.9171.2-5.3-122.417341.100110.7
8I39.7Very low39.9Very low132 Ų132147 Ų14768%0.67782%0.82SS**  trans-64.7175.1-179.351.8173.1000116.2
9N34.1Very low39.9Very low134 Ų134145.8 Ų145.872%0.71782%0.82SS**  trans83.9145.9164.9-57.6-24.9000116.5
10I37.8Very low39.8Very low155 Ų155146.5 Ų146.580%0.79582%0.821SS**  cis-150.1156.8-5.1-149.471.1000111
11G41.4Very low39.6Very low75 Ų75148 Ų14877%0.77382%0.821SS**  trans73.8165.6164.300000116.1
12G37.3Very low38.8Very low78 Ų78146.5 Ų146.580%0.80480%0.8SS**  cis166.8127.3-4.700000110.3
13L36.3Very low38.6Very low166 Ų166139.1 Ų139.187%0.86979%0.793SS**  trans-69.7140.7-176.1-68.1166.9000112.3
14A32.6Very low38.2Very low98 Ų98139.4 Ų139.481%0.8179%0.786SS**  trans-138127162.800000109.3
15Y32.6Very low38.4Very low203 Ų203140.1 Ų140.180%0.79678%0.783SS**PPolyproline II helixtrans-83.7154.4-176.1-80.6-106000112.3
16P41.1Very low37.9Very low110 Ų110139.2 Ų139.271%0.71478%0.78SS**PPolyproline II helixtrans-67.7143163.530.8-34.3000110.7
17P38.4Very low37.7Very low125 Ų125136.8 Ų136.881%0.81278%0.778SS**PPolyproline II helixtrans-79.5135.7-176.730.9-34.5000112.9
18L43.1Very low37.7Very low165 Ų165135 Ų13586%0.86478%0.781SS**PPolyproline II helixtrans-94.6131.1168.1-70.6172.4000110.7
19P40.9Very low37.4Very low125 Ų125134.6 Ų134.681%0.81279%0.79SS**PPolyproline II helixtrans-86128.3171.132.1-31.5000112.6
20L37.9Very low37.2Very low159 Ų159131.1 Ų131.183%0.83279%0.785SS**  trans-118.7154.1164.8-82.3167.5000106.9
21H35.5Very low37Very low178 Ų178134.7 Ų134.782%0.82479%0.79SS**  cis-150.4-176.54.2-170.563.2000109.2
22E31Very low36.6Very low167 Ų167135.9 Ų135.978%0.7879%0.787SS**  trans-102.1145.4-173.2-175.4-175.9138.800114.3
23A34.3Very low36.4Very low93 Ų93140.6 Ų140.677%0.76979%0.788SS**  trans-169144.5153.900000113.5
24P41.7Very low37Very low114 Ų114137.6 Ų137.674%0.7478%0.778SS**  trans-115.4-161.3177.245-36.8000112.5
25P44.9Very low36.8Very low96 Ų96137.1 Ų137.162%0.62378%0.775SS**  cis-128169.6-28.237.6-23000114.7
26R31.4Very low36.6Very low228 Ų228132.5 Ų132.586%0.8677%0.772SS**  trans171.2166.8132.2-96.4-178.6-156.384.7-8.4115.1
27P36.7Very low36Very low113 Ų113133.1 Ų133.173%0.73477%0.773SS**  trans-113.7-163-173.941.6-28.6000113.4
28P42.6Very low35.4Very low121 Ų121132.6 Ų132.679%0.78677%0.771SS**  -129.3152.2-5534.7-19.1000113.9
29S33.3Very low34.7Very low124 Ų124129.8 Ų129.887%0.86777%0.766SS**  trans-170.4145.5154.7-167.70000110.2
30G30.6Very low34.5Very low60 Ų60129.4 Ų129.462%0.61977%0.766SS**  cis134.874.4-900000115.5
31Y32.8Very low34.1Very low230 Ų230127.4 Ų127.490%0.90277%0.765SS**  trans-163.1154.4152.7-133.3-112.6000114.5
32S34Very low34Very low101 Ų101123.3 Ų123.371%0.70676%0.762SS**  trans50.594.6163.4-70.40000122.7
33Q31.8Very low34.2Very low176 Ų176121 Ų12182%0.82276%0.764SS**  trans-71-179.1135.1-72.6-85.1-42.100110.7
34P49.7Very low34Very low104 Ų104124.5 Ų124.568%0.67576%0.762SS**  cis-136.9-161.9-36.436-16.1000113.4
35A28.1Very low33.5Very low88 Ų88126 Ų12673%0.72776%0.764SS**  trans74.3155.6152.400000118.7
36S28.8Very low32.8Very low106 Ų106123.8 Ų123.874%0.74176%0.759SS**  cis-166.7161.2-16.3-107.60000111.8
37V28.2Very low33.6Very low123 Ų123119.2 Ų119.275%0.74576%0.759SS**  trans49.2105.5143.9-179.70000120
38C26.2Very low33.6Very low113 Ų113123.2 Ų123.276%0.76477%0.765SS**  trans56.4148.8131.6-53.60000124.9
39S28.4Very low33.8Very low107 Ų107123.4 Ų123.475%0.74877%0.767SS**  trans81.8106.8143.4-63.60000122.5
40S36.8Very low33.7Very low117 Ų117121.1 Ų121.182%0.81876%0.762SS**  53.8135.4112.1-50.80000123.6
41S29.3Very low33.8Very low116 Ų116121.4 Ų121.481%0.81177%0.765SS**  trans-139.5130.4147.4-77.70000107.2
42A34.4Very low34.1Very low93 Ų93117.4 Ų117.477%0.76977%0.765SS**  68.3136.163.500000111.5
43S33.4Very low34.1Very low118 Ų118119.3 Ų119.383%0.82577%0.771SS**  cis-162.417222.5-105.90000109.6
44F30.7Very low34.3Very low166 Ų166116 Ų11673%0.72877%0.768SS**  cis-177.9138.1-14.3153.3-92.8000109.5
45N31.2Very low34.3Very low146 Ų146116.1 Ų116.178%0.78177%0.769SS**  trans-170.5155.2137.1-117-52.4000113.4
46G30.4Very low34.4Very low50 Ų50120.6 Ų120.652%0.51577%0.774SS.*  trans-117.1-159.4-178.700000113.7
47P47.9Very low35.7Very low132 Ų132119.8 Ų119.886%0.85777%0.767SS**  cis-125.7179.921.439.6-23.5000117.2
48F37.5Very low35.9Very low197 Ų197123.7 Ų123.786%0.86478%0.776SS**  trans-92.6-179.9-175.1-78.4-77.3000113.4
49P46.2Very low36.4Very low125 Ų125123.3 Ų123.381%0.81278%0.775SS**  cis-121-179.38.741.1-25.8000114.3
50G31.1Very low36.8Very low75 Ų75122.8 Ų122.877%0.77377%0.771SS**  cis127146.56.200000110.4
51G33.4Very low36.8Very low66 Ų66128.1 Ų128.168%0.6878%0.775SS**  cis173.3155.4-6.700000111.3
52V37.6Very low37.1Very low147 Ų147132.4 Ų132.489%0.89178%0.775SS**  trans59.4164.4167.8-63.10000121
53V35.2Very low37.5Very low140 Ų140132.3 Ų132.385%0.84877%0.769SS**  trans92.4132.1165.8-173.10000119.1
54S36.4Very low37.8Very low107 Ų107129.8 Ų129.875%0.74876%0.761SS**  trans-142.9154.2157.9-1720000105.1
55P48.3Very low38.3Very low107 Ų107130.2 Ų130.270%0.69577%0.77SS**  cis-138.9177.516.545-28.5000117
56Q30.8Very low39.3Very low181 Ų181129 Ų12985%0.84677%0.773SS**  trans70.4-178.3148-128.7-166.4-9.500118.1
57P57.2Low39.9Very low90 Ų90129.7 Ų129.758%0.58478%0.78SS**  -120.2171.5-104.641.5-27.8000115.7
58H31.8Very low39.7Very low204 Ų204129.9 Ų129.994%0.94478%0.781SS**  trans-141.7161.3157.4-90.2-72.5000113.2
59S35.8Very low40.3Very low106 Ų106129.8 Ų129.874%0.74178%0.783SS**  trans-133.8169.5-171.6-175.90000111.3
60S38.2Very low40.1Very low95 Ų95130.3 Ų130.366%0.66478%0.775SS**  trans66.6118157.864.50000120.8
61Y36.2Very low41.2Very low229 Ų229132.1 Ų132.190%0.89877%0.773SS**  -116132.5126.8-85.5-103000105.4
62Y35.9Very low42Very low207 Ų207136.8 Ų136.881%0.81278%0.775SS**  cis76.6119.130.8-150-104.7000112
63S41.8Very low42.5Very low91 Ų91140 Ų14064%0.63677%0.772SS**  cis-168.2176.54.1-144.80000114.9
64G39.3Very low42.8Very low64 Ų64140.7 Ų140.766%0.6677%0.771SS**  trans95.8154.1150.900000117
65L42.8Very low43.4Very low176 Ų176146.7 Ų146.792%0.92178%0.777SS**  cis-147.3162.2-6-87.3174.2000110
66S52Low43.8Very low121 Ų121146.5 Ų146.585%0.84678%0.776SS**  trans-85.7136.5-17754.30000114.6
67G42.3Very low44.2Very low64 Ų64145.9 Ų145.966%0.6677%0.771SS**  trans-119.3171.3170.800000113.2
68P44.4Very low43.5Very low135 Ų135151 Ų15188%0.87778%0.784SS**PPolyproline II helixtrans-71.6145.8-161.527.2-35.5000115.4
69Q49.7Very low44.3Very low195 Ų195145.6 Ų145.691%0.91178%0.775SS**PPolyproline II helixtrans-72.9133.5177.4-72.8156-38.900112.1
70H41.6Very low44.6Very low137 Ų137145.2 Ų145.263%0.63477%0.77SS**PPolyproline II helixtrans-103.8130.8167.2-153.7-108.3000109.5F72H70-F72 AromaticContact CE1-CD2 3.74Å; H70-F72 AromaticContact ND1-CD2 3.71Å; H70-F72 PolarHBondContact O-N 3Å
71P54Low44.5Very low112 Ų112151.2 Ų151.273%0.72778%0.779SS**G310 helixtrans-64.2-9.8-168.6-26.235.5000117.1
72F50.1Low44.6Very low164 Ų164147.6 Ų147.672%0.71978%0.775SS**G310 helixtrans-83.9-11.6-166.6-82.3-90.8000115.8H70H70-F72 AromaticContact CE1-CD2 3.74Å; H70-F72 AromaticContact ND1-CD2 3.71Å; H70-F72 PolarHBondContact O-N 3Å
73Y48.6Very low44.5Very low216 Ų216147.8 Ų147.885%0.84778%0.775SS**G310 helixtrans-115.133.1-177.5-64.1-63.5000113.9
74N42.7Very low44.5Very low153 Ų153148.4 Ų148.482%0.81878%0.776SS**  trans-15477.5165.1-128.3-24.4000113.6
75R47.3Very low44.6Very low234 Ų234150.6 Ų150.688%0.88378%0.778SS**  trans-150.7127.1156.5-146.2171-167.51654112.1
76P57.2Low44.3Very low102 Ų102151.6 Ų151.666%0.66277%0.77SS**  trans-84.8-164170.935.1-33.8000111.4
77F40.3Very low43.3Very low169 Ų169156.6 Ų156.674%0.74177%0.772SS**  trans105.187.4171.8-68.4-88.6000118.1
78F42.3Very low42.9Very low197 Ų197162.4 Ų162.486%0.86478%0.775SS**  trans50.6147.6137.1-64.2-81.8000123.4
79A47.3Very low42.9Very low90 Ų90162.1 Ų162.174%0.74477%0.773SS**  trans-78.2178177.200000113.2
80P42.1Very low42Very low98 Ų98156.7 Ų156.764%0.63677%0.769SS**  -153.1170.310338.6-20.7000118.5
81Y36.8Very low41.7Very low221 Ų221154.1 Ų154.187%0.86778%0.78SS**  trans91.6135.8156.7-59.5-56.2000122.2
82L38.7Very low40.5Very low154 Ų154154 Ų15481%0.80678%0.781SS**  trans-88.8155.5-177.3-61.8140.7000110.9
83Y34.3Very low39.8Very low210 Ų210153.4 Ų153.482%0.82478%0.781SS**  trans-117.897.5155.1-165.5-88000110
84T42.2Very low39Very low105 Ų105150.9 Ų150.964%0.64478%0.777SS**PPolyproline II helixtrans-86.2126.9170.947.30000109.7R86T84-R86 PolarHBondContact O-N 3.25Å
85P39.9Very low38.6Very low110 Ų110151.3 Ų151.371%0.71478%0.778SS**PPolyproline II helixtrans-59.1130.6174.3-25.835.6000111.8Y87P85-Y87 PolarHBondContact O-N 3.22Å
86R36.6Very low38Very low197 Ų197147.4 Ų147.474%0.74377%0.773SS**PPolyproline II helixtrans-68.5118178.1-87.1-71.9-164.2105.61.3111.1T84T84-R86 PolarHBondContact O-N 3.25Å
87Y32.3Very low36.7Very low226 Ų226148.5 Ų148.589%0.88678%0.783SS**PPolyproline II helixtrans-65.5139.2152-97.2-102000109.8P85P85-Y87 PolarHBondContact O-N 3.22Å
88Y32Very low36.5Very low186 Ų186151.5 Ų151.573%0.72979%0.79SS**  trans-128.2130.7164.4-111.1-85.4000108.7
89P44.5Very low36Very low129 Ų129147.7 Ų147.784%0.83879%0.787SS**  trans-85.6129-179.332.5-32.8000111.6
90G32.1Very low35Very low80 Ų80149 Ų14983%0.82579%0.791SS**  trans174.4104.7174.100000110.4
91G33.8Very low34.7Very low83 Ų83151.1 Ų151.186%0.85680%0.802SS**  trans-104.1156.9-172.700000114
92S29.8Very low34.5Very low109 Ų109149.9 Ų149.976%0.76280%0.801SS**  trans-152.7119.2161.6-1670000112.4
93Q34.1Very low34.1Very low153 Ų153148.6 Ų148.672%0.71580%0.8SS**  trans34.8109137.2-51.8-65.8-6.600120.2
94H33.2Very low33.8Very low163 Ų163143.9 Ų143.976%0.75580%0.798SS**  trans64.4163.2150-67.6-104.2000116.5
95L34.6Very low33.5Very low161 Ų161146 Ų14684%0.84380%0.804SS**  cis-133.7155.821.1-75.2159.7000113
96I35.1Very low33.4Very low153 Ų153146.6 Ų146.679%0.78581%0.808SS**  trans-95.2123.3166.8-67161000108.7R98I96-R98 PolarHBondContact O-N 2.77Å
97S28.4Very low33.1Very low124 Ų124145.8 Ų145.887%0.86781%0.805SS**  trans-67.3111171.7-63.70000110.5
98R37Very low33Very low233 Ų233142.4 Ų142.488%0.87980%0.802SS**PPolyproline II helixtrans-84.1144.1177.5-72.2-177168.3-135.4-0.9111.8I96I96-R98 PolarHBondContact O-N 2.77Å
99S30.4Very low33.3Very low116 Ų116139.1 Ų139.181%0.81179%0.793SS**PPolyproline II helixtrans-66.5147.6158.750.20000110.6
100S28.2Very low32.7Very low117 Ų117138.9 Ų138.982%0.81879%0.785SS**PPolyproline II helixtrans-99.3116.6-175.2-173.50000111.8
101V34.4Very low32.8Very low144 Ų144142.4 Ų142.487%0.87379%0.785SS**  trans-133.7137.7159.8-175.20000107.3
102K32.2Very low32.6Very low194 Ų194141.8 Ų141.884%0.84378%0.778SS**  trans-126.8115.2-159169.9-172.8168.2-174.40111.8
103T30.5Very low32.9Very low127 Ų127145.2 Ų145.278%0.77979%0.787SS**  trans-139.3108.6170.951.70000112.2
104S28.8Very low33.3Very low112 Ų112146.9 Ų146.978%0.78380%0.795SS**  trans30.9119.215052.60000122.3
105L34.8Very low33.6Very low149 Ų149145.9 Ų145.978%0.7880%0.8SS**  trans-65.4163.7146.9-82.2169.6000111.1R107L105-R107 HydrophobicContact CD2-CB 4.44Å
106P38.5Very low33.7Very low122 Ų122145.6 Ų145.679%0.79280%0.798SS**  cis-117.116048.739.6-29.4000114.4
107R29.8Very low33.8Very low181 Ų181145.9 Ų145.968%0.68379%0.793SS**  cis77.497.529.9-168.4-179.3-176157.86115.8L105L105-R107 HydrophobicContact CD2-CB 4.44Å
108D31.1Very low34.3Very low155 Ų155146.9 Ų146.983%0.82978%0.784SS**  trans-148179.8131.4-136.3-41.1000111.4
109Q37.2Very low34.2Very low117 Ų117143 Ų14355%0.54778%0.781SS.*  trans-133.1164.3-155.3-60.7-175.8-32.500116.9
110N31.9Very low34.5Very low123 Ų123141.8 Ų141.866%0.65878%0.778SS**  trans98.2127.2151-58.7-58.1000120.9
111N34.1Very low34.9Very low155 Ų155140 Ų14083%0.82977%0.771SS**  trans36.1127.8136.7-49.9-11.2000119.1
112G30.1Very low34.9Very low69 Ų69142.6 Ų142.671%0.71177%0.773SS**  cis130.9172.730.500000110.5
113L37.6Very low34.9Very low181 Ų181137.2 Ų137.295%0.94877%0.773SS**  trans77.5131.6178.3-59.3173.1000118.5
114E42.3Very low35.1Very low188 Ų188139.7 Ų139.788%0.87978%0.78SS**  trans-84.3139.4167.2-55.5167.4118.200109.8
115V38.7Very low35.9Very low142 Ų142139.4 Ų139.486%0.86178%0.775SS**  trans-136.4125.8158.8179.10000110.2
116I37.7Very low35.8Very low156 Ų156137.7 Ų137.780%0.878%0.776SS**  trans-66134.6178.4-54152.2000110.7
117K36.1Very low35.9Very low158 Ų158138.1 Ų138.169%0.68778%0.779SS**  179.5138.2125-105.8-170.9158.8-131.90117.5
118E38.6Very low36Very low146 Ų146136 Ų13668%0.68279%0.786SS**  65.997.8124.5-149159.6-122.900120.5
119D35.5Very low36Very low152 Ų152133.4 Ų133.481%0.81379%0.786SS**  30.8123.8117.2-129.5-62000120.4
120A37.4Very low35.6Very low89 Ų89133.9 Ų133.974%0.73680%0.802SS**  179.4136.7116.700000114.6
121A36.2Very low35.5Very low81 Ų81133.4 Ų133.467%0.66981%0.809SS**  trans43.5125139.800000123.7
122E33.7Very low35.3Very low198 Ų198136.2 Ų136.293%0.92581%0.808SS**  50.9123.8126.6-55.3-173.1152.800122
123G32.6Very low35.2Very low81 Ų81137.8 Ų137.884%0.83580%0.796SS**  trans178.677168.900000115
124L35.5Very low34.9Very low178 Ų178137.9 Ų137.993%0.93279%0.789SS**  trans-82.1161.5173.9-82.5176.6000112.7
125P45.6Very low34.1Very low106 Ų106133.4 Ų133.469%0.68878%0.779SS**  trans-105.8162.4-146.539.8-38.5000116.1
126S31.2Very low33.6Very low114 Ų114137.6 Ų137.680%0.79778%0.779SS**  trans-179.8152.2143.6-81.60000108.7
127P40.7Very low33.5Very low130 Ų130136.1 Ų136.184%0.84478%0.778SS**  -139.5163.783.436.5-20.5000115.6
128T31.9Very low33.5Very low138 Ų138139.6 Ų139.685%0.84779%0.787SS**  trans-72.8164.1-179.9-230000113.1
129A32Very low33.3Very low99 Ų99142.7 Ų142.782%0.81880%0.798SS**  trans-66158.3177.300000114.2
130S28.1Very low33.2Very low127 Ų127143.5 Ų143.589%0.88880%0.797SS**  trans-138.5139.2155.9-1710000110.2
131S29.2Very low33.2Very low113 Ų113147.3 Ų147.379%0.7980%0.804SS**  trans-98.2140.4-178.6172.50000110.5
132R30.9Very low32.9Very low214 Ų214151 Ų15181%0.80881%0.809SS**  trans-153.8112155.6-142.7176163.4164.6-1.6116.2
133E28Very low32.9Very low102 Ų102148.7 Ų148.748%0.47780%0.798SS.*  trans48.1125.5141.5-65-171.5100.100122.8
134K30.7Very low33Very low183 Ų183149.8 Ų149.880%0.79678%0.784SS**  trans72.8143.8138.7-64.2166.1179.6160.70116.1
135S25.8Very low32.7Very low95 Ų95147.8 Ų147.866%0.66478%0.784SS**  cis-158.5171.59.690.70000113.3
136W28.1Very low31.9Very low230 Ų230148.7 Ų148.787%0.87178%0.783SS**  trans70.1100.3154.7-77.142.2000120.7
137T36.6Very low31.8Very low125 Ų125149.3 Ų149.377%0.76779%0.787SS**  40.6103.4127.657.90000120.8
138R36.2Very low31.3Very low231 Ų231145.6 Ų145.687%0.87277%0.773SS**  -151.6123.9114.8-155.8170.7-169.8157.33.2110.6
139K34.2Very low31.3Very low210 Ų210148.7 Ų148.791%0.91378%0.775SS**  trans-77.1126.8168.4-73.2-177.2176-177.50108.6
140Q33.1Very low31.2Very low169 Ų169151.4 Ų151.479%0.7978%0.776SS**  trans-148.495.4160.6-162.8151.8-0.300112
141L38Very low31.6Very low170 Ų170153.9 Ų153.989%0.8977%0.77SS**  trans5870.7150.8-141.2138.5000118.5
142M29.3Very low31.5Very low158 Ų158156.6 Ų156.678%0.77877%0.77SS**  trans-106124.3136.3-149.5-175.2154.900103.5L144M142-L144 HydrophobicContact CE-CD1 4.42Å
143E34Very low31.9Very low150 Ų150157.1 Ų157.170%0.70177%0.773SS**  177162.676.1-94.4-163.614000107.3
144L33.2Very low32Very low103 Ų103160.1 Ų160.154%0.53979%0.787SS.*  cis-165.3150.9-18.4-165.276000107.6M142 D146M142-L144 HydrophobicContact CE-CD1 4.42Å; L144-D146 WeakPolarHBondContact CD1-OD2 3.39Å; L144-D146 WeakPolarHBondContact CD2-OD2 3.48Å; L144-D146 WeakPolarHBondContact CG-OD2 3.45Å
145C29.4Very low32.4Very low136 Ų136156.5 Ų156.592%0.91979%0.79SS**  trans-163.2100.3142.7-101.10000108.7
146D29.5Very low32.6Very low126 Ų126156.9 Ų156.967%0.67479%0.793SS**  trans-77.8146.1-177.8-80-71.5000114L144L144-D146 WeakPolarHBondContact CD1-OD2 3.39Å; L144-D146 WeakPolarHBondContact CD2-OD2 3.48Å; L144-D146 WeakPolarHBondContact CG-OD2 3.45Å
147S29.1Very low32.8Very low126 Ų126151.7 Ų151.788%0.88179%0.787SS**  trans-152.485.1136.854.90000110.1
148G30Very low33Very low53 Ų53151.4 Ų151.455%0.54679%0.787SS.*  trans-84.6-177.2178.500000114.7
149F32.2Very low32.8Very low202 Ų202144.7 Ų144.789%0.88678%0.781SS**  trans71.7130.2-177.5-56.1-86.5000114.9
150N29.6Very low33.1Very low157 Ų157141.5 Ų141.584%0.8478%0.779SS**  cis-127.7156.48.9-101.8-53.7000113.8
151K36.6Very low33.8Very low179 Ų179136.6 Ų136.678%0.77877%0.774SS**  trans-117.397.5-172.5177.4-172.9174.9-177.80111.3
152Q27.5Very low34.3Very low169 Ų169134.1 Ų134.179%0.7977%0.766SS**  trans-104.9100.8161.4-17484.7-14.900108Q154Q152-Q154 PolarHBondContact O-N 3.36Å
153R38.7Very low36.1Very low226 Ų226131.7 Ų131.785%0.85377%0.765SS**  trans-74.9108.2168.3-101.7-166.1172.7-160.7-1.5108.5
154Q30.7Very low38.4Very low165 Ų165128.4 Ų128.477%0.77175%0.751SS**  trans-106.3120.9147.9-77.5-176.6-24.700107.9Q152 S156Q152-Q154 PolarHBondContact O-N 3.36Å; Q154-S156 PolarHBondContact O-N 3.42Å
155A38.3Very low41.1Very low106 Ų106127 Ų12788%0.87674%0.744SS**  trans-8386.8167.800000107.5
156S29.6Very low44.2Very low104 Ų104120.6 Ų120.673%0.72770%0.701SS**  trans-74.5123.9172.752.40000110Q154Q154-S156 PolarHBondContact O-N 3.42Å
157V33.8Very low47.3Very low120 Ų120116.4 Ų116.473%0.72768%0.681SS**  trans-45.1144.3156178.60000108.8A159V157-A159 PolarHBondContact O-N 2.63Å
158P39.4Very low50.4Low119 Ų119113.4 Ų113.477%0.77366%0.66SS**  trans-53.3107.5175.621.6-34.6000110.4T160P158-T160 PolarHBondContact O-N 3.21Å; P158-T160 VanDerWaalsContact O-N 3.12Å
159A33.2Very low53.5Low90 Ų90111.2 Ų111.274%0.74464%0.636SS**  trans-75.4104.1-17500000109.1V157 G161V157-A159 PolarHBondContact O-N 2.63Å; A159-G161 PolarHBondContact O-N 3.36Å
160T39.8Very low56.6Low144 Ų144105.1 Ų105.188%0.88362%0.615SS**  trans-64.6100175.548.60000110.3P158P158-T160 PolarHBondContact O-N 3.21Å; P158-T160 VanDerWaalsContact O-N 3.12Å
161G47.1Very low59.9Low66 Ų6698.7 Ų98.768%0.6858%0.582SS**  trans60.271.2156.600000117A159A159-G161 PolarHBondContact O-N 3.36Å
162T49.7Very low62.8Low117 Ų11794.3 Ų94.372%0.71857%0.567SS**  trans-77.3114.4136.642.30000107.8L164T162-L164 VanDerWaalsContact C-N 3.27Å; T162-L164 PolarHBondContact O-N 3.02Å
163S66.8Low66.1Low107 Ų10788.7 Ų88.775%0.74854%0.542SS*.  trans-71.882.5178.2-62.70000110.6L165S163-L165 PolarHBondContact O-N 2.63Å
164L83.1Confident68.9Low81 Ų8178 Ų7842%0.42450%0.501SS..  trans-61.3123.8173.6-72172.2000110.1T162 L166 M169 I173 M235T162-L164 VanDerWaalsContact C-N 3.27Å; T162-L164 PolarHBondContact O-N 3.02Å; L164-L166 PolarHBondContact O-N 2.97Å; L164-M169 HydrophobicContact CB-CE 3.73Å; L164-I173 HydrophobicContact CD1-CG2 4.29Å; L164-M235 WeakPolarHBondContact O-CE 3.5Å
165L90.1Very high72.1Confident73 Ų7370.1 Ų70.138%0.38246%0.464SS..  trans-51.3132.5171.6-79.4160.5000110.7S163 S167 S168 E239 V242S163-L165 PolarHBondContact O-N 2.63Å; L165-S167 VanDerWaalsContact C-N 3.34Å; L165-S167 PolarHBondContact O-N 3.07Å; L165-S168 WeakPolarHBondContact O-CB 3.2Å; L165-S168 PolarHBondContact O-N 2.99Å; L165-S168 PolarHBondContact O-OG 2.82Å; L165-E239 WeakPolarHBondContact CB-OE1 3.25Å; L165-E239 HydrophobicContact CD2-CB 4.3Å; L165-E239 HydrophobicContact CD2-CG 3.91Å; L165-V242 HydrophobicContact CD2-CB 3.96Å; L165-V242 HydrophobicContact CD2-CG1 3.91Å
166L93.9Very high74.8Confident3 Ų370 Ų702%0.01645%0.446CS..G310 helixtrans-56.9-48.4-175.7-179.758000110.9L164 S168 M169 G203 L206 A207 M235 R236 E239L164-L166 PolarHBondContact O-N 2.97Å; L166-S168 PolarHBondContact O-N 2.89Å; L166-M169 HydrophobicContact CD1-SD 4.36Å; L166-M169 WeakPolarHBondContact O-CB 3.42Å; L166-M169 PolarHBondContact O-N 3.08Å; L166-M169 VanDerWaalsContact O-N 3.08Å; L166-G203 CarbonylContact O-C 3.54Å; L166-G203 WeakPolarHBondContact O-CA 3.37Å; L166-L206 HydrophobicContact CD1-CB 4Å; L166-L206 HydrophobicContact CD2-CB 4.4Å; L166-L206 HydrophobicContact CG-CB 4.39Å; L166-A207 HydrophobicContact CD2-CB 4.11Å; L166-A207 HydrophobicContact CG-CB 4.24Å; L166-M235 HydrophobicContact CB-CB 4.13Å; L166-M235 HydrophobicContact CB-CE 4.06Å; L166-M235 HydrophobicContact CD1-CB 4.02Å; L166-M235 HydrophobicContact CD1-CE 4.11Å; L166-M235 HydrophobicContact CD1-SD 4.02Å; L166-M235 HydrophobicContact CD2-CB 3.88Å; L166-M235 HydrophobicContact CG-CB 4.22Å; L166-R236 HydrophobicContact CD2-CG 3.71Å; L166-E239 HydrophobicContact CB-CB 4.43Å; L166-E239 PolarHBondContact N-OE1 3.35Å; L166-E239 VanDerWaalsContact N-OE1 3.12Å
167S94.4Very high78Confident38 Ų3868.3 Ų68.327%0.26643%0.425SS..G310 helixtrans-59.6-16.1176.266.90000115.5L165 R204 E239L165-S167 VanDerWaalsContact C-N 3.34Å; L165-S167 PolarHBondContact O-N 3.07Å; S167-R204 WeakPolarHBondContact O-CG 3.48Å; S167-E239 WeakPolarHBondContact CB-OE1 3.36Å; S167-E239 WeakPolarHBondContact CB-OE2 3.4Å; S167-E239 VanDerWaalsContact N-CD 3.34Å; S167-E239 PolarHBondContact N-OE1 3.05Å; S167-E239 PolarHBondContact N-OE2 3.27Å; S167-E239 VanDerWaalsContact N-OE2 3.08Å; S167-E239 PolarHBondContact OG-OE1 2.89Å
168S94.1Very high81Confident63 Ų6362.6 Ų62.644%0.44139%0.391SS..G310 helixtrans-86.7-15.2176.777.20000114L165 L166L165-S168 WeakPolarHBondContact O-CB 3.2Å; L165-S168 PolarHBondContact O-N 2.99Å; L165-S168 PolarHBondContact O-OG 2.82Å; L166-S168 PolarHBondContact O-N 2.89Å
169M95.6Very high83.7Confident7 Ų762.7 Ų62.73%0.03438%0.376CS..  trans-72132.4-172.1-63.5-169.1160.900112.9L164 L166 I173 V174 K177 G203 M235L164-M169 HydrophobicContact CB-CE 3.73Å; L166-M169 HydrophobicContact CD1-SD 4.36Å; L166-M169 WeakPolarHBondContact O-CB 3.42Å; L166-M169 PolarHBondContact O-N 3.08Å; L166-M169 VanDerWaalsContact O-N 3.08Å; M169-I173 HydrophobicContact CB-CB 4.22Å; M169-I173 HydrophobicContact CB-CG2 3.99Å; M169-I173 HydrophobicContact CE-CG2 3.99Å; M169-I173 HydrophobicContact CG-CG2 3.75Å; M169-I173 HydrophobicContact SD-CG2 3.85Å; M169-V174 HydrophobicContact CB-CG2 3.95Å; M169-K177 HydrophobicContact CE-CD 4.26Å; M169-K177 HydrophobicContact CE-CG 3.86Å; M169-K177 HydrophobicContact SD-CG 4.04Å; M169-G203 WeakPolarHBondContact O-CA 3.4Å; M169-G203 PolarHBondContact O-N 3.27Å; M169-M235 HydrophobicContact CE-CE 3.3Å; M169-M235 HydrophobicContact CE-SD 3.95Å; M169-M235 HydrophobicContact SD-CE 3.84Å; M169-M235 HydrophobicContact SD-SD 4.12Å
170T97.3Very high86.7Confident74 Ų7464 Ų6445%0.45437%0.367SS..  trans-77164.9166.565.30000110.8D172 I173 V174T170-D172 PolarHBondContact O-N 3.39Å; T170-I173 HydrophobicContact CG2-CD1 4.46Å; T170-I173 PolarHBondContact O-N 3.19Å; T170-I173 VanDerWaalsContact O-N 3.1Å; T170-I173 WeakPolarHBondContact OG1-CG1 3.39Å; T170-I173 PolarHBondContact OG1-N 2.91Å; T170-V174 WeakPolarHBondContact O-CG2 3.12Å; T170-V174 PolarHBondContact O-N 2.89Å
171V97.9Very high89.4Confident21 Ų2158.5 Ų58.513%0.12733%0.331CS..Hα-helixtrans-53.2-40176.2-176.30000111.9V174 C175 I196 K197 N200 N202V171-V174 PolarHBondContact O-N 3.25Å; V171-C175 PolarHBondContact O-N 2.99Å; V171-C175 PolarHBondContact O-SG 3.4Å; V171-C175 VanDerWaalsContact O-SG 3.4Å; V171-I196 HydrophobicContact CG1-CG2 3.89Å; V171-K197 HydrophobicContact CG1-CB 4.34Å; V171-K197 HydrophobicContact CG1-CG 3.71Å; V171-N200 VanDerWaalsContact CG2-OD1 3.31Å; V171-N200 WeakPolarHBondContact CG2-OD1 3.5Å; V171-N202 HydrophobicContact CG2-CB 3.91Å
172D97.8Very high91.7Very high88 Ų8863.7 Ų63.747%0.47134%0.338SS..Hα-helixtrans-68.5-39.7177.2-69.3-77.9000113.3T170 V174 C175 E176 K197T170-D172 PolarHBondContact O-N 3.39Å; D172-V174 VanDerWaalsContact C-N 3.32Å; D172-V174 PolarHBondContact O-N 2.84Å; D172-C175 CarbonylContact O-C 3.56Å; D172-C175 WeakPolarHBondContact O-CB 3.43Å; D172-C175 PolarHBondContact O-N 2.94Å; D172-E176 PolarHBondContact O-N 2.88Å; D172-K197 WeakPolarHBondContact OD1-CE 3.31Å; D172-K197 IonicContact OD1-NZ 2.63Å; D172-K197 PolarHBondContact OD1-NZ 3.23Å
173I96.8Very high93.8Very high50 Ų5061.7 Ų61.726%0.25634%0.341SS..Hα-helixtrans-65.5-37.5174.5-63.9168.9000110.3L164 M169 T170 E176 K177L164-I173 HydrophobicContact CD1-CG2 4.29Å; M169-I173 HydrophobicContact CB-CB 4.22Å; M169-I173 HydrophobicContact CB-CG2 3.99Å; M169-I173 HydrophobicContact CE-CG2 3.99Å; M169-I173 HydrophobicContact CG-CG2 3.75Å; M169-I173 HydrophobicContact SD-CG2 3.85Å; T170-I173 HydrophobicContact CG2-CD1 4.46Å; T170-I173 PolarHBondContact O-N 3.19Å; T170-I173 VanDerWaalsContact O-N 3.1Å; T170-I173 WeakPolarHBondContact OG1-CG1 3.39Å; T170-I173 PolarHBondContact OG1-N 2.91Å; I173-E176 PolarHBondContact O-N 3.1Å; I173-K177 WeakPolarHBondContact O-CB 3.26Å; I173-K177 PolarHBondContact O-N 3.5Å
174V97.2Very high95.3Very high1 Ų157.6 Ų57.61%0.00631%0.31CS..Hα-helixtrans-62.5-41.7172.3172.90000111.1M169 T170 V171 D172 E176 K177 L178 I196 L206M169-V174 HydrophobicContact CB-CG2 3.95Å; T170-V174 WeakPolarHBondContact O-CG2 3.12Å; T170-V174 PolarHBondContact O-N 2.89Å; V171-V174 PolarHBondContact O-N 3.25Å; D172-V174 VanDerWaalsContact C-N 3.32Å; D172-V174 PolarHBondContact O-N 2.84Å; V174-E176 VanDerWaalsContact C-N 3.34Å; V174-E176 PolarHBondContact O-N 3.21Å; V174-K177 PolarHBondContact O-N 3.36Å; V174-L178 PolarHBondContact O-N 3.07Å; V174-I196 HydrophobicContact CB-CG2 4.4Å; V174-I196 HydrophobicContact CG1-CD1 4.27Å; V174-I196 HydrophobicContact CG1-CG2 3.92Å; V174-L206 HydrophobicContact CB-CD1 4.36Å; V174-L206 HydrophobicContact CG1-CD1 3.48Å; V174-L206 VanDerWaalsContact CG1-CD1 3.48Å; V174-L206 HydrophobicContact CG2-CD1 3.87Å
175C97.6Very high95.8Very high0 Ų056.9 Ų56.90%031%0.307CS..Hα-helixtrans-66.4-31.3173.1-69.70000113.5V171 D172 R179 I196V171-C175 PolarHBondContact O-N 2.99Å; V171-C175 PolarHBondContact O-SG 3.4Å; V171-C175 VanDerWaalsContact O-SG 3.4Å; D172-C175 CarbonylContact O-C 3.56Å; D172-C175 WeakPolarHBondContact O-CB 3.43Å; D172-C175 PolarHBondContact O-N 2.94Å; C175-R179 PolarHBondContact O-N 3.18Å; C175-R179 PolarHBondContact O-NH1 3.29Å; C175-R179 VanDerWaalsContact O-NH1 3.15Å; C175-I196 VanDerWaalsContact SG-CG2 3.58Å
176E96.4Very high96.1Very high105 Ų10559.8 Ų59.849%0.49132%0.319SS..Hα-helixtrans-71.8-37.3171.4-74.9-168.9152.400112.4D172 I173 V174 R179 Q180D172-E176 PolarHBondContact O-N 2.88Å; I173-E176 PolarHBondContact O-N 3.1Å; V174-E176 VanDerWaalsContact C-N 3.34Å; V174-E176 PolarHBondContact O-N 3.21Å; E176-R179 WeakPolarHBondContact O-CB 3.49Å; E176-R179 PolarHBondContact O-N 2.87Å; E176-R179 VanDerWaalsContact O-N 3.17Å; E176-Q180 WeakPolarHBondContact O-CG 3.44Å; E176-Q180 PolarHBondContact O-N 3.02Å
177K95.4Very high96.2Very high67 Ų6762.6 Ų62.629%0.29135%0.348SS..Hα-helixtrans-65.3-40.5173.2-80.2-74.7164.4-159.80111.9M169 I173 V174 R179 Q180 I181 M231M169-K177 HydrophobicContact CE-CD 4.26Å; M169-K177 HydrophobicContact CE-CG 3.86Å; M169-K177 HydrophobicContact SD-CG 4.04Å; I173-K177 WeakPolarHBondContact O-CB 3.26Å; I173-K177 PolarHBondContact O-N 3.5Å; V174-K177 PolarHBondContact O-N 3.36Å; K177-R179 VanDerWaalsContact C-N 3.26Å; K177-R179 PolarHBondContact O-N 2.77Å; K177-Q180 WeakPolarHBondContact O-CB 3.37Å; K177-Q180 PolarHBondContact O-N 3.44Å; K177-I181 PolarHBondContact O-N 3.29Å; K177-M231 HydrophobicContact CB-CE 4.23Å; K177-M231 HydrophobicContact CB-SD 3.89Å
178L96.9Very high96.3Very high1 Ų163.3 Ų63.31%0.00535%0.348CS..Hα-helixtrans-57.2-38.7170.3-168.579.5000112.2V174 Q180 I181 L184 L189 I196 M220 F228V174-L178 PolarHBondContact O-N 3.07Å; L178-Q180 PolarHBondContact O-N 3.06Å; L178-I181 HydrophobicContact CD1-CD1 4.1Å; L178-I181 PolarHBondContact O-N 3.39Å; L178-L184 HydrophobicContact CD1-CD1 3.74Å; L178-L184 HydrophobicContact CG-CD1 4.15Å; L178-L189 HydrophobicContact CD2-CD1 3.86Å; L178-L189 HydrophobicContact CG-CD1 3.95Å; L178-I196 HydrophobicContact CB-CD1 4.46Å; L178-I196 HydrophobicContact CD2-CD1 3.87Å; L178-M220 HydrophobicContact CD1-CE 3.67Å; L178-M220 HydrophobicContact CD2-CE 4.49Å; L178-F228 HydrophobicContact CD1-CB 4.4Å; L178-F228 HydrophobicContact CD1-CD2 3.44Å; L178-F228 VanDerWaalsContact CD1-CD2 3.44Å; L178-F228 HydrophobicContact CD1-CE2 3.92Å; L178-F228 HydrophobicContact CD1-CG 4.1Å
179R96.6Very high96.4Very high121 Ų12160.9 Ų60.946%0.45733%0.33SS..THydrogen-bonded Turntrans-69.6-14.3174.3-85.6-174.9-66.7-795.3114.8C175 E176 K177 L189 C193C175-R179 PolarHBondContact O-N 3.18Å; C175-R179 PolarHBondContact O-NH1 3.29Å; C175-R179 VanDerWaalsContact O-NH1 3.15Å; E176-R179 WeakPolarHBondContact O-CB 3.49Å; E176-R179 PolarHBondContact O-N 2.87Å; E176-R179 VanDerWaalsContact O-N 3.17Å; K177-R179 VanDerWaalsContact C-N 3.26Å; K177-R179 PolarHBondContact O-N 2.77Å; R179-L189 HydrophobicContact CG-CD1 3.86Å; R179-L189 HydrophobicContact CG-CD2 3.55Å; R179-L189 HydrophobicContact CG-CG 4.23Å; R179-C193 PolarHBondContact NH1-SG 3.05Å; R179-C193 VanDerWaalsContact NH1-SG 3.44Å
180Q95.9Very high96.5Very high118 Ų11864.1 Ų64.155%0.55135%0.352SS*.THydrogen-bonded Turntrans-95.80.3177.8-69.2166.913.500112.4E176 K177 L178 E182E176-Q180 WeakPolarHBondContact O-CG 3.44Å; E176-Q180 PolarHBondContact O-N 3.02Å; K177-Q180 WeakPolarHBondContact O-CB 3.37Å; K177-Q180 PolarHBondContact O-N 3.44Å; L178-Q180 PolarHBondContact O-N 3.06Å; Q180-E182 PolarHBondContact O-N 3.14Å
181I96.6Very high96.6Very high27 Ų2766.5 Ų66.514%0.13836%0.358CS..  trans-79.5112176.2-58.3-172.8000109.6K177 L178 L184 L227 F228 M231K177-I181 PolarHBondContact O-N 3.29Å; L178-I181 HydrophobicContact CD1-CD1 4.1Å; L178-I181 PolarHBondContact O-N 3.39Å; I181-L184 HydrophobicContact CB-CB 4.21Å; I181-L184 HydrophobicContact CB-CD1 4.06Å; I181-L184 HydrophobicContact CD1-CD1 4.05Å; I181-L184 HydrophobicContact CG2-CB 3.99Å; I181-L184 HydrophobicContact CG2-CD1 4.07Å; I181-L227 HydrophobicContact CG2-CB 3.55Å; I181-L227 HydrophobicContact CG2-CD1 4.19Å; I181-L227 HydrophobicContact CG2-CG 4.37Å; I181-F228 HydrophobicContact CD1-CB 4.2Å; I181-F228 HydrophobicContact CD1-CD2 4.09Å; I181-M231 HydrophobicContact CD1-CB 4.14Å; I181-M231 HydrophobicContact CD1-CE 4.18Å; I181-M231 HydrophobicContact CD1-SD 3.72Å; I181-M231 HydrophobicContact CG1-SD 3.8Å
182E95.8Very high96.6Very high175 Ų17565.6 Ų65.682%0.81835%0.352SS*.THydrogen-bonded Turntrans-66140.2173.1-61.7-172.9173.400111.4Q180 L184Q180-E182 PolarHBondContact O-N 3.14Å; E182-L184 VanDerWaalsContact C-N 3.33Å; E182-L184 PolarHBondContact O-N 3.3Å
183G94.3Very high96.6Very high76 Ų7662 Ų6278%0.78433%0.334SS*.THydrogen-bonded Turntrans80.41.9178.200000116.3
184L96.7Very high96.6Very high20 Ų2064 Ų6411%0.10535%0.348CS..  trans-79.9142.4177.3-171.1149000111.7L178 I181 E182 Q186 L189 Y192 D224 L227L178-L184 HydrophobicContact CD1-CD1 3.74Å; L178-L184 HydrophobicContact CG-CD1 4.15Å; I181-L184 HydrophobicContact CB-CB 4.21Å; I181-L184 HydrophobicContact CB-CD1 4.06Å; I181-L184 HydrophobicContact CD1-CD1 4.05Å; I181-L184 HydrophobicContact CG2-CB 3.99Å; I181-L184 HydrophobicContact CG2-CD1 4.07Å; E182-L184 VanDerWaalsContact C-N 3.33Å; E182-L184 PolarHBondContact O-N 3.3Å; L184-Q186 PolarHBondContact O-N 2.86Å; L184-L189 HydrophobicContact CD2-CB 4.08Å; L184-L189 HydrophobicContact CD2-CD1 3.75Å; L184-Y192 HydrophobicContact CD2-CD2 4.17Å; L184-Y192 HydrophobicContact CD2-CE2 4.28Å; L184-D224 HydrophobicContact CD1-CB 4.45Å; L184-D224 HydrophobicContact CG-CB 4.17Å; L184-L227 HydrophobicContact CB-CD1 4.24Å
185D95.4Very high96.7Very high66 Ų6665.3 Ų65.335%0.35336%0.356SS..  trans-62.7104.9-178.8-177.8-0.5000112.6G187 M188 L189 D224D185-G187 PolarHBondContact O-N 3.25Å; D185-G187 WeakPolarHBondContact OD1-CA 3.48Å; D185-G187 PolarHBondContact OD1-N 2.6Å; D185-M188 HydrophobicContact CB-CB 4.22Å; D185-M188 PolarHBondContact O-N 2.82Å; D185-M188 VanDerWaalsContact O-N 3.14Å; D185-M188 PolarHBondContact OD1-N 3.12Å; D185-M188 WeakPolarHBondContact OD2-CG 3.47Å; D185-L189 PolarHBondContact O-N 3.36Å; D185-D224 WeakPolarHBondContact CB-OD2 3.35Å; D185-D224 PolarHBondContact N-OD1 3.5Å
186Q95.6Very high96.7Very high135 Ų13565.3 Ų65.363%0.63136%0.356SS*.THydrogen-bonded Turntrans-64.2-21179.5-17453.182.800113.6L184L184-Q186 PolarHBondContact O-N 2.86Å
187G96.6Very high96.8Very high62 Ų6265.5 Ų65.564%0.63936%0.355SS*.THydrogen-bonded Turntrans-76.3-36.6172.900000113D185 P190D185-G187 PolarHBondContact O-N 3.25Å; D185-G187 WeakPolarHBondContact OD1-CA 3.48Å; D185-G187 PolarHBondContact OD1-N 2.6Å; G187-P190 WeakPolarHBondContact O-CD 3.44Å
188M96.3Very high96.9Very high53 Ų5371.1 Ų71.126%0.26138%0.38SS..THydrogen-bonded Turntrans-89-21.3179.4-70-68-71.100113.8D185 P190 Q191 Y192D185-M188 HydrophobicContact CB-CB 4.22Å; D185-M188 PolarHBondContact O-N 2.82Å; D185-M188 VanDerWaalsContact O-N 3.14Å; D185-M188 PolarHBondContact OD1-N 3.12Å; D185-M188 WeakPolarHBondContact OD2-CG 3.47Å; M188-P190 VanDerWaalsContact C-N 3.34Å; M188-Q191 WeakPolarHBondContact O-CA 3.34Å; M188-Q191 WeakPolarHBondContact O-CB 3.48Å; M188-Q191 PolarHBondContact O-N 3.08Å; M188-Y192 HydrophobicContact CB-CD2 4.27Å; M188-Y192 HydrophobicContact CB-CE1 4.06Å; M188-Y192 HydrophobicContact CB-CE2 3.59Å; M188-Y192 VanDerWaalsContact CB-CZ 3.49Å; M188-Y192 HydrophobicContact CE-CE1 4.01Å; M188-Y192 PolarHBondContact O-N 3.33Å
189L96.8Very high96.9Very high11 Ų1172.7 Ų72.76%0.05839%0.393CS..Hα-helixtrans-44.8-44.1175.9178.4102000114.6L178 R179 L184 D185 Q191 Y192 C193L178-L189 HydrophobicContact CD2-CD1 3.86Å; L178-L189 HydrophobicContact CG-CD1 3.95Å; R179-L189 HydrophobicContact CG-CD1 3.86Å; R179-L189 HydrophobicContact CG-CD2 3.55Å; R179-L189 HydrophobicContact CG-CG 4.23Å; L184-L189 HydrophobicContact CD2-CB 4.08Å; L184-L189 HydrophobicContact CD2-CD1 3.75Å; D185-L189 PolarHBondContact O-N 3.36Å; L189-Q191 VanDerWaalsContact C-N 3.29Å; L189-Q191 PolarHBondContact O-N 3.47Å; L189-Y192 PolarHBondContact O-N 3Å; L189-C193 WeakPolarHBondContact O-CB 3.47Å; L189-C193 PolarHBondContact O-N 2.83Å; L189-C193 PolarHBondContact O-SG 2.98Å
190P97.5Very high97Very high75 Ų7571.7 Ų71.749%0.48740%0.397SS..Hα-helixtrans-62.5-35.9178-21.434.4000112.8G187 M188 T194G187-P190 WeakPolarHBondContact O-CD 3.44Å; M188-P190 VanDerWaalsContact C-N 3.34Å; P190-T194 WeakPolarHBondContact O-CB 3.44Å; P190-T194 PolarHBondContact O-N 3.12Å; P190-T194 PolarHBondContact O-OG1 3.23Å
191Q97.9Very high97Very high124 Ų12466.4 Ų66.458%0.57937%0.372SS*.Hα-helixtrans-72.1-42.6176.7-174.3158.9-35.300110.9M188 L189 C193 T194 T195M188-Q191 WeakPolarHBondContact O-CA 3.34Å; M188-Q191 WeakPolarHBondContact O-CB 3.48Å; M188-Q191 PolarHBondContact O-N 3.08Å; L189-Q191 VanDerWaalsContact C-N 3.29Å; L189-Q191 PolarHBondContact O-N 3.47Å; Q191-C193 PolarHBondContact O-N 3.21Å; Q191-T194 CarbonylContact O-C 3.49Å; Q191-T194 WeakPolarHBondContact O-CA 3.18Å; Q191-T194 WeakPolarHBondContact O-CB 3.43Å; Q191-T194 PolarHBondContact O-N 3.19Å; Q191-T195 PolarHBondContact O-N 2.91Å; Q191-T195 PolarHBondContact O-OG1 3.18Å
192Y98Very high97.1Very high3 Ų366.7 Ų66.71%0.01237%0.374CS..Hα-helixtrans-60.7-42.4173.1-56.9-28.7000112.4L184 M188 L189 T194 T195 I196 M220 N221 D224L184-Y192 HydrophobicContact CD2-CD2 4.17Å; L184-Y192 HydrophobicContact CD2-CE2 4.28Å; M188-Y192 HydrophobicContact CB-CD2 4.27Å; M188-Y192 HydrophobicContact CB-CE1 4.06Å; M188-Y192 HydrophobicContact CB-CE2 3.59Å; M188-Y192 VanDerWaalsContact CB-CZ 3.49Å; M188-Y192 HydrophobicContact CE-CE1 4.01Å; M188-Y192 PolarHBondContact O-N 3.33Å; L189-Y192 PolarHBondContact O-N 3Å; Y192-T194 VanDerWaalsContact C-N 3.26Å; Y192-T194 PolarHBondContact O-N 2.85Å; Y192-T195 PolarHBondContact O-N 3.38Å; Y192-I196 VanDerWaalsContact O-CG1 3.3Å; Y192-I196 WeakPolarHBondContact O-CG1 2.95Å; Y192-I196 PolarHBondContact O-N 3.37Å; Y192-M220 HydrophobicContact CD1-CE 4.38Å; Y192-M220 HydrophobicContact CD1-CG 3.66Å; Y192-M220 HydrophobicContact CD2-CE 4.07Å; Y192-M220 HydrophobicContact CD2-CG 4.18Å; Y192-M220 HydrophobicContact CE1-CB 4.03Å; Y192-M220 HydrophobicContact CE1-CG 3.51Å; Y192-M220 HydrophobicContact CE2-CG 4.03Å; Y192-M220 HydrophobicContact CG-CE 3.89Å; Y192-M220 HydrophobicContact CG-CG 4Å; Y192-N221 PolarHBondContact OH-N 2.91Å; Y192-N221 PolarHBondContact OH-ND2 3.31Å; Y192-N221 VanDerWaalsContact OH-ND2 3.12Å; Y192-D224 HydrophobicContact CE2-CB 3.8Å; Y192-D224 VanDerWaalsContact CE2-OD2 3.31Å; Y192-D224 WeakPolarHBondContact CE2-OD2 3.45Å; Y192-D224 PolarHBondContact OH-OD2 3.49Å
193C98Very high97.1Very high13 Ų1358.3 Ų58.39%0.08834%0.335CS..Hα-helixtrans-60.6-36.6172.4-68.50000112R179 L189 Q191 K197R179-C193 PolarHBondContact NH1-SG 3.05Å; R179-C193 VanDerWaalsContact NH1-SG 3.44Å; L189-C193 WeakPolarHBondContact O-CB 3.47Å; L189-C193 PolarHBondContact O-N 2.83Å; L189-C193 PolarHBondContact O-SG 2.98Å; Q191-C193 PolarHBondContact O-N 3.21Å; C193-K197 WeakPolarHBondContact O-CB 3.21Å; C193-K197 WeakPolarHBondContact O-CG 3.48Å; C193-K197 PolarHBondContact O-N 2.97Å; C193-K197 VanDerWaalsContact O-N 3.07Å
194T98.1Very high97.2Very high90 Ų9062.7 Ų62.755%0.55233%0.328SS*.Hα-helixtrans-68.4-41.3175.9-57.70000111.4P190 Q191 Y192 K197 K198P190-T194 WeakPolarHBondContact O-CB 3.44Å; P190-T194 PolarHBondContact O-N 3.12Å; P190-T194 PolarHBondContact O-OG1 3.23Å; Q191-T194 CarbonylContact O-C 3.49Å; Q191-T194 WeakPolarHBondContact O-CA 3.18Å; Q191-T194 WeakPolarHBondContact O-CB 3.43Å; Q191-T194 PolarHBondContact O-N 3.19Å; Y192-T194 VanDerWaalsContact C-N 3.26Å; Y192-T194 PolarHBondContact O-N 2.85Å; T194-K197 PolarHBondContact O-N 2.85Å; T194-K198 VanDerWaalsContact O-CB 3.26Å; T194-K198 WeakPolarHBondContact O-CB 3.37Å; T194-K198 PolarHBondContact O-N 3.32Å
195T98.1Very high97.2Very high29 Ų2964.4 Ų64.418%0.17834%0.339CS..Hα-helixtrans-60.8-49.8173.3-58.10000111.6Q191 Y192 K197 K198 A199 E217 M218Q191-T195 PolarHBondContact O-N 2.91Å; Q191-T195 PolarHBondContact O-OG1 3.18Å; Y192-T195 PolarHBondContact O-N 3.38Å; T195-K197 VanDerWaalsContact C-N 3.27Å; T195-K197 PolarHBondContact O-N 3.17Å; T195-K198 PolarHBondContact O-N 3.15Å; T195-A199 WeakPolarHBondContact O-CB 3.48Å; T195-A199 PolarHBondContact O-N 3.45Å; T195-E217 WeakPolarHBondContact CG2-O 3.42Å; T195-M218 HydrophobicContact CG2-CE 3.85Å
196I98Very high97.3Very high0 Ų061.3 Ų61.30%032%0.322CS..Hα-helixtrans-55.1-43.1176.8-70.1165.7000111V171 V174 C175 L178 Y192 N200 I201 M218V171-I196 HydrophobicContact CG1-CG2 3.89Å; V174-I196 HydrophobicContact CB-CG2 4.4Å; V174-I196 HydrophobicContact CG1-CD1 4.27Å; V174-I196 HydrophobicContact CG1-CG2 3.92Å; C175-I196 VanDerWaalsContact SG-CG2 3.58Å; L178-I196 HydrophobicContact CB-CD1 4.46Å; L178-I196 HydrophobicContact CD2-CD1 3.87Å; Y192-I196 VanDerWaalsContact O-CG1 3.3Å; Y192-I196 WeakPolarHBondContact O-CG1 2.95Å; Y192-I196 PolarHBondContact O-N 3.37Å; I196-N200 PolarHBondContact O-N 3.03Å; I196-I201 HydrophobicContact CG2-CB 4.33Å; I196-I201 WeakPolarHBondContact CG2-O 3.1Å; I196-I201 PolarHBondContact O-N 3.38Å; I196-M218 HydrophobicContact CD1-SD 4.37Å; I196-M218 HydrophobicContact CG1-CE 3.56Å; I196-M218 HydrophobicContact CG1-SD 3.86Å
197K98Very high97.3Very high109 Ų10955.8 Ų55.847%0.47430%0.299SS..Hα-helixtrans-69.8-44.2177-73.9-175.5174.3-147.60113.6V171 D172 C193 T194 T195 N200V171-K197 HydrophobicContact CG1-CB 4.34Å; V171-K197 HydrophobicContact CG1-CG 3.71Å; D172-K197 WeakPolarHBondContact OD1-CE 3.31Å; D172-K197 IonicContact OD1-NZ 2.63Å; D172-K197 PolarHBondContact OD1-NZ 3.23Å; C193-K197 WeakPolarHBondContact O-CB 3.21Å; C193-K197 WeakPolarHBondContact O-CG 3.48Å; C193-K197 PolarHBondContact O-N 2.97Å; C193-K197 VanDerWaalsContact O-N 3.07Å; T194-K197 PolarHBondContact O-N 2.85Å; T195-K197 VanDerWaalsContact C-N 3.27Å; T195-K197 PolarHBondContact O-N 3.17Å; K197-N200 PolarHBondContact O-N 3.32Å
198K97.9Very high97.3Very high186 Ų18660.9 Ų60.981%0.80931%0.307SS*.Hα-helixtrans-64.5-41179.9-175-171.3179-164.20112.3T194 T195 N200T194-K198 VanDerWaalsContact O-CB 3.26Å; T194-K198 WeakPolarHBondContact O-CB 3.37Å; T194-K198 PolarHBondContact O-N 3.32Å; T195-K198 PolarHBondContact O-N 3.15Å; K198-N200 VanDerWaalsContact C-N 3.31Å
199A97.3Very high97.3Very high34 Ų3459.6 Ų59.628%0.28130%0.303SS..THydrogen-bonded Turntrans-86.22178.700000113.6T195 I201 E217T195-A199 WeakPolarHBondContact O-CB 3.48Å; T195-A199 PolarHBondContact O-N 3.45Å; A199-I201 VanDerWaalsContact C-N 3.25Å; A199-I201 HydrophobicContact CB-CD1 3.57Å; A199-I201 HydrophobicContact CB-CG1 3.75Å; A199-I201 PolarHBondContact O-N 2.88Å; A199-E217 HydrophobicContact CB-CG 3.91Å; A199-E217 WeakPolarHBondContact CB-OE1 3.31Å
200N97.4Very high97.3Very high100 Ų10062.7 Ų62.754%0.53532%0.32SS..THydrogen-bonded Turntrans52.839.5-177.8-170.422.6000113.4V171 I196 K197 K198 N202V171-N200 VanDerWaalsContact CG2-OD1 3.31Å; V171-N200 WeakPolarHBondContact CG2-OD1 3.5Å; I196-N200 PolarHBondContact O-N 3.03Å; K197-N200 PolarHBondContact O-N 3.32Å; K198-N200 VanDerWaalsContact C-N 3.31Å; N200-N202 VanDerWaalsContact C-N 3.32Å; N200-N202 PolarHBondContact O-N 2.93Å; N200-N202 PolarHBondContact O-ND2 3.2Å
201I97.8Very high97.3Very high6 Ų660 Ų603%0.03130%0.301CS..  trans-78.986-175-68.6170.8000109I196 A199 V205 L206 L214 E217 M218I196-I201 HydrophobicContact CG2-CB 4.33Å; I196-I201 WeakPolarHBondContact CG2-O 3.1Å; I196-I201 PolarHBondContact O-N 3.38Å; A199-I201 VanDerWaalsContact C-N 3.25Å; A199-I201 HydrophobicContact CB-CD1 3.57Å; A199-I201 HydrophobicContact CB-CG1 3.75Å; A199-I201 PolarHBondContact O-N 2.88Å; I201-V205 HydrophobicContact CG1-CG1 4.31Å; I201-V205 HydrophobicContact CG2-CG1 4.45Å; I201-L206 HydrophobicContact CG2-CD1 4.28Å; I201-L206 HydrophobicContact CG2-CD2 3.53Å; I201-L206 HydrophobicContact CG2-CG 3.7Å; I201-L214 HydrophobicContact CD1-CD1 4.1Å; I201-L214 HydrophobicContact CG2-CD1 4.32Å; I201-E217 HydrophobicContact CD1-CG 3.91Å; I201-M218 HydrophobicContact CD1-CE 3.36Å
202N97.2Very high97.2Very high33 Ų3358.1 Ų58.118%0.17630%0.295CS..  trans-90175.6173.863.876.4000111.3V171 N200 R204 V205 L206V171-N202 HydrophobicContact CG2-CB 3.91Å; N200-N202 VanDerWaalsContact C-N 3.32Å; N200-N202 PolarHBondContact O-N 2.93Å; N200-N202 PolarHBondContact O-ND2 3.2Å; N202-R204 VanDerWaalsContact C-N 3.34Å; N202-R204 PolarHBondContact O-N 3.37Å; N202-R204 WeakPolarHBondContact OD1-CB 3.3Å; N202-R204 PolarHBondContact OD1-N 3.37Å; N202-V205 WeakPolarHBondContact O-CB 3.44Å; N202-V205 PolarHBondContact O-N 3.26Å; N202-V205 VanDerWaalsContact O-N 3.14Å; N202-V205 PolarHBondContact OD1-N 2.89Å; N202-L206 PolarHBondContact O-N 2.75Å
203G96.6Very high97.2Very high0 Ų063.3 Ų63.30%032%0.319CS..Hα-helixtrans-55-39.4-179.200000115.6L166 M169 L206 A207L166-G203 CarbonylContact O-C 3.54Å; L166-G203 WeakPolarHBondContact O-CA 3.37Å; M169-G203 WeakPolarHBondContact O-CA 3.4Å; M169-G203 PolarHBondContact O-N 3.27Å; G203-L206 CarbonylContact O-C 3.58Å; G203-L206 PolarHBondContact O-N 3.37Å; G203-A207 WeakPolarHBondContact O-CB 3.38Å; G203-A207 PolarHBondContact O-N 2.97Å
204R95.8Very high97.2Very high167 Ų16763 Ų6363%0.6332%0.317SS*.Hα-helixtrans-67.2-38.9177.9-60-176.7175.8-106.3-5111.8S167 N202 A207 Q208S167-R204 WeakPolarHBondContact O-CG 3.48Å; N202-R204 VanDerWaalsContact C-N 3.34Å; N202-R204 PolarHBondContact O-N 3.37Å; N202-R204 WeakPolarHBondContact OD1-CB 3.3Å; N202-R204 PolarHBondContact OD1-N 3.37Å; R204-A207 PolarHBondContact O-N 3.43Å; R204-Q208 PolarHBondContact O-N 3Å
205V97.5Very high97.2Very high57 Ų5763.1 Ų63.135%0.34531%0.309SS..Hα-helixtrans-61.6-48.7172.5179.30000109.3I201 N202 A207 Q208 C209I201-V205 HydrophobicContact CG1-CG1 4.31Å; I201-V205 HydrophobicContact CG2-CG1 4.45Å; N202-V205 WeakPolarHBondContact O-CB 3.44Å; N202-V205 PolarHBondContact O-N 3.26Å; N202-V205 VanDerWaalsContact O-N 3.14Å; N202-V205 PolarHBondContact OD1-N 2.89Å; V205-A207 VanDerWaalsContact C-N 3.3Å; V205-A207 PolarHBondContact O-N 3.2Å; V205-Q208 PolarHBondContact O-N 2.8Å; V205-C209 HydrophobicContact CG1-CB 4.2Å; V205-C209 WeakPolarHBondContact O-CB 3.47Å; V205-C209 PolarHBondContact O-N 3.2Å; V205-C209 PolarHBondContact O-SG 3.31Å
206L97.2Very high97.1Very high1 Ų169.5 Ų69.51%0.00534%0.335CS..Hα-helixtrans-66.3-25.4179.3-70.8-176.4000114.6L166 V174 I201 N202 G203 L214 F228 V232 R236L166-L206 HydrophobicContact CD1-CB 4Å; L166-L206 HydrophobicContact CD2-CB 4.4Å; L166-L206 HydrophobicContact CG-CB 4.39Å; V174-L206 HydrophobicContact CB-CD1 4.36Å; V174-L206 HydrophobicContact CG1-CD1 3.48Å; V174-L206 VanDerWaalsContact CG1-CD1 3.48Å; V174-L206 HydrophobicContact CG2-CD1 3.87Å; I201-L206 HydrophobicContact CG2-CD1 4.28Å; I201-L206 HydrophobicContact CG2-CD2 3.53Å; I201-L206 HydrophobicContact CG2-CG 3.7Å; N202-L206 PolarHBondContact O-N 2.75Å; G203-L206 CarbonylContact O-C 3.58Å; G203-L206 PolarHBondContact O-N 3.37Å; L206-L214 HydrophobicContact CD2-CD1 3.83Å; L206-L214 HydrophobicContact CD2-CD2 3.67Å; L206-L214 HydrophobicContact CD2-CG 4.42Å; L206-F228 HydrophobicContact CD1-CZ 4.17Å; L206-F228 HydrophobicContact CD2-CE1 4.41Å; L206-F228 HydrophobicContact CD2-CZ 3.96Å; L206-V232 HydrophobicContact CB-CG1 4.46Å; L206-V232 HydrophobicContact CD1-CG2 4.22Å; L206-V232 HydrophobicContact CD2-CG1 4.49Å; L206-V232 HydrophobicContact CD2-CG2 4.06Å; L206-V232 WeakPolarHBondContact O-CG1 3.43Å; L206-R236 PolarHBondContact O-NE 3.06Å; L206-R236 PolarHBondContact O-NH2 2.95Å
207A96.1Very high97.1Very high18 Ų1874.5 Ų74.515%0.14936%0.358CS..Hα-helixtrans-71.9-35.2173.300000112.8L166 G203 R204 V205 R236 E239L166-A207 HydrophobicContact CD2-CB 4.11Å; L166-A207 HydrophobicContact CG-CB 4.24Å; G203-A207 WeakPolarHBondContact O-CB 3.38Å; G203-A207 PolarHBondContact O-N 2.97Å; R204-A207 PolarHBondContact O-N 3.43Å; V205-A207 VanDerWaalsContact C-N 3.3Å; V205-A207 PolarHBondContact O-N 3.2Å; A207-R236 WeakPolarHBondContact O-CD 3.2Å; A207-R236 VanDerWaalsContact O-CZ 3.25Å; A207-R236 PolarHBondContact O-NE 2.86Å; A207-R236 VanDerWaalsContact O-NE 3.13Å; A207-E239 WeakPolarHBondContact CB-OE2 3.33Å
208Q95.1Very high97Very high169 Ų16969.3 Ų69.379%0.7934%0.336SS*.Hα-helixtrans-114.7-20.5-166.2-62.3-176.9-2.700115.5R204 V205R204-Q208 PolarHBondContact O-N 3Å; V205-Q208 PolarHBondContact O-N 2.8Å
209C96.4Very high96.9Very high27 Ų2764.1 Ų64.118%0.18233%0.327CS..SBendtrans-65.3154.8-172.867.30000113.8V205 I211 R236V205-C209 HydrophobicContact CG1-CB 4.2Å; V205-C209 WeakPolarHBondContact O-CB 3.47Å; V205-C209 PolarHBondContact O-N 3.2Å; V205-C209 PolarHBondContact O-SG 3.31Å; C209-I211 PolarHBondContact O-N 3.21Å; C209-R236 PolarHBondContact O-NH1 3.33Å; C209-R236 VanDerWaalsContact O-NH1 3.08Å; C209-R236 PolarHBondContact O-NH2 3.2Å; C209-R236 PolarHBondContact SG-NH2 3.38Å
210N97.5Very high96.9Very high76 Ų7663.5 Ų63.541%0.40632%0.319SS..  trans-67.1126.3167.1-179.1-1.7000109.6D212 E213 L214N210-D212 VanDerWaalsContact C-N 3.26Å; N210-D212 PolarHBondContact O-N 3.41Å; N210-D212 PolarHBondContact OD1-N 3.04Å; N210-D212 VanDerWaalsContact OD1-N 3.13Å; N210-E213 HydrophobicContact CB-CB 4.15Å; N210-E213 HydrophobicContact CB-CG 4.17Å; N210-E213 WeakPolarHBondContact CB-OE1 3.47Å; N210-E213 PolarHBondContact ND2-OE1 3.49Å; N210-E213 PolarHBondContact O-N 3.01Å; N210-L214 PolarHBondContact O-N 2.89Å
211I97.3Very high96.9Very high19 Ų1962.3 Ų62.310%0.09731%0.313CS..Hα-helixtrans-64.7-30.5-175.9-58.3-64.6000111.8C209 K215 W225 R229 V232 L233C209-I211 PolarHBondContact O-N 3.21Å; I211-K215 PolarHBondContact O-N 3.13Å; I211-W225 HydrophobicContact CG2-CH2 4.08Å; I211-W225 HydrophobicContact CG2-CZ2 3.7Å; I211-W225 WeakPolarHBondContact O-CH2 3.43Å; I211-W225 WeakPolarHBondContact O-CZ2 3.19Å; I211-R229 HydrophobicContact CG2-CG 3.91Å; I211-R229 VanDerWaalsContact CG2-CZ 3.46Å; I211-R229 VanDerWaalsContact CG2-NH1 3.3Å; I211-V232 HydrophobicContact CD1-CG1 4.23Å; I211-L233 HydrophobicContact CD1-CD2 4.13Å; I211-L233 HydrophobicContact CG1-CD2 4.28Å
212D96.9Very high96.8Very high84 Ų8469.5 Ų69.545%0.44934%0.344SS..Hα-helixtrans-86.1-11.3-179.5-60.5-35.5000113.2N210 K216 R229N210-D212 VanDerWaalsContact C-N 3.26Å; N210-D212 PolarHBondContact O-N 3.41Å; N210-D212 PolarHBondContact OD1-N 3.04Å; N210-D212 VanDerWaalsContact OD1-N 3.13Å; D212-K216 WeakPolarHBondContact O-CD 3.43Å; D212-K216 VanDerWaalsContact O-CE 3.25Å; D212-K216 WeakPolarHBondContact O-CE 3.35Å; D212-K216 WeakPolarHBondContact O-CG 3.48Å; D212-R229 IonicContact OD1-NH1 2.63Å; D212-R229 PolarHBondContact OD1-NH1 3.33Å; D212-R229 VanDerWaalsContact OD1-NH1 3.13Å
213E97.4Very high96.8Very high112 Ų11269.8 Ų69.852%0.52336%0.355SS..Hα-helixtrans-84.4-45.5163.5-74155.6-140.300110.4N210 K215 K216 E217N210-E213 HydrophobicContact CB-CB 4.15Å; N210-E213 HydrophobicContact CB-CG 4.17Å; N210-E213 WeakPolarHBondContact CB-OE1 3.47Å; N210-E213 PolarHBondContact ND2-OE1 3.49Å; N210-E213 PolarHBondContact O-N 3.01Å; E213-K215 PolarHBondContact O-N 3.01Å; E213-K216 WeakPolarHBondContact O-CB 3.25Å; E213-K216 PolarHBondContact O-N 3.48Å; E213-E217 PolarHBondContact O-N 3.49Å
214L97.5Very high96.9Very high7 Ų770.2 Ų70.24%0.03736%0.357CS..Hα-helixtrans-54.3-36.6172.5-17866.3000111.8I201 L206 N210 K216 E217 M218 W225 F228 V232I201-L214 HydrophobicContact CD1-CD1 4.1Å; I201-L214 HydrophobicContact CG2-CD1 4.32Å; L206-L214 HydrophobicContact CD2-CD1 3.83Å; L206-L214 HydrophobicContact CD2-CD2 3.67Å; L206-L214 HydrophobicContact CD2-CG 4.42Å; N210-L214 PolarHBondContact O-N 2.89Å; L214-K216 PolarHBondContact O-N 3.47Å; L214-E217 PolarHBondContact O-N 3.21Å; L214-M218 HydrophobicContact CD1-CG 4.03Å; L214-M218 HydrophobicContact CG-CG 4.23Å; L214-M218 VanDerWaalsContact O-CB 3.25Å; L214-M218 WeakPolarHBondContact O-CB 3.33Å; L214-M218 VanDerWaalsContact O-CG 3.31Å; L214-M218 WeakPolarHBondContact O-CG 3.32Å; L214-M218 PolarHBondContact O-N 3.07Å; L214-W225 HydrophobicContact CB-CH2 4.12Å; L214-W225 HydrophobicContact CD2-CH2 4.08Å; L214-W225 HydrophobicContact CD2-CZ3 4.32Å; L214-W225 HydrophobicContact CG-CH2 3.95Å; L214-W225 HydrophobicContact CG-CZ3 4.02Å; L214-F228 HydrophobicContact CD1-CE1 4.42Å; L214-F228 HydrophobicContact CD2-CE1 4.02Å; L214-F228 HydrophobicContact CG-CE1 4.34Å; L214-V232 HydrophobicContact CD2-CG1 4.49Å
215K97.6Very high97Very high92 Ų9262.3 Ų62.340%0.433%0.327SS..Hα-helixtrans-58.9-44.2173.7-171.6174.7-176-179.20112.8I211 E213 A219 W225I211-K215 PolarHBondContact O-N 3.13Å; E213-K215 PolarHBondContact O-N 3.01Å; K215-A219 PolarHBondContact O-N 3.49Å; K215-W225 VanDerWaalsContact CA-CH2 3.5Å; K215-W225 HydrophobicContact CB-CD2 4.18Å; K215-W225 HydrophobicContact CB-CE3 4.41Å; K215-W225 HydrophobicContact CB-CH2 3.78Å; K215-W225 HydrophobicContact CB-CZ2 3.49Å; K215-W225 VanDerWaalsContact CB-CZ2 3.49Å; K215-W225 HydrophobicContact CB-CZ3 4.24Å; K215-W225 HydrophobicContact CD-CD2 4.41Å; K215-W225 HydrophobicContact CD-CG 4.47Å; K215-W225 HydrophobicContact CD-CZ2 4.38Å; K215-W225 HydrophobicContact CG-CD2 3.82Å; K215-W225 HydrophobicContact CG-CE3 4.36Å; K215-W225 HydrophobicContact CG-CG 4.19Å; K215-W225 HydrophobicContact CG-CH2 4.49Å; K215-W225 HydrophobicContact CG-CZ2 3.95Å
216K97.2Very high97Very high162 Ų16263.6 Ų63.670%0.70433%0.329SS*.Hα-helixtrans-69.8-42.8-178.4-63.6164.6-169.7165.30110.5D212 E213 L214D212-K216 WeakPolarHBondContact O-CD 3.43Å; D212-K216 VanDerWaalsContact O-CE 3.25Å; D212-K216 WeakPolarHBondContact O-CE 3.35Å; D212-K216 WeakPolarHBondContact O-CG 3.48Å; E213-K216 WeakPolarHBondContact O-CB 3.25Å; E213-K216 PolarHBondContact O-N 3.48Å; L214-K216 PolarHBondContact O-N 3.47Å
217E97.5Very high97.1Very high105 Ų10566.5 Ų66.549%0.49135%0.345SS..Hα-helixtrans-69.2-41.5179.8-167.259.8-150.600112.1T195 A199 I201 E213 L214 A219T195-E217 WeakPolarHBondContact CG2-O 3.42Å; A199-E217 HydrophobicContact CB-CG 3.91Å; A199-E217 WeakPolarHBondContact CB-OE1 3.31Å; I201-E217 HydrophobicContact CD1-CG 3.91Å; E213-E217 PolarHBondContact O-N 3.49Å; L214-E217 PolarHBondContact O-N 3.21Å; E217-A219 PolarHBondContact O-N 3.39Å
218M96.7Very high97.2Very high1 Ų165.7 Ų65.71%0.00534%0.337CS..Hα-helixtrans-65.8-34.6176.9-79.5-65.4102.900113.6T195 I196 I201 L214 M220 W225 F228T195-M218 HydrophobicContact CG2-CE 3.85Å; I196-M218 HydrophobicContact CD1-SD 4.37Å; I196-M218 HydrophobicContact CG1-CE 3.56Å; I196-M218 HydrophobicContact CG1-SD 3.86Å; I201-M218 HydrophobicContact CD1-CE 3.36Å; L214-M218 HydrophobicContact CD1-CG 4.03Å; L214-M218 HydrophobicContact CG-CG 4.23Å; L214-M218 VanDerWaalsContact O-CB 3.25Å; L214-M218 WeakPolarHBondContact O-CB 3.33Å; L214-M218 VanDerWaalsContact O-CG 3.31Å; L214-M218 WeakPolarHBondContact O-CG 3.32Å; L214-M218 PolarHBondContact O-N 3.07Å; M218-M220 HydrophobicContact CB-CE 4.43Å; M218-M220 HydrophobicContact CB-CG 4.03Å; M218-M220 HydrophobicContact CB-SD 3.92Å; M218-M220 HydrophobicContact CG-CE 4.22Å; M218-M220 HydrophobicContact CG-SD 4.1Å; M218-M220 PolarHBondContact O-N 3.35Å; M218-M220 HydrophobicContact SD-CE 3.57Å; M218-M220 VanDerWaalsContact SD-CE 3.57Å; M218-M220 HydrophobicContact SD-SD 4.23Å; M218-W225 HydrophobicContact CB-CE3 4.29Å; M218-W225 HydrophobicContact CB-CZ3 4.22Å; M218-W225 HydrophobicContact CG-CZ3 4.1Å; M218-F228 HydrophobicContact CG-CD1 4.15Å; M218-F228 HydrophobicContact CG-CE1 3.73Å; M218-F228 HydrophobicContact SD-CD1 4.4Å; M218-F228 HydrophobicContact SD-CE1 3.79Å; M218-F228 HydrophobicContact SD-CZ 4.19Å
219A95.7Very high97.3Very high77 Ų7761.3 Ų61.364%0.63631%0.314SS*.  trans49.631.7-177.400000114.5K215 E217K215-A219 PolarHBondContact O-N 3.49Å; E217-A219 PolarHBondContact O-N 3.39Å
220M96.8Very high97.4Very high21 Ų2163.5 Ų63.510%0.10333%0.329CS..  trans-71153.7-178.7-79.1163.9172.500113.2L178 Y192 M218 D224 W225 F228L178-M220 HydrophobicContact CD1-CE 3.67Å; L178-M220 HydrophobicContact CD2-CE 4.49Å; Y192-M220 HydrophobicContact CD1-CE 4.38Å; Y192-M220 HydrophobicContact CD1-CG 3.66Å; Y192-M220 HydrophobicContact CD2-CE 4.07Å; Y192-M220 HydrophobicContact CD2-CG 4.18Å; Y192-M220 HydrophobicContact CE1-CB 4.03Å; Y192-M220 HydrophobicContact CE1-CG 3.51Å; Y192-M220 HydrophobicContact CE2-CG 4.03Å; Y192-M220 HydrophobicContact CG-CE 3.89Å; Y192-M220 HydrophobicContact CG-CG 4Å; M218-M220 HydrophobicContact CB-CE 4.43Å; M218-M220 HydrophobicContact CB-CG 4.03Å; M218-M220 HydrophobicContact CB-SD 3.92Å; M218-M220 HydrophobicContact CG-CE 4.22Å; M218-M220 HydrophobicContact CG-SD 4.1Å; M218-M220 PolarHBondContact O-N 3.35Å; M218-M220 HydrophobicContact SD-CE 3.57Å; M218-M220 VanDerWaalsContact SD-CE 3.57Å; M218-M220 HydrophobicContact SD-SD 4.23Å; M220-D224 HydrophobicContact CB-CB 4.25Å; M220-D224 HydrophobicContact CG-CB 4.45Å; M220-W225 HydrophobicContact CB-CB 3.87Å; M220-W225 HydrophobicContact SD-CE3 4.1Å; M220-F228 HydrophobicContact CE-CB 4.15Å; M220-F228 HydrophobicContact CE-CD1 3.91Å; M220-F228 HydrophobicContact CE-CD2 4.35Å; M220-F228 HydrophobicContact CE-CE1 4.38Å; M220-F228 HydrophobicContact CE-CG 3.88Å; M220-F228 HydrophobicContact SD-CB 3.83Å; M220-F228 HydrophobicContact SD-CD1 3.75Å; M220-F228 HydrophobicContact SD-CG 3.95Å
221N96.5Very high97.3Very high75 Ų7561 Ų6140%0.40132%0.316SS..  trans-52.8155164.3-63.5-40.7000110.7Y192 G223 D224 W225Y192-N221 PolarHBondContact OH-N 2.91Å; Y192-N221 PolarHBondContact OH-ND2 3.31Å; Y192-N221 VanDerWaalsContact OH-ND2 3.12Å; N221-G223 VanDerWaalsContact C-N 3.33Å; N221-G223 PolarHBondContact O-N 2.6Å; N221-D224 HydrophobicContact CB-CB 4.33Å; N221-D224 WeakPolarHBondContact CB-OD2 3.31Å; N221-D224 PolarHBondContact ND2-OD2 3.14Å; N221-D224 PolarHBondContact O-N 3.03Å; N221-W225 VanDerWaalsContact O-CB 3.25Å; N221-W225 WeakPolarHBondContact O-CB 3.15Å; N221-W225 PolarHBondContact O-N 2.81Å
222F97.2Very high97.3Very high156 Ų15660.1 Ų60.168%0.68431%0.311SS*.Hα-helixtrans-54.9-44.9-178.1-179.7-96.1000113.2H226F222-H226 AromaticContact CE1-CD2 3.94Å; F222-H226 AromaticContact CE2-CD2 3.76Å; F222-H226 AromaticContact CE2-NE2 3.58Å; F222-H226 AromaticContact CZ-CD2 3.65Å; F222-H226 AromaticContact CZ-NE2 3.55Å; F222-H226 PolarHBondContact O-CD2 3.21Å; F222-H226 VanDerWaalsContact O-CD2 3.31Å; F222-H226 PolarHBondContact O-N 3.12Å
223G97.3Very high97.3Very high40 Ų4059.7 Ų59.741%0.41231%0.308SS..Hα-helixtrans-65-57.9177.100000112.7N221 W225 H226 L227N221-G223 VanDerWaalsContact C-N 3.33Å; N221-G223 PolarHBondContact O-N 2.6Å; G223-W225 PolarHBondContact O-N 3.24Å; G223-H226 WeakPolarHBondContact O-CA 3.44Å; G223-H226 WeakPolarHBondContact O-CB 3.35Å; G223-H226 PolarHBondContact O-N 3Å; G223-L227 PolarHBondContact O-N 3.48Å
224D97.8Very high97.2Very high8 Ų860.3 Ų60.34%0.04331%0.311CS..Hα-helixtrans-52.8-42.4179.2-57.7-32.2000112.2L184 D185 Y192 M220 N221 H226 L227 F228L184-D224 HydrophobicContact CD1-CB 4.45Å; L184-D224 HydrophobicContact CG-CB 4.17Å; D185-D224 WeakPolarHBondContact CB-OD2 3.35Å; D185-D224 PolarHBondContact N-OD1 3.5Å; Y192-D224 HydrophobicContact CE2-CB 3.8Å; Y192-D224 VanDerWaalsContact CE2-OD2 3.31Å; Y192-D224 WeakPolarHBondContact CE2-OD2 3.45Å; Y192-D224 PolarHBondContact OH-OD2 3.49Å; M220-D224 HydrophobicContact CB-CB 4.25Å; M220-D224 HydrophobicContact CG-CB 4.45Å; N221-D224 HydrophobicContact CB-CB 4.33Å; N221-D224 WeakPolarHBondContact CB-OD2 3.31Å; N221-D224 PolarHBondContact ND2-OD2 3.14Å; N221-D224 PolarHBondContact O-N 3.03Å; D224-H226 PolarHBondContact O-N 2.91Å; D224-L227 PolarHBondContact O-N 3.44Å; D224-F228 WeakPolarHBondContact O-CB 3.41Å; D224-F228 PolarHBondContact O-N 3.46Å
225W98.1Very high97Very high2 Ų261.3 Ų61.31%0.00832%0.316CS..Hα-helixtrans-60.8-43.4175.1172.5-108000112.3I211 L214 K215 M218 M220 N221 G223 L227 F228 R229I211-W225 HydrophobicContact CG2-CH2 4.08Å; I211-W225 HydrophobicContact CG2-CZ2 3.7Å; I211-W225 WeakPolarHBondContact O-CH2 3.43Å; I211-W225 WeakPolarHBondContact O-CZ2 3.19Å; L214-W225 HydrophobicContact CB-CH2 4.12Å; L214-W225 HydrophobicContact CD2-CH2 4.08Å; L214-W225 HydrophobicContact CD2-CZ3 4.32Å; L214-W225 HydrophobicContact CG-CH2 3.95Å; L214-W225 HydrophobicContact CG-CZ3 4.02Å; K215-W225 VanDerWaalsContact CA-CH2 3.5Å; K215-W225 HydrophobicContact CB-CD2 4.18Å; K215-W225 HydrophobicContact CB-CE3 4.41Å; K215-W225 HydrophobicContact CB-CH2 3.78Å; K215-W225 HydrophobicContact CB-CZ2 3.49Å; K215-W225 VanDerWaalsContact CB-CZ2 3.49Å; K215-W225 HydrophobicContact CB-CZ3 4.24Å; K215-W225 HydrophobicContact CD-CD2 4.41Å; K215-W225 HydrophobicContact CD-CG 4.47Å; K215-W225 HydrophobicContact CD-CZ2 4.38Å; K215-W225 HydrophobicContact CG-CD2 3.82Å; K215-W225 HydrophobicContact CG-CE3 4.36Å; K215-W225 HydrophobicContact CG-CG 4.19Å; K215-W225 HydrophobicContact CG-CH2 4.49Å; K215-W225 HydrophobicContact CG-CZ2 3.95Å; M218-W225 HydrophobicContact CB-CE3 4.29Å; M218-W225 HydrophobicContact CB-CZ3 4.22Å; M218-W225 HydrophobicContact CG-CZ3 4.1Å; M220-W225 HydrophobicContact CB-CB 3.87Å; M220-W225 HydrophobicContact SD-CE3 4.1Å; N221-W225 VanDerWaalsContact O-CB 3.25Å; N221-W225 WeakPolarHBondContact O-CB 3.15Å; N221-W225 PolarHBondContact O-N 2.81Å; G223-W225 PolarHBondContact O-N 3.24Å; W225-L227 VanDerWaalsContact C-N 3.35Å; W225-F228 HydrophobicContact CE3-CD1 4.22Å; W225-F228 AromaticContact CZ3-CD1 3.91Å; W225-F228 HydrophobicContact CZ3-CD1 3.91Å; W225-F228 HydrophobicContact CZ3-CE1 4.36Å; W225-R229 HydrophobicContact CD2-CB 4.47Å; W225-R229 HydrophobicContact CH2-CB 4.44Å; W225-R229 HydrophobicContact CZ2-CB 4Å; W225-R229 HydrophobicContact CZ2-CG 4.18Å; W225-R229 WeakPolarHBondContact O-CB 3.49Å; W225-R229 PolarHBondContact O-N 3.43Å
226H98.1Very high96.9Very high84 Ų8459 Ų5939%0.38931%0.305SS..Hα-helixtrans-66.8-36.8178.8-94.1-81.4000112.1F222 G223 D224 S230F222-H226 AromaticContact CE1-CD2 3.94Å; F222-H226 AromaticContact CE2-CD2 3.76Å; F222-H226 AromaticContact CE2-NE2 3.58Å; F222-H226 AromaticContact CZ-CD2 3.65Å; F222-H226 AromaticContact CZ-NE2 3.55Å; F222-H226 PolarHBondContact O-CD2 3.21Å; F222-H226 VanDerWaalsContact O-CD2 3.31Å; F222-H226 PolarHBondContact O-N 3.12Å; G223-H226 WeakPolarHBondContact O-CA 3.44Å; G223-H226 WeakPolarHBondContact O-CB 3.35Å; G223-H226 PolarHBondContact O-N 3Å; D224-H226 PolarHBondContact O-N 2.91Å; H226-S230 WeakPolarHBondContact O-CB 3.35Å; H226-S230 PolarHBondContact O-N 2.79Å; H226-S230 VanDerWaalsContact O-N 3.07Å; H226-S230 PolarHBondContact O-OG 2.87Å
227L98.1Very high96.7Very high62 Ų6254.1 Ų54.133%0.32529%0.291SS..Hα-helixtrans-67.8-49.8174.9-60.6170.4000111.2I181 L184 G223 D224 W225 R229 S230 M231I181-L227 HydrophobicContact CG2-CB 3.55Å; I181-L227 HydrophobicContact CG2-CD1 4.19Å; I181-L227 HydrophobicContact CG2-CG 4.37Å; L184-L227 HydrophobicContact CB-CD1 4.24Å; G223-L227 PolarHBondContact O-N 3.48Å; D224-L227 PolarHBondContact O-N 3.44Å; W225-L227 VanDerWaalsContact C-N 3.35Å; L227-R229 PolarHBondContact O-N 3.08Å; L227-S230 WeakPolarHBondContact O-CB 3.25Å; L227-S230 PolarHBondContact O-N 3.03Å; L227-S230 VanDerWaalsContact O-N 3.16Å; L227-M231 PolarHBondContact O-N 2.93Å
228F98Very high96.3Very high0 Ų052.1 Ų52.10%029%0.286CS..Hα-helixtrans-62.5-42.8177.5-179.2-114.2000112.8L178 I181 L206 L214 M218 M220 D224 W225 S230 M231 V232L178-F228 HydrophobicContact CD1-CB 4.4Å; L178-F228 HydrophobicContact CD1-CD2 3.44Å; L178-F228 VanDerWaalsContact CD1-CD2 3.44Å; L178-F228 HydrophobicContact CD1-CE2 3.92Å; L178-F228 HydrophobicContact CD1-CG 4.1Å; I181-F228 HydrophobicContact CD1-CB 4.2Å; I181-F228 HydrophobicContact CD1-CD2 4.09Å; L206-F228 HydrophobicContact CD1-CZ 4.17Å; L206-F228 HydrophobicContact CD2-CE1 4.41Å; L206-F228 HydrophobicContact CD2-CZ 3.96Å; L214-F228 HydrophobicContact CD1-CE1 4.42Å; L214-F228 HydrophobicContact CD2-CE1 4.02Å; L214-F228 HydrophobicContact CG-CE1 4.34Å; M218-F228 HydrophobicContact CG-CD1 4.15Å; M218-F228 HydrophobicContact CG-CE1 3.73Å; M218-F228 HydrophobicContact SD-CD1 4.4Å; M218-F228 HydrophobicContact SD-CE1 3.79Å; M218-F228 HydrophobicContact SD-CZ 4.19Å; M220-F228 HydrophobicContact CE-CB 4.15Å; M220-F228 HydrophobicContact CE-CD1 3.91Å; M220-F228 HydrophobicContact CE-CD2 4.35Å; M220-F228 HydrophobicContact CE-CE1 4.38Å; M220-F228 HydrophobicContact CE-CG 3.88Å; M220-F228 HydrophobicContact SD-CB 3.83Å; M220-F228 HydrophobicContact SD-CD1 3.75Å; M220-F228 HydrophobicContact SD-CG 3.95Å; D224-F228 WeakPolarHBondContact O-CB 3.41Å; D224-F228 PolarHBondContact O-N 3.46Å; W225-F228 HydrophobicContact CE3-CD1 4.22Å; W225-F228 AromaticContact CZ3-CD1 3.91Å; W225-F228 HydrophobicContact CZ3-CD1 3.91Å; W225-F228 HydrophobicContact CZ3-CE1 4.36Å; F228-S230 VanDerWaalsContact C-N 3.27Å; F228-S230 PolarHBondContact O-N 3.06Å; F228-M231 HydrophobicContact CD2-CE 3.71Å; F228-M231 HydrophobicContact CE2-CE 3.67Å; F228-M231 PolarHBondContact O-N 3.04Å; F228-V232 HydrophobicContact CD1-CG2 4.46Å; F228-V232 HydrophobicContact CD2-CG2 4.33Å; F228-V232 HydrophobicContact CE1-CG2 4.13Å; F228-V232 HydrophobicContact CE2-CG2 3.99Å; F228-V232 HydrophobicContact CZ-CG2 3.89Å; F228-V232 WeakPolarHBondContact O-CG2 3.41Å; F228-V232 PolarHBondContact O-N 2.76Å
229R97.8Very high95.9Very high78 Ų7853.3 Ų53.329%0.29429%0.291SS..Hα-helixtrans-59.6-38.2173.7178.1173.6174.8137.6-1.4111.6I211 D212 W225 L227 L233I211-R229 HydrophobicContact CG2-CG 3.91Å; I211-R229 VanDerWaalsContact CG2-CZ 3.46Å; I211-R229 VanDerWaalsContact CG2-NH1 3.3Å; D212-R229 IonicContact OD1-NH1 2.63Å; D212-R229 PolarHBondContact OD1-NH1 3.33Å; D212-R229 VanDerWaalsContact OD1-NH1 3.13Å; W225-R229 HydrophobicContact CD2-CB 4.47Å; W225-R229 HydrophobicContact CH2-CB 4.44Å; W225-R229 HydrophobicContact CZ2-CB 4Å; W225-R229 HydrophobicContact CZ2-CG 4.18Å; W225-R229 WeakPolarHBondContact O-CB 3.49Å; W225-R229 PolarHBondContact O-N 3.43Å; L227-R229 PolarHBondContact O-N 3.08Å; R229-L233 HydrophobicContact CG-CD1 3.87Å; R229-L233 HydrophobicContact CG-CG 4.48Å; R229-L233 WeakPolarHBondContact O-CB 3.4Å; R229-L233 VanDerWaalsContact O-CG 3.24Å; R229-L233 WeakPolarHBondContact O-CG 3.39Å; R229-L233 PolarHBondContact O-N 2.93Å
230S97.8Very high95.3Very high72 Ų7255.7 Ų55.750%0.50329%0.294SS..Hα-helixtrans-65.1-51177.1-57.80000111H226 L227 F228 V232 L233 E234H226-S230 WeakPolarHBondContact O-CB 3.35Å; H226-S230 PolarHBondContact O-N 2.79Å; H226-S230 VanDerWaalsContact O-N 3.07Å; H226-S230 PolarHBondContact O-OG 2.87Å; L227-S230 WeakPolarHBondContact O-CB 3.25Å; L227-S230 PolarHBondContact O-N 3.03Å; L227-S230 VanDerWaalsContact O-N 3.16Å; F228-S230 VanDerWaalsContact C-N 3.27Å; F228-S230 PolarHBondContact O-N 3.06Å; S230-V232 VanDerWaalsContact C-N 3.34Å; S230-V232 PolarHBondContact O-N 2.95Å; S230-L233 PolarHBondContact O-N 3.2Å; S230-E234 WeakPolarHBondContact O-CB 3.24Å; S230-E234 PolarHBondContact O-N 3.31Å
231M96.6Very high94Very high25 Ų2562.1 Ų62.112%0.12332%0.323CS..Hα-helixtrans-55.9-45.1175.8-176.2-163.872.700112.2K177 I181 L227 F228 L233 M235K177-M231 HydrophobicContact CB-CE 4.23Å; K177-M231 HydrophobicContact CB-SD 3.89Å; I181-M231 HydrophobicContact CD1-CB 4.14Å; I181-M231 HydrophobicContact CD1-CE 4.18Å; I181-M231 HydrophobicContact CD1-SD 3.72Å; I181-M231 HydrophobicContact CG1-SD 3.8Å; L227-M231 PolarHBondContact O-N 2.93Å; F228-M231 HydrophobicContact CD2-CE 3.71Å; F228-M231 HydrophobicContact CE2-CE 3.67Å; F228-M231 PolarHBondContact O-N 3.04Å; M231-L233 PolarHBondContact O-N 3.13Å; M231-M235 WeakPolarHBondContact O-CB 3.42Å; M231-M235 WeakPolarHBondContact O-CG 3.45Å; M231-M235 PolarHBondContact O-N 2.96Å
232V97Very high92.2Very high0 Ų062.3 Ų62.30%033%0.327CS..Hα-helixtrans-65-39.3179.5171.70000111.8L206 I211 L214 F228 S230 R236L206-V232 HydrophobicContact CB-CG1 4.46Å; L206-V232 HydrophobicContact CD1-CG2 4.22Å; L206-V232 HydrophobicContact CD2-CG1 4.49Å; L206-V232 HydrophobicContact CD2-CG2 4.06Å; L206-V232 WeakPolarHBondContact O-CG1 3.43Å; I211-V232 HydrophobicContact CD1-CG1 4.23Å; L214-V232 HydrophobicContact CD2-CG1 4.49Å; F228-V232 HydrophobicContact CD1-CG2 4.46Å; F228-V232 HydrophobicContact CD2-CG2 4.33Å; F228-V232 HydrophobicContact CE1-CG2 4.13Å; F228-V232 HydrophobicContact CE2-CG2 3.99Å; F228-V232 HydrophobicContact CZ-CG2 3.89Å; F228-V232 WeakPolarHBondContact O-CG2 3.41Å; F228-V232 PolarHBondContact O-N 2.76Å; S230-V232 VanDerWaalsContact C-N 3.34Å; S230-V232 PolarHBondContact O-N 2.95Å; V232-R236 WeakPolarHBondContact O-CG 3.42Å; V232-R236 PolarHBondContact O-N 2.89Å
233L96.3Very high89.6Confident75 Ų7560.1 Ų60.139%0.39333%0.326SS..Hα-helixtrans-73.4-37.7179-70.7172.1000112.7I211 R229 S230 M231 R236 S237I211-L233 HydrophobicContact CD1-CD2 4.13Å; I211-L233 HydrophobicContact CG1-CD2 4.28Å; R229-L233 HydrophobicContact CG-CD1 3.87Å; R229-L233 HydrophobicContact CG-CG 4.48Å; R229-L233 WeakPolarHBondContact O-CB 3.4Å; R229-L233 VanDerWaalsContact O-CG 3.24Å; R229-L233 WeakPolarHBondContact O-CG 3.39Å; R229-L233 PolarHBondContact O-N 2.93Å; S230-L233 PolarHBondContact O-N 3.2Å; M231-L233 PolarHBondContact O-N 3.13Å; L233-R236 PolarHBondContact O-N 3.49Å; L233-S237 PolarHBondContact O-N 3.07Å
234E95Very high87.2Confident125 Ų12562.7 Ų62.758%0.58434%0.335SS*.Hα-helixtrans-60.8-48.8170.7-178.7-173.6-179.700110.8S230 R236 S237 V238S230-E234 WeakPolarHBondContact O-CB 3.24Å; S230-E234 PolarHBondContact O-N 3.31Å; E234-R236 VanDerWaalsContact C-N 3.29Å; E234-R236 PolarHBondContact O-N 3.17Å; E234-S237 PolarHBondContact O-N 3.16Å; E234-S237 PolarHBondContact O-OG 2.82Å; E234-V238 WeakPolarHBondContact O-CG2 3.45Å; E234-V238 PolarHBondContact O-N 3.49Å
235M93.6Very high84.7Confident28 Ų2871 Ų7114%0.13837%0.374CS..Hα-helixtrans-64.5-31.7178.7-76.1-153.57200113.2L164 L166 M169 M231 E239L164-M235 WeakPolarHBondContact O-CE 3.5Å; L166-M235 HydrophobicContact CB-CB 4.13Å; L166-M235 HydrophobicContact CB-CE 4.06Å; L166-M235 HydrophobicContact CD1-CB 4.02Å; L166-M235 HydrophobicContact CD1-CE 4.11Å; L166-M235 HydrophobicContact CD1-SD 4.02Å; L166-M235 HydrophobicContact CD2-CB 3.88Å; L166-M235 HydrophobicContact CG-CB 4.22Å; M169-M235 HydrophobicContact CE-CE 3.3Å; M169-M235 HydrophobicContact CE-SD 3.95Å; M169-M235 HydrophobicContact SD-CE 3.84Å; M169-M235 HydrophobicContact SD-SD 4.12Å; M231-M235 WeakPolarHBondContact O-CB 3.42Å; M231-M235 WeakPolarHBondContact O-CG 3.45Å; M231-M235 PolarHBondContact O-N 2.96Å; M235-E239 WeakPolarHBondContact O-CB 3.08Å; M235-E239 PolarHBondContact O-N 2.91Å
236R95.4Very high81.6Confident43 Ų4377 Ų7716%0.16241%0.406CS..Hα-helixtrans-66.8-40.1169.1-75.7-179.7-167.9-158.81112.6L166 L206 A207 C209 V232 L233 E234 E239 N240L166-R236 HydrophobicContact CD2-CG 3.71Å; L206-R236 PolarHBondContact O-NE 3.06Å; L206-R236 PolarHBondContact O-NH2 2.95Å; A207-R236 WeakPolarHBondContact O-CD 3.2Å; A207-R236 VanDerWaalsContact O-CZ 3.25Å; A207-R236 PolarHBondContact O-NE 2.86Å; A207-R236 VanDerWaalsContact O-NE 3.13Å; C209-R236 PolarHBondContact O-NH1 3.33Å; C209-R236 VanDerWaalsContact O-NH1 3.08Å; C209-R236 PolarHBondContact O-NH2 3.2Å; C209-R236 PolarHBondContact SG-NH2 3.38Å; V232-R236 WeakPolarHBondContact O-CG 3.42Å; V232-R236 PolarHBondContact O-N 2.89Å; L233-R236 PolarHBondContact O-N 3.49Å; E234-R236 VanDerWaalsContact C-N 3.29Å; E234-R236 PolarHBondContact O-N 3.17Å; R236-E239 PolarHBondContact O-N 2.96Å; R236-N240 WeakPolarHBondContact O-CB 3.33Å; R236-N240 VanDerWaalsContact O-CG 3.23Å; R236-N240 PolarHBondContact O-N 3.22Å; R236-N240 PolarHBondContact O-ND2 3.34Å
237S93.3Very high79.3Confident59 Ų5977.1 Ų77.141%0.41341%0.414SS..Hα-helixtrans-73.2-31.1-179.873.50000112.5L233 E234 Q241L233-S237 PolarHBondContact O-N 3.07Å; E234-S237 PolarHBondContact O-N 3.16Å; E234-S237 PolarHBondContact O-OG 2.82Å; S237-Q241 WeakPolarHBondContact O-CG 3.46Å; S237-Q241 PolarHBondContact O-N 3.03Å; S237-Q241 PolarHBondContact O-NE2 2.88Å
238V89.7Confident76.5Confident64 Ų6483.4 Ų83.439%0.38843%0.434SS..Hα-helixtrans-67.2-50.9169174.60000110.5E234 N240 Q241 V242E234-V238 WeakPolarHBondContact O-CG2 3.45Å; E234-V238 PolarHBondContact O-N 3.49Å; V238-N240 VanDerWaalsContact C-N 3.35Å; V238-N240 PolarHBondContact O-N 2.89Å; V238-Q241 PolarHBondContact O-N 3.49Å; V238-V242 WeakPolarHBondContact O-CG2 3.42Å; V238-V242 PolarHBondContact O-N 3.27Å
239E88.9Confident73.4Confident25 Ų2592.1 Ų92.112%0.11747%0.472CS..Hα-helixtrans-59.8-41.7-179.9177.9155.8-102.400112.7L165 L166 S167 A207 M235 R236 Q241 V242L165-E239 WeakPolarHBondContact CB-OE1 3.25Å; L165-E239 HydrophobicContact CD2-CB 4.3Å; L165-E239 HydrophobicContact CD2-CG 3.91Å; L166-E239 HydrophobicContact CB-CB 4.43Å; L166-E239 PolarHBondContact N-OE1 3.35Å; L166-E239 VanDerWaalsContact N-OE1 3.12Å; S167-E239 WeakPolarHBondContact CB-OE1 3.36Å; S167-E239 WeakPolarHBondContact CB-OE2 3.4Å; S167-E239 VanDerWaalsContact N-CD 3.34Å; S167-E239 PolarHBondContact N-OE1 3.05Å; S167-E239 PolarHBondContact N-OE2 3.27Å; S167-E239 VanDerWaalsContact N-OE2 3.08Å; S167-E239 PolarHBondContact OG-OE1 2.89Å; A207-E239 WeakPolarHBondContact CB-OE2 3.33Å; M235-E239 WeakPolarHBondContact O-CB 3.08Å; M235-E239 PolarHBondContact O-N 2.91Å; R236-E239 PolarHBondContact O-N 2.96Å; E239-Q241 PolarHBondContact O-N 3.34Å; E239-V242 PolarHBondContact O-N 3.38Å
240N81.2Confident70.2Confident128 Ų12896.7 Ų96.768%0.68450%0.502SS*.THydrogen-bonded Turntrans-67.2-14.4176.4-72.5-13.6000114.3R236 V238R236-N240 WeakPolarHBondContact O-CB 3.33Å; R236-N240 VanDerWaalsContact O-CG 3.23Å; R236-N240 PolarHBondContact O-N 3.22Å; R236-N240 PolarHBondContact O-ND2 3.34Å; V238-N240 VanDerWaalsContact C-N 3.35Å; V238-N240 PolarHBondContact O-N 2.89Å
241Q70Confident66.8Low155 Ų155100.1 Ų100.172%0.72451%0.514SS*.THydrogen-bonded Turntrans-95.3-8.3171.9-72.7173.5102.200112.7S237 V238 E239 V243S237-Q241 WeakPolarHBondContact O-CG 3.46Å; S237-Q241 PolarHBondContact O-N 3.03Å; S237-Q241 PolarHBondContact O-NE2 2.88Å; V238-Q241 PolarHBondContact O-N 3.49Å; E239-Q241 PolarHBondContact O-N 3.34Å; Q241-V243 VanDerWaalsContact C-N 3.28Å; Q241-V243 PolarHBondContact O-N 2.83Å
242V58.8Low63.7Low79 Ų79106 Ų10648%0.47954%0.542SS..  trans-99.342.4176.7-174.70000110.2L165 V238 E239 P244L165-V242 HydrophobicContact CD2-CB 3.96Å; L165-V242 HydrophobicContact CD2-CG1 3.91Å; V238-V242 WeakPolarHBondContact O-CG2 3.42Å; V238-V242 PolarHBondContact O-N 3.27Å; E239-V242 PolarHBondContact O-N 3.38Å; V242-P244 WeakPolarHBondContact O-CD 3.41Å
243V43.9Very low60.5Low111 Ų111114.2 Ų114.267%0.67359%0.585SS**  trans-104.883.7156.4-178.30000107.7Q241 E245Q241-V243 VanDerWaalsContact C-N 3.28Å; Q241-V243 PolarHBondContact O-N 2.83Å; V243-E245 PolarHBondContact O-N 3.46Å
244P45Very low57.2Low93 Ų93115.5 Ų115.560%0.60460%0.601SS**  trans-77.3112.6170.532.2-33.2000109.6V242 D246V242-P244 WeakPolarHBondContact O-CD 3.41Å; P244-D246 HydrophobicContact CB-CB 4.29Å; P244-D246 PolarHBondContact O-N 3.04Å
245E45.2Very low54.1Low183 Ų183115.9 Ų115.986%0.85562%0.617SS**  trans-68.670151.7-74.2-74.4129.300108V243V243-E245 PolarHBondContact O-N 3.46Å
246D34.3Very low51.1Low127 Ų127119 Ų11968%0.67965%0.648SS**  trans-74.4131.6-176-161.659.7000110.7P244P244-D246 HydrophobicContact CB-CB 4.29Å; P244-D246 PolarHBondContact O-N 3.04Å
247P49.8Very low48.2Very low87 Ų87123.1 Ų123.157%0.56568%0.68SS**  trans-86.7157.4-166.433.1-36.3000114.3
248R38Very low45.6Very low195 Ų195127.2 Ų127.274%0.73670%0.702SS**  trans109.5131.8159.1-56.2162.3-63.4158.83115.9
249F34.2Very low42.9Very low183 Ų183128.8 Ų128.880%0.80372%0.722SS**  trans75.254156.7-50.2-53.3000119.9
250L29.7Very low40.3Very low174 Ų174137.2 Ų137.291%0.91176%0.76SS**  -132.4147.2110.3-65.5179.5000106.2
251N27Very low37.9Very low143 Ų143134 Ų13477%0.76576%0.757SS**  cis-142.8161.323.7179.248000112.6
252E31.1Very low35.8Very low150 Ų150136.7 Ų136.770%0.70177%0.77SS**  trans-16.8134.6172-155.982.4131.200119.6S254E252-S254 PolarHBondContact O-N 3.28Å
253N30Very low34.5Very low171 Ų171138.5 Ų138.591%0.91479%0.786SS**  trans-65.698.7162.9-82.188.7000111.4
254S26.7Very low33.6Very low103 Ų103136.9 Ų136.972%0.7279%0.785SS**  trans-131.237.2172.473.50000114.9E252E252-S254 PolarHBondContact O-N 3.28Å
255S30.9Very low32.9Very low133 Ų133143.4 Ų143.493%0.9380%0.797SS**  trans-88.6105.2161.8-74.70000110.3
256A30.6Very low32.1Very low94 Ų94145.7 Ų145.778%0.77780%0.798SS**  trans-131.3126.3166.100000109.2
257P34Very low31.5Very low129 Ų129145 Ų14584%0.83880%0.799SS**  trans-81.3164.9-17632.6-35.4000113.7
258V38.3Very low30.3Very low145 Ų145145.7 Ų145.788%0.87981%0.806SS**  trans-53.3135172.1179.50000109.7
259A32.7Very low29.8Very low97 Ų97145.5 Ų145.580%0.80281%0.812SS**  -156.9-178.372.500000116.9
260H34.1Very low29.3Very low201 Ų201141.6 Ų141.693%0.93181%0.808SS**  trans-79.6138.7-167.8-17367.1000113.6
261G31.6Very low29Very low60 Ų60141.9 Ų141.962%0.61980%0.804SS**  trans129.297.5157.500000117.9
262E26.9Very low29.6Very low212 Ų212141.3 Ų141.399%0.99180%0.801SS**  trans60.1-173151.6-57.1-162.994.600119.3
263S30.7Very low30Very low117 Ų117138.4 Ų138.482%0.81880%0.795SS**  trans-136.4131.2-156.51700000112.4
264A25.8Very low30Very low78 Ų78137.7 Ų137.765%0.64579%0.786SS**  trans165.7145.1130.500000115
265R29Very low30.1Very low229 Ų229138.6 Ų138.686%0.86479%0.787SS**  trans63.8104.6143.9-66.3161.8-171.21742.9121.4
266R29.1Very low30Very low232 Ų232139.6 Ų139.688%0.87578%0.777SS**  71.9141.3114.3-79.2-167173.2-138.7-1.9123.6
267T22.1Very low30.3Very low113 Ų113142.6 Ų142.669%0.69378%0.779SS**  trans98.6143.2134.4-73.70000120.6
268S23.6Very low30Very low101 Ų101141.2 Ų141.271%0.70677%0.773SS**  trans64128.4170.738.90000117.4
269H27.6Very low29.6Very low190 Ų190138.5 Ų138.588%0.8876%0.76SS**  cis69.2115.932.8-81.1-98.5000116.9
270S24.5Very low29.7Very low101 Ų101142.5 Ų142.571%0.70676%0.762SS**  trans139.2140.1152.1-79.70000110.6
271E23.6Very low29.7Very low180 Ų180139.1 Ų139.184%0.84176%0.756SS**  cis-158176.2-19.4-128.2153.5152.800110.6
272L37.8Very low30.6Very low132 Ų132141 Ų14169%0.69176%0.757SS**  trans-96.3176.6171-77.3173.8000108.3
273P40Very low31.3Very low88 Ų88141.2 Ų141.257%0.57175%0.75SS**  cis-159-174.132.947.9-26.2000120.4
274H30.8Very low31.4Very low157 Ų157142 Ų14273%0.72775%0.751SS**  trans61159.8158.4-52.4-45.7000117.7
275T27.8Very low32.4Very low122 Ų122145.6 Ų145.675%0.74876%0.758SS**  cis-142.1144.917.8-590000112.3
276E29.7Very low33.2Very low153 Ų153139.3 Ų139.372%0.71574%0.741SS**  trans-0.7145.1142.6-43.4-59.397.900117.7
277L37Very low34.4Very low157 Ų157134.8 Ų134.882%0.82273%0.729SS**  cis-173.5155.1-2.8176.268.7000108.5
278S26.7Very low35.7Very low100 Ų100130.4 Ų130.470%0.69970%0.703SS**  trans150.2108.2131.5-154.40000116.8
279S31.1Very low36.4Very low88 Ų88130.8 Ų130.862%0.61569%0.692SS**  trans43.4118.2138.466.60000124.2
280Q35.1Very low38Very low181 Ų181125.6 Ų125.685%0.84667%0.668SS**  trans57.2131.1131.5-55.3179.512.200119.1
281T34.2Very low39.7Very low130 Ų130126 Ų12680%0.79866%0.658SS**  -153.1171.857.137.80000113.7
282P49.3Very low41.2Very low99 Ų99122.8 Ų122.864%0.64365%0.646SS**  trans-93.7169.5-174.337.1-36.4000115.7
283Y42.5Very low41.9Very low217 Ų217121.5 Ų121.585%0.85164%0.64SS**  trans72.185.7172.5-50.2-67.6000117.3
284T32.8Very low42.2Very low135 Ų135122.8 Ų122.883%0.82865%0.647SS**  trans-121.9128.3146.859.70000108.6
285L45.9Very low43.3Very low152 Ų152122.6 Ų122.680%0.79665%0.65SS**  trans-102.498.6173.1-71.1176.6000108.2F287L285-F287 HydrophobicContact CB-CE2 4.18Å
286N46.2Very low43.9Very low97 Ų97119.9 Ų119.952%0.51965%0.646SS.*  trans-109.179.2179.9-176.989.4000109.5N647 T648N286-N647 PolarHBondContact ND2-O 2.82Å; N286-T648 PolarHBondContact ND2-OG1 2.73Å
287F54.5Low44.5Very low138 Ų138121.1 Ų121.161%0.60566%0.657SS**  trans-70.9141168.2-64.1-75.7000109.9L285 E291L285-F287 HydrophobicContact CB-CE2 4.18Å; F287-E291 WeakPolarHBondContact CA-OE2 3.15Å
288S49.4Very low44.4Very low21 Ų21121.5 Ų121.515%0.14766%0.66CS.*  trans-82.3146.9163.4-176.10000109.4E290 E291 N645S288-E290 PolarHBondContact O-N 3.31Å; S288-E290 VanDerWaalsContact O-N 3.08Å; S288-E290 PolarHBondContact OG-N 3.13Å; S288-E291 PolarHBondContact N-OE2 2.92Å; S288-E291 WeakPolarHBondContact O-CB 3.29Å; S288-E291 PolarHBondContact O-N 3.31Å; S288-N645 PolarHBondContact OG-ND2 2.68Å
289F38.2Very low45.2Very low109 Ų109124.7 Ų124.748%0.47866%0.664SS.*THydrogen-bonded Turntrans-60.9-11.3167.9165.3-99.7000111.9E291 L292 L644 N645F289-E291 PolarHBondContact O-N 3.21Å; F289-L292 PolarHBondContact O-N 3.37Å; F289-L644 HydrophobicContact CD1-CB 3.84Å; F289-L644 HydrophobicContact CD1-CD2 3.19Å; F289-L644 HydrophobicContact CD1-CG 4.07Å; F289-L644 HydrophobicContact CE1-CB 4.5Å; F289-L644 HydrophobicContact CE1-CD2 3.26Å; F289-L644 HydrophobicContact CE1-CG 4.42Å; F289-L644 HydrophobicContact CG-CD2 3.96Å; F289-L644 HydrophobicContact CZ-CD2 4.03Å; F289-L644 WeakPolarHBondContact O-CD1 3.46Å; F289-N645 HydrophobicContact CB-CB 3.63Å; F289-N645 VanDerWaalsContact CB-CG 3.48Å; F289-N645 HydrophobicContact CD1-CB 3.42Å; F289-N645 VanDerWaalsContact CD1-CB 3.42Å; F289-N645 HydrophobicContact CE1-CB 4.36Å; F289-N645 HydrophobicContact CG-CB 3.99Å; F289-N645 PolarHBondContact N-ND2 3.28Å
290E61.6Low45.1Very low80 Ų80124.7 Ų124.737%0.37468%0.677SS.*THydrogen-bonded Turntrans-53.7-39.5161.9-168.372.1-129.800112.3S288 T643 L644S288-E290 PolarHBondContact O-N 3.31Å; S288-E290 VanDerWaalsContact O-N 3.08Å; S288-E290 PolarHBondContact OG-N 3.13Å; E290-T643 WeakPolarHBondContact OE1-CB 3.49Å; E290-T643 PolarHBondContact OE1-OG1 2.97Å; E290-T643 VanDerWaalsContact OE2-CB 3.29Å; E290-T643 WeakPolarHBondContact OE2-CB 3.48Å; E290-T643 PolarHBondContact OE2-OG1 2.77Å; E290-T643 VanDerWaalsContact OE2-OG1 3.09Å; E290-L644 VanDerWaalsContact CA-CD1 3.47Å; E290-L644 HydrophobicContact CB-CB 4.09Å; E290-L644 HydrophobicContact CB-CD1 4.48Å
291E60.1Low45.1Very low109 Ų109119.1 Ų119.151%0.50966%0.663SS.*THydrogen-bonded Turntrans-84.5-12.9-176.4-57.9168.4110.600113F287 S288 F289F287-E291 WeakPolarHBondContact CA-OE2 3.15Å; S288-E291 PolarHBondContact N-OE2 2.92Å; S288-E291 WeakPolarHBondContact O-CB 3.29Å; S288-E291 PolarHBondContact O-N 3.31Å; F289-E291 PolarHBondContact O-N 3.21Å
292L55.8Low45.7Very low113 Ų113117.5 Ų117.559%0.59265%0.654SS**THydrogen-bonded Turntrans-88.4-25.3-179.5-84.1167.1000113.8F289 T294F289-L292 PolarHBondContact O-N 3.37Å; L292-T294 VanDerWaalsContact C-N 3.3Å; L292-T294 PolarHBondContact O-N 3.31Å
293N51.6Low45.2Very low105 Ų105122 Ų12256%0.56166%0.658SS**THydrogen-bonded Turntrans-85-0.5-167.9-155.956000114.1L644N293-L644 HydrophobicContact CB-CD1 3.27Å; N293-L644 HydrophobicContact CB-CD2 3.85Å; N293-L644 HydrophobicContact CB-CG 4.23Å
294T47.1Very low44.8Very low115 Ų115119 Ų11971%0.70665%0.652SS**THydrogen-bonded Turntrans-92.52.2178.848.50000113.8L292L292-T294 VanDerWaalsContact C-N 3.3Å; L292-T294 PolarHBondContact O-N 3.31Å
295L52.9Low44.7Very low153 Ų153117.1 Ų117.180%0.80164%0.644SS**  trans-104.415.3179.3-64.5173.6000113.6
296G41.4Very low43.9Very low65 Ų65117 Ų11767%0.6764%0.644SS**  trans-86135172.700000112.7
297L41.1Very low43.4Very low179 Ų179120.5 Ų120.594%0.93766%0.662SS**  trans-63.9148.1179-70.8154.4000113.4
298D35.8Very low42.3Very low166 Ų166119.6 Ų119.689%0.88867%0.673SS**  trans-129.7149.4149.7-173.529.3000109.2
299E43.9Very low41.5Very low167 Ų167130.1 Ų130.178%0.7871%0.709SS**  trans-119.3125.7-165.4-171.3178.1135.300113.3A301E299-A301 HydrophobicContact CG-CB 4.5Å
300G27.7Very low41.7Very low87 Ų87133.2 Ų133.290%0.89773%0.726SS**  trans-116.337.2-174.800000115.7
301A36.2Very low40.2Very low65 Ų65134.8 Ų134.854%0.53775%0.745SS.*  trans-77.8172.1168.800000110.7E299E299-A301 HydrophobicContact CG-CB 4.5Å
302P46Very low39Very low95 Ų95138.7 Ų138.762%0.61776%0.764SS**  cis-142.9-178.410.230.6-5.3000116.6
303R38Very low37.8Very low193 Ų193138.6 Ų138.673%0.72877%0.768SS**  141.890.7125.4-70.2-148.414898.48.2116.9
304H33.9Very low37.3Very low156 Ų156145.4 Ų145.472%0.72279%0.785SS**  trans73.1150.9134.4-45.1-36.8000118.3
305S30.9Very low37Very low95 Ų95150.4 Ų150.466%0.66479%0.792SS**  cis-176.6167.7-19.663.30000107.6
306N29.4Very low36.3Very low149 Ų149149 Ų14980%0.79779%0.789SS**  cis-150.8152.35.6-99.1-45.6000108.8
307L35.7Very low36.3Very low170 Ų170150.7 Ų150.789%0.8979%0.788SS**  trans-146128.6154-95.1175.8000109.4
308S31.7Very low36Very low119 Ų119147 Ų14783%0.83278%0.777SS**  trans-96.2119.8-165.754.40000113.7
309W31.9Very low36.7Very low242 Ų242146.2 Ų146.292%0.91777%0.773SS**  trans-82.9135.4167.2-73.582.2000111.4
310Q43.3Very low36.9Very low175 Ų175143.1 Ų143.182%0.81877%0.769SS**  trans-118.5163.5156.8-76.4-168.3-15.400109.6
311S29.7Very low37.6Very low113 Ų113142.1 Ų142.179%0.7975%0.749SS**SBendtrans71.961.7167.5-53.40000117.9
312Q34.1Very low38.3Very low191 Ų191145.9 Ų145.989%0.89376%0.759SS**  62.672.6122.8-163.8161.4-22.200119
313T31.2Very low38.9Very low110 Ų110149.3 Ų149.368%0.67577%0.772SS**  trans-77.8136.8153.1-40.50000110.3R315T313-R315 VanDerWaalsContact C-N 3.28Å; T313-R315 PolarHBondContact O-N 3.41Å
314R42.3Very low40.1Very low248 Ų248142.6 Ų142.694%0.93676%0.755SS**  trans-69.888.1157.8-76.4-172.2-178.2-91.84.2108.4
315R40.3Very low41.6Very low221 Ų221142.8 Ų142.883%0.83476%0.756SS**PPolyproline II helixtrans-67.1138.2170.4-74.4-173.7174.9177.7-1.9109.6T313T313-R315 VanDerWaalsContact C-N 3.28Å; T313-R315 PolarHBondContact O-N 3.41Å
316T36.8Very low43.4Very low123 Ų123144.1 Ų144.176%0.75576%0.756SS**PPolyproline II helixtrans-59.9138.4158.640.90000109S318T316-S318 PolarHBondContact O-N 2.87Å
317P41.4Very low45.2Very low100 Ų100138.5 Ų138.565%0.64973%0.728SS**PPolyproline II helixtrans-67.3127.5172.128.1-32.5000109.1
318S36.1Very low46.9Very low101 Ų101133.8 Ų133.871%0.70671%0.71SS**PPolyproline II helixtrans-70.3128.7173.5-56.40000109.5T316 S320T316-S318 PolarHBondContact O-N 2.87Å; S318-S320 PolarHBondContact O-N 2.93Å
319L50Low49.2Very low151 Ų151131.5 Ų131.579%0.79169%0.687SS**SBendtrans-73.228.6-178.6-63.6174.2000113.8S321L319-S321 VanDerWaalsContact C-N 3.32Å; L319-S321 PolarHBondContact O-N 2.89Å
320S47.6Very low51.6Low101 Ų101125.5 Ų125.571%0.70667%0.669SS**  trans-88.113.2-169.655.20000114.9S318S318-S320 PolarHBondContact O-N 2.93Å
321S43.6Very low53.2Low67 Ų67121.6 Ų121.647%0.46965%0.653SS.*  trans-143.760.1-179.3-64.30000112.9L319 N323 S324 S327L319-S321 VanDerWaalsContact C-N 3.32Å; L319-S321 PolarHBondContact O-N 2.89Å; S321-N323 PolarHBondContact O-N 3.08Å; S321-S324 PolarHBondContact O-N 3.02Å; S321-S324 VanDerWaalsContact O-N 3.09Å; S321-S327 PolarHBondContact O-OG 3.23Å
322L50.2Low55.8Low143 Ų143119 Ų11975%0.74964%0.635SS**THydrogen-bonded Turntrans-59.9-0.7177.2-72.3171.7000115.6
323N59Low58.2Low167 Ų167116.4 Ų116.489%0.89362%0.621SS**THydrogen-bonded Turntrans-112.512.2178.7-163.538.8000113.3S321S321-N323 PolarHBondContact O-N 3.08Å
324S63.4Low60.5Low53 Ų53116.4 Ų116.437%0.37162%0.616SS.*  trans-82.9139.5172.8-71.60000111.3S321 D326 S327 S328S321-S324 PolarHBondContact O-N 3.02Å; S321-S324 VanDerWaalsContact O-N 3.09Å; S324-D326 PolarHBondContact O-N 3.35Å; S324-S327 WeakPolarHBondContact O-CB 3.4Å; S324-S327 PolarHBondContact O-N 3.09Å; S324-S328 PolarHBondContact O-N 2.83Å
325Q64.6Low62.6Low159 Ų159107.7 Ų107.774%0.74359%0.591SS**Hα-helixtrans-60.3-34.9-178.4-171.8170.4-37.200112.4S327 S328 I329Q325-S327 VanDerWaalsContact C-N 3.33Å; Q325-S327 PolarHBondContact O-N 3.39Å; Q325-S328 WeakPolarHBondContact O-CB 3.35Å; Q325-S328 PolarHBondContact O-N 2.85Å; Q325-I329 WeakPolarHBondContact O-CG1 3.31Å; Q325-I329 PolarHBondContact O-N 3.09Å; Q325-I329 VanDerWaalsContact O-N 3.14Å
326D69.4Low65.1Low124 Ų124101.7 Ų101.766%0.66358%0.575SS**Hα-helixtrans-63.4-34.8172.9-57.1-80.2000113.1S324 I329 E330S324-D326 PolarHBondContact O-N 3.35Å; D326-I329 WeakPolarHBondContact O-CB 3.47Å; D326-I329 PolarHBondContact O-N 2.86Å; D326-E330 PolarHBondContact O-N 3.36Å
327S67.8Low67.8Low30 Ų30102.4 Ų102.421%0.2157%0.568CS.*Hα-helixtrans-68.9-34.4174.9-57.20000111.7S321 S324 Q325 I329 E330 I331S321-S327 PolarHBondContact O-OG 3.23Å; S324-S327 WeakPolarHBondContact O-CB 3.4Å; S324-S327 PolarHBondContact O-N 3.09Å; Q325-S327 VanDerWaalsContact C-N 3.33Å; Q325-S327 PolarHBondContact O-N 3.39Å; S327-I329 VanDerWaalsContact C-N 3.33Å; S327-E330 PolarHBondContact O-N 2.96Å; S327-I331 WeakPolarHBondContact O-CB 3.45Å; S327-I331 WeakPolarHBondContact O-CD1 3.33Å; S327-I331 WeakPolarHBondContact O-CG1 3.42Å; S327-I331 PolarHBondContact O-N 3.42Å
328S70.2Confident70.3Confident72 Ų72101.6 Ų101.650%0.50356%0.561SS.*Hα-helixtrans-61.2-44169.8-171.40000111.1S324 Q325 E330 I331 S332S324-S328 PolarHBondContact O-N 2.83Å; Q325-S328 WeakPolarHBondContact O-CB 3.35Å; Q325-S328 PolarHBondContact O-N 2.85Å; S328-E330 VanDerWaalsContact C-N 3.35Å; S328-E330 PolarHBondContact O-N 2.79Å; S328-I331 PolarHBondContact O-N 2.9Å; S328-S332 PolarHBondContact O-N 3.45Å; S328-S332 PolarHBondContact O-OG 3.28Å
329I80.2Confident73Confident70 Ų70101.1 Ų101.136%0.35955%0.547SS..Hα-helixtrans-65.1-36.7176.8-65.6165.2000111.7Q325 D326 S327 K333Q325-I329 WeakPolarHBondContact O-CG1 3.31Å; Q325-I329 PolarHBondContact O-N 3.09Å; Q325-I329 VanDerWaalsContact O-N 3.14Å; D326-I329 WeakPolarHBondContact O-CB 3.47Å; D326-I329 PolarHBondContact O-N 2.86Å; S327-I329 VanDerWaalsContact C-N 3.33Å; I329-K333 HydrophobicContact CG2-CD 4.07Å; I329-K333 WeakPolarHBondContact O-CB 3.36Å; I329-K333 WeakPolarHBondContact O-CD 3.4Å; I329-K333 VanDerWaalsContact O-CG 3.24Å; I329-K333 WeakPolarHBondContact O-CG 3.35Å; I329-K333 PolarHBondContact O-N 3.49Å
330E82.1Confident75.1Confident117 Ų11796 Ų9655%0.54753%0.527SS..Hα-helixtrans-70.3-40.1175.6-171.6166.5-141.100112.1D326 S327 S328 K333 L334D326-E330 PolarHBondContact O-N 3.36Å; S327-E330 PolarHBondContact O-N 2.96Å; S328-E330 VanDerWaalsContact C-N 3.35Å; S328-E330 PolarHBondContact O-N 2.79Å; E330-K333 PolarHBondContact O-N 3.44Å; E330-L334 WeakPolarHBondContact O-CB 3.39Å; E330-L334 PolarHBondContact O-N 2.84Å
331I77Confident77.3Confident92 Ų9297.1 Ų97.147%0.47252%0.521SS..Hα-helixtrans-64.5-42.2173.5-69.3162.6000110.9S327 S328 L334 T335S327-I331 WeakPolarHBondContact O-CB 3.45Å; S327-I331 WeakPolarHBondContact O-CD1 3.33Å; S327-I331 WeakPolarHBondContact O-CG1 3.42Å; S327-I331 PolarHBondContact O-N 3.42Å; S328-I331 PolarHBondContact O-N 2.9Å; I331-L334 PolarHBondContact O-N 3.44Å; I331-T335 WeakPolarHBondContact O-CB 3.39Å; I331-T335 PolarHBondContact O-N 3.04Å; I331-T335 PolarHBondContact O-OG1 3.27Å
332S84.1Confident79.7Confident59 Ų59101.7 Ų101.741%0.41353%0.529SS..Hα-helixtrans-58.9-52.1171.4-65.30000111.1S328 L334 T335 D336S328-S332 PolarHBondContact O-N 3.45Å; S328-S332 PolarHBondContact O-OG 3.28Å; S332-L334 VanDerWaalsContact C-N 3.3Å; S332-L334 PolarHBondContact O-N 3.43Å; S332-T335 CarbonylContact O-C 3.56Å; S332-T335 WeakPolarHBondContact O-CA 3.18Å; S332-T335 WeakPolarHBondContact O-CB 3.37Å; S332-T335 PolarHBondContact O-N 2.63Å; S332-D336 PolarHBondContact O-N 3.03Å
333K84.4Confident81.8Confident136 Ų136102.3 Ų102.359%0.59152%0.521SS*.Hα-helixtrans-59.6-36.3178.3-74.6166-178.2170.40113.4I329 E330 K337I329-K333 HydrophobicContact CG2-CD 4.07Å; I329-K333 WeakPolarHBondContact O-CB 3.36Å; I329-K333 WeakPolarHBondContact O-CD 3.4Å; I329-K333 VanDerWaalsContact O-CG 3.24Å; I329-K333 WeakPolarHBondContact O-CG 3.35Å; I329-K333 PolarHBondContact O-N 3.49Å; E330-K333 PolarHBondContact O-N 3.44Å; K333-K337 VanDerWaalsContact O-CB 3.27Å; K333-K337 WeakPolarHBondContact O-CB 3.36Å; K333-K337 PolarHBondContact O-N 3Å
334L79.6Confident83.6Confident110 Ų11098.2 Ų98.258%0.57650%0.499SS*.Hα-helixtrans-67.1-42.1173.8-178.560.6000111.1E330 I331 S332 K337 V338E330-L334 WeakPolarHBondContact O-CB 3.39Å; E330-L334 PolarHBondContact O-N 2.84Å; I331-L334 PolarHBondContact O-N 3.44Å; S332-L334 VanDerWaalsContact C-N 3.3Å; S332-L334 PolarHBondContact O-N 3.43Å; L334-K337 PolarHBondContact O-N 2.97Å; L334-V338 WeakPolarHBondContact O-CG2 3.49Å; L334-V338 PolarHBondContact O-N 3.23Å
335T87.8Confident85.1Confident66 Ų6698.4 Ų98.441%0.40551%0.505SS..Hα-helixtrans-63-46.7174.8-53.50000111.3I331 S332 K337 V338 Q339I331-T335 WeakPolarHBondContact O-CB 3.39Å; I331-T335 PolarHBondContact O-N 3.04Å; I331-T335 PolarHBondContact O-OG1 3.27Å; S332-T335 CarbonylContact O-C 3.56Å; S332-T335 WeakPolarHBondContact O-CA 3.18Å; S332-T335 WeakPolarHBondContact O-CB 3.37Å; S332-T335 PolarHBondContact O-N 2.63Å; T335-K337 VanDerWaalsContact C-N 3.32Å; T335-K337 PolarHBondContact O-N 3.09Å; T335-V338 PolarHBondContact O-N 3.46Å; T335-Q339 WeakPolarHBondContact O-CB 3.42Å; T335-Q339 WeakPolarHBondContact O-CG 3.34Å; T335-Q339 PolarHBondContact O-N 3.35Å
336D91Very high86.6Confident95 Ų9596.9 Ų96.951%0.50849%0.493SS..Hα-helixtrans-60.5-41.7176.2-63.3-32.2000111.2S332 Q339 A340S332-D336 PolarHBondContact O-N 3.03Å; D336-Q339 PolarHBondContact O-N 3.34Å; D336-A340 WeakPolarHBondContact O-CB 3.43Å; D336-A340 PolarHBondContact O-N 3.23Å
337K93.6Very high87.8Confident137 Ų13797.6 Ų97.660%0.59649%0.486SS*.Hα-helixtrans-64.2-45.5176.1-175-178.1174.3-169.40111.7K333 L334 T335 Q339 A340 E341K333-K337 VanDerWaalsContact O-CB 3.27Å; K333-K337 WeakPolarHBondContact O-CB 3.36Å; K333-K337 PolarHBondContact O-N 3Å; L334-K337 PolarHBondContact O-N 2.97Å; T335-K337 VanDerWaalsContact C-N 3.32Å; T335-K337 PolarHBondContact O-N 3.09Å; K337-Q339 VanDerWaalsContact C-N 3.32Å; K337-Q339 PolarHBondContact O-N 3.35Å; K337-A340 PolarHBondContact O-N 2.86Å; K337-E341 WeakPolarHBondContact O-CB 3.5Å; K337-E341 PolarHBondContact O-N 3.42Å
338V94.8Very high89.1Confident84 Ų84101.5 Ų101.551%0.50950%0.501SS..Hα-helixtrans-65.6-36.3176.9170.50000111.2L334 T335 Y342L334-V338 WeakPolarHBondContact O-CG2 3.49Å; L334-V338 PolarHBondContact O-N 3.23Å; T335-V338 PolarHBondContact O-N 3.46Å; V338-Y342 WeakPolarHBondContact O-CB 3.27Å; V338-Y342 PolarHBondContact O-N 2.87Å
339Q93.2Very high90.2Very high91 Ų91104.2 Ų104.243%0.42550%0.501SS..Hα-helixtrans-68.1-36.9172.7-73-175.327.900112.8T335 D336 K337 R343T335-Q339 WeakPolarHBondContact O-CB 3.42Å; T335-Q339 WeakPolarHBondContact O-CG 3.34Å; T335-Q339 PolarHBondContact O-N 3.35Å; D336-Q339 PolarHBondContact O-N 3.34Å; K337-Q339 VanDerWaalsContact C-N 3.32Å; K337-Q339 PolarHBondContact O-N 3.35Å; Q339-R343 WeakPolarHBondContact O-CB 3.36Å; Q339-R343 VanDerWaalsContact O-CG 3.25Å; Q339-R343 WeakPolarHBondContact O-CG 3.32Å; Q339-R343 PolarHBondContact O-N 3.28Å
340A92.8Very high90.9Very high43 Ų43105 Ų10536%0.35551%0.505SS..Hα-helixtrans-65.9-48.417300000110.8D336 K337 Y342 R343 D344D336-A340 WeakPolarHBondContact O-CB 3.43Å; D336-A340 PolarHBondContact O-N 3.23Å; K337-A340 PolarHBondContact O-N 2.86Å; A340-Y342 VanDerWaalsContact C-N 3.32Å; A340-Y342 PolarHBondContact O-N 3.01Å; A340-R343 CarbonylContact O-C 3.59Å; A340-R343 WeakPolarHBondContact O-CB 3.33Å; A340-R343 PolarHBondContact O-N 2.94Å; A340-R343 VanDerWaalsContact O-N 3.09Å; A340-D344 WeakPolarHBondContact O-CB 3.33Å; A340-D344 PolarHBondContact O-N 2.85Å; A340-D344 VanDerWaalsContact O-OD1 3.06Å
341E93.8Very high91.4Very high124 Ų124101.6 Ų101.658%0.57950%0.497SS*.Hα-helixtrans-59.3-40.8177.1-168.516617400111.8K337 D344 A345K337-E341 WeakPolarHBondContact O-CB 3.5Å; K337-E341 PolarHBondContact O-N 3.42Å; E341-D344 PolarHBondContact O-N 2.75Å; E341-A345 WeakPolarHBondContact O-CB 3.34Å; E341-A345 PolarHBondContact O-N 2.92Å
342Y95.1Very high92.2Very high163 Ų163102.3 Ų102.364%0.63950%0.498SS*.Hα-helixtrans-63.4-45.6170.9178.9-93000112.8V338 A340 D344 Y346V338-Y342 WeakPolarHBondContact O-CB 3.27Å; V338-Y342 PolarHBondContact O-N 2.87Å; A340-Y342 VanDerWaalsContact C-N 3.32Å; A340-Y342 PolarHBondContact O-N 3.01Å; Y342-D344 VanDerWaalsContact C-N 3.27Å; Y342-D344 PolarHBondContact O-N 3.41Å; Y342-Y346 VanDerWaalsContact O-CB 3.23Å; Y342-Y346 WeakPolarHBondContact O-CB 3.25Å; Y342-Y346 PolarHBondContact O-N 2.92Å
343R94.9Very high92.2Very high156 Ų156103.5 Ų103.559%0.58950%0.498SS*.Hα-helixtrans-63.7-33.7176.2-77.5171.3178.11593.1112.1Q339 A340 R347Q339-R343 WeakPolarHBondContact O-CB 3.36Å; Q339-R343 VanDerWaalsContact O-CG 3.25Å; Q339-R343 WeakPolarHBondContact O-CG 3.32Å; Q339-R343 PolarHBondContact O-N 3.28Å; A340-R343 CarbonylContact O-C 3.59Å; A340-R343 WeakPolarHBondContact O-CB 3.33Å; A340-R343 PolarHBondContact O-N 2.94Å; A340-R343 VanDerWaalsContact O-N 3.09Å; R343-R347 WeakPolarHBondContact O-CG 3.39Å; R343-R347 PolarHBondContact O-N 3.09Å; R343-R347 PolarHBondContact O-NH1 3.44Å
344D96Very high92.1Very high81 Ų81100.3 Ų100.343%0.43349%0.493SS..Hα-helixtrans-74.9-48.8-179.3-77.729.9000110.3A340 E341 Y342 Y346 R347 E348A340-D344 WeakPolarHBondContact O-CB 3.33Å; A340-D344 PolarHBondContact O-N 2.85Å; A340-D344 VanDerWaalsContact O-OD1 3.06Å; E341-D344 PolarHBondContact O-N 2.75Å; Y342-D344 VanDerWaalsContact C-N 3.27Å; Y342-D344 PolarHBondContact O-N 3.41Å; D344-Y346 VanDerWaalsContact C-N 3.27Å; D344-Y346 PolarHBondContact O-N 3.38Å; D344-R347 PolarHBondContact O-N 2.87Å; D344-R347 VanDerWaalsContact O-N 3.16Å; D344-R347 IonicContact OD1-CZ 3.13Å; D344-R347 IonicContact OD1-NH1 3.11Å; D344-R347 PolarHBondContact OD1-NH1 2.9Å; D344-R347 IonicContact OD1-NH2 3.75Å; D344-R347 PolarHBondContact OD1-NH2 3.38Å; D344-R347 IonicContact OD2-NH2 2.69Å; D344-R347 PolarHBondContact OD2-NH2 3.49Å; D344-E348 PolarHBondContact O-N 3.38Å
345A95.1Very high91.8Very high58 Ų58102.4 Ų102.448%0.47950%0.5SS..Hα-helixtrans-59.1-35.9171.600000112.6E341 E348 Y349E341-A345 WeakPolarHBondContact O-CB 3.34Å; E341-A345 PolarHBondContact O-N 2.92Å; A345-E348 PolarHBondContact O-N 2.9Å; A345-Y349 WeakPolarHBondContact O-CB 3.23Å; A345-Y349 PolarHBondContact O-N 2.83Å
346Y95.7Very high90.9Very high126 Ų126105.6 Ų105.649%0.49451%0.514SS..Hα-helixtrans-70.2-38175.6-171.8-107.3000112.8Y342 D344 I350Y342-Y346 VanDerWaalsContact O-CB 3.23Å; Y342-Y346 WeakPolarHBondContact O-CB 3.25Å; Y342-Y346 PolarHBondContact O-N 2.92Å; D344-Y346 VanDerWaalsContact C-N 3.27Å; D344-Y346 PolarHBondContact O-N 3.38Å; Y346-I350 HydrophobicContact CD1-CD1 3.89Å; Y346-I350 HydrophobicContact CE1-CD1 3.49Å; Y346-I350 VanDerWaalsContact CE1-CD1 3.49Å; Y346-I350 HydrophobicContact CE1-CG1 4.47Å; Y346-I350 WeakPolarHBondContact O-CG1 3.39Å; Y346-I350 PolarHBondContact O-N 3.24Å; Y346-I350 VanDerWaalsContact O-N 3.07Å
347R95.4Very high89.5Confident139 Ų139109.7 Ų109.753%0.52553%0.53SS..Hα-helixtrans-65.7-40170.9-73.6-167.1-44-74.610.1111.6R343 D344 I350 A351R343-R347 WeakPolarHBondContact O-CG 3.39Å; R343-R347 PolarHBondContact O-N 3.09Å; R343-R347 PolarHBondContact O-NH1 3.44Å; D344-R347 PolarHBondContact O-N 2.87Å; D344-R347 VanDerWaalsContact O-N 3.16Å; D344-R347 IonicContact OD1-CZ 3.13Å; D344-R347 IonicContact OD1-NH1 3.11Å; D344-R347 PolarHBondContact OD1-NH1 2.9Å; D344-R347 IonicContact OD1-NH2 3.75Å; D344-R347 PolarHBondContact OD1-NH2 3.38Å; D344-R347 IonicContact OD2-NH2 2.69Å; D344-R347 PolarHBondContact OD2-NH2 3.49Å; R347-I350 PolarHBondContact O-N 2.95Å; R347-A351 WeakPolarHBondContact O-CB 3.35Å; R347-A351 PolarHBondContact O-N 3.37Å
348E94Very high87.9Confident113 Ų113106 Ų10653%0.52853%0.53SS..Hα-helixtrans-64.6-45.7176-162.2-169.2151.700111.2D344 A345 I350 A351 Q352D344-E348 PolarHBondContact O-N 3.38Å; A345-E348 PolarHBondContact O-N 2.9Å; E348-I350 VanDerWaalsContact C-N 3.33Å; E348-I350 PolarHBondContact O-N 2.79Å; E348-A351 CarbonylContact O-C 3.33Å; E348-A351 WeakPolarHBondContact O-CA 3.48Å; E348-A351 WeakPolarHBondContact O-CB 3.45Å; E348-A351 PolarHBondContact O-N 2.9Å; E348-Q352 HydrophobicContact CG-CG 4.44Å; E348-Q352 WeakPolarHBondContact O-CG 3.49Å; E348-Q352 PolarHBondContact O-N 3.41Å; E348-Q352 PolarHBondContact OE1-NE2 3.26Å
349Y94.8Very high85.5Confident129 Ų129104.7 Ų104.751%0.50654%0.535SS..Hα-helixtrans-55.7-45.2174.5173.3-103.2000112A345 A351 Q352 M353A345-Y349 WeakPolarHBondContact O-CB 3.23Å; A345-Y349 PolarHBondContact O-N 2.83Å; Y349-A351 VanDerWaalsContact C-N 3.32Å; Y349-A351 PolarHBondContact O-N 2.87Å; Y349-Q352 PolarHBondContact O-N 3.16Å; Y349-M353 HydrophobicContact CD1-CG 4.46Å; Y349-M353 HydrophobicContact CD2-CG 4.11Å; Y349-M353 HydrophobicContact CE1-CG 4.05Å; Y349-M353 HydrophobicContact CE2-CG 3.67Å; Y349-M353 HydrophobicContact CE2-SD 4.05Å; Y349-M353 HydrophobicContact CG-CG 4.49Å; Y349-M353 WeakPolarHBondContact O-CB 3.49Å; Y349-M353 VanDerWaalsContact O-CG 3.31Å; Y349-M353 WeakPolarHBondContact O-CG 3.39Å; Y349-M353 PolarHBondContact O-N 2.78Å
350I94.1Very high83.5Confident86 Ų86108 Ų10844%0.44156%0.561SS.*Hα-helixtrans-61.1-41.1174.2-70.8168.9000111.3Y346 R347 E348 M353 S354Y346-I350 HydrophobicContact CD1-CD1 3.89Å; Y346-I350 HydrophobicContact CE1-CD1 3.49Å; Y346-I350 VanDerWaalsContact CE1-CD1 3.49Å; Y346-I350 HydrophobicContact CE1-CG1 4.47Å; Y346-I350 WeakPolarHBondContact O-CG1 3.39Å; Y346-I350 PolarHBondContact O-N 3.24Å; Y346-I350 VanDerWaalsContact O-N 3.07Å; R347-I350 PolarHBondContact O-N 2.95Å; E348-I350 VanDerWaalsContact C-N 3.33Å; E348-I350 PolarHBondContact O-N 2.79Å; I350-M353 PolarHBondContact O-N 3.01Å; I350-S354 WeakPolarHBondContact O-CB 3.41Å; I350-S354 PolarHBondContact O-N 3.33Å; I350-S354 PolarHBondContact O-OG 3.04Å
351A93.4Very high81.3Confident45 Ų45109.4 Ų109.437%0.37258%0.58SS.*Hα-helixtrans-70.7-29.4177.700000113.7R347 E348 Y349 S354 Q355R347-A351 WeakPolarHBondContact O-CB 3.35Å; R347-A351 PolarHBondContact O-N 3.37Å; E348-A351 CarbonylContact O-C 3.33Å; E348-A351 WeakPolarHBondContact O-CA 3.48Å; E348-A351 WeakPolarHBondContact O-CB 3.45Å; E348-A351 PolarHBondContact O-N 2.9Å; Y349-A351 VanDerWaalsContact C-N 3.32Å; Y349-A351 PolarHBondContact O-N 2.87Å; A351-S354 PolarHBondContact O-OG 2.99Å; A351-Q355 WeakPolarHBondContact O-CG 3.47Å; A351-Q355 PolarHBondContact O-NE2 3.25Å
352Q92.4Very high78.7Confident107 Ų107108.4 Ų108.450%0.559%0.587SS.*Hα-helixtrans-72.6-43.7171.7-69.4-179.514.700110.8E348 Y349 Q355 L356E348-Q352 HydrophobicContact CG-CG 4.44Å; E348-Q352 WeakPolarHBondContact O-CG 3.49Å; E348-Q352 PolarHBondContact O-N 3.41Å; E348-Q352 PolarHBondContact OE1-NE2 3.26Å; Y349-Q352 PolarHBondContact O-N 3.16Å; Q352-Q355 PolarHBondContact O-N 3.07Å; Q352-L356 PolarHBondContact O-N 2.96Å
353M83.7Confident76.3Confident84 Ų84106.7 Ų106.741%0.41460%0.598SS.*Hα-helixtrans-69.8-37.2179.6-68.5-58.7-64.500113Y349 I350 Q355 L356 E357Y349-M353 HydrophobicContact CD1-CG 4.46Å; Y349-M353 HydrophobicContact CD2-CG 4.11Å; Y349-M353 HydrophobicContact CE1-CG 4.05Å; Y349-M353 HydrophobicContact CE2-CG 3.67Å; Y349-M353 HydrophobicContact CE2-SD 4.05Å; Y349-M353 HydrophobicContact CG-CG 4.49Å; Y349-M353 WeakPolarHBondContact O-CB 3.49Å; Y349-M353 VanDerWaalsContact O-CG 3.31Å; Y349-M353 WeakPolarHBondContact O-CG 3.39Å; Y349-M353 PolarHBondContact O-N 2.78Å; I350-M353 PolarHBondContact O-N 3.01Å; M353-Q355 VanDerWaalsContact C-N 3.28Å; M353-Q355 PolarHBondContact O-N 3.41Å; M353-L356 WeakPolarHBondContact O-CB 3.37Å; M353-L356 PolarHBondContact O-N 2.91Å; M353-E357 PolarHBondContact O-N 3.32Å
354S82.7Confident73.7Confident69 Ų69104.8 Ų104.848%0.48361%0.605SS.*Hα-helixtrans-66.8-29.117767.70000113.1I350 A351 L356 G358I350-S354 WeakPolarHBondContact O-CB 3.41Å; I350-S354 PolarHBondContact O-N 3.33Å; I350-S354 PolarHBondContact O-OG 3.04Å; A351-S354 PolarHBondContact O-OG 2.99Å; S354-L356 VanDerWaalsContact C-N 3.28Å; S354-L356 PolarHBondContact O-N 3.38Å; S354-G358 PolarHBondContact O-N 3.36Å
355Q73.1Confident71.2Confident154 Ų154109.2 Ų109.272%0.7263%0.626SS**Hα-helixtrans-70.7-21.6170.2-74.4174.493.200113.2A351 Q352 M353A351-Q355 WeakPolarHBondContact O-CG 3.47Å; A351-Q355 PolarHBondContact O-NE2 3.25Å; Q352-Q355 PolarHBondContact O-N 3.07Å; M353-Q355 VanDerWaalsContact C-N 3.28Å; M353-Q355 PolarHBondContact O-N 3.41Å
356L69.8Low68.6Low134 Ų134112.2 Ų112.270%0.70264%0.644SS**Hα-helixtrans-86.9-31.8176.5-16665.2000112.2Q352 M353 S354Q352-L356 PolarHBondContact O-N 2.96Å; M353-L356 WeakPolarHBondContact O-CB 3.37Å; M353-L356 PolarHBondContact O-N 2.91Å; S354-L356 VanDerWaalsContact C-N 3.28Å; S354-L356 PolarHBondContact O-N 3.38Å
357E61.8Low65.5Low181 Ų181109.5 Ų109.585%0.84665%0.654SS**Hα-helixtrans-80.4-24.8173.5-164163.5-146.400112.5M353 G359M353-E357 PolarHBondContact O-N 3.32Å; E357-G359 PolarHBondContact O-N 2.95Å
358G58.8Low63Low58 Ų58115.1 Ų115.160%0.59868%0.676SS**SBendtrans-69.564.8166.400000113.1S354S354-G358 PolarHBondContact O-N 3.36Å
359G44.3Very low60.2Low58 Ų58114.7 Ų114.760%0.59869%0.685SS**  trans-55.6153.1-164.900000117E357 G361E357-G359 PolarHBondContact O-N 2.95Å; G359-G361 PolarHBondContact O-N 2.84Å
360T51.2Low57.3Low159 Ų159113.8 Ų113.898%0.97570%0.698SS**SBendtrans-59.9102.8-17752.50000113.3
361G47.2Very low54.7Low74 Ų74115.4 Ų115.476%0.76371%0.713SS**  trans169.770.8170.600000119.1G359G359-G361 PolarHBondContact O-N 2.84Å
362S40.1Very low51.7Low102 Ų102122 Ų12271%0.71374%0.736SS**  trans-177124.1133.9-172.90000111.9
363S43.6Very low48.8Very low127 Ų127121.6 Ų121.689%0.88875%0.745SS**  trans-124.171.7171.6-62.70000110.6
364T41.3Very low46.3Very low117 Ų117121.8 Ų121.872%0.71875%0.751SS**  trans-145.2131.6171.648.20000114.6
365I43.8Very low43.8Very low174 Ų174129.6 Ų129.689%0.89277%0.772SS**  trans74.8147.6151.6-129.4165.2000120
366S40Very low41.8Very low120 Ų120131.9 Ų131.984%0.83978%0.775SS**  trans-87.8141.2-168.3-49.10000113.6
367G30.9Very low40.2Very low70 Ų70133.5 Ų133.572%0.72278%0.783SS**  trans-134.848.2179.400000114.6S369G367-S369 PolarHBondContact O-N 2.96Å
368R42.3Very low38.7Very low257 Ų257128.3 Ų128.397%0.9778%0.778SS**  trans-79.980.5-177.5-169.5-176.9-171.6-102.85.9112.1
369S34.7Very low37.4Very low104 Ų104134.2 Ų134.273%0.72779%0.79SS**  trans-125.7107.9176.355.60000112.9G367G367-S369 PolarHBondContact O-N 2.96Å
370S35Very low36.9Very low110 Ų110136.7 Ų136.777%0.76980%0.798SS**  trans-71.2142.2162.9-174.80000109.8
371P39Very low35.9Very low119 Ų119134.3 Ų134.377%0.77379%0.788SS**  trans-68.9152.2160.831.3-33.7000110.5
372H30.8Very low35.2Very low184 Ų184136.3 Ų136.385%0.85279%0.79SS**  trans-157.3172.2172.4-174.872.7000108.5
373S29.9Very low34.8Very low99 Ų99135.3 Ų135.369%0.69280%0.796SS**  trans87.4132-176.3-162.50000113.8
374T32.3Very low34.1Very low88 Ų88133.2 Ų133.254%0.5479%0.794SS.*  cis-160141-7-99.20000110.6
375Y29.8Very low33.5Very low233 Ų233133.2 Ų133.291%0.91480%0.799SS**  trans-154.591.8143.2-87.6-64.8000111.8
376Y32.1Very low33Very low201 Ų201131.2 Ų131.279%0.78879%0.789SS**  trans45.9140.7149.6-92.3-84.6000125.4
377I35.6Very low32.4Very low169 Ų169133.2 Ų133.287%0.86779%0.785SS**  trans78.6128.3162.5-60.5167000116.2
378G29.5Very low32.2Very low71 Ų71134.7 Ų134.773%0.73278%0.784SS**  trans174-12.317700000120.9
379Q31.3Very low31.4Very low183 Ų183128.7 Ų128.786%0.85577%0.771SS**  trans50.2109.8168-68.5-174.4-11.300121
380S33.3Very low31.2Very low109 Ų109130.2 Ų130.276%0.76277%0.77SS**  90.3139.1129.3-56.20000123.7
381S31.3Very low30.9Very low109 Ų109133.8 Ų133.876%0.76278%0.775SS**  trans8793.7147.7-63.50000123
382S32Very low30.6Very low117 Ų117136.5 Ų136.582%0.81878%0.777SS**  81.7125.1116.1690000123.2
383G31.3Very low30.6Very low81 Ų81134.6 Ų134.684%0.83577%0.769SS**  trans79.4129.9154.700000116.5
384G29.8Very low30.6Very low82 Ų82140.3 Ų140.385%0.84578%0.775SS**  cis99.295.7-7.600000115.8
385S29.2Very low30.5Very low118 Ų118139.7 Ų139.783%0.82579%0.786SS**  trans-170.6121.6142.1-168.10000113.9
386I32.4Very low30.7Very low132 Ų132137.7 Ų137.768%0.67778%0.782SS**  trans-43.3159.4157.719.6168.9000117.8
387H27.5Very low30.4Very low162 Ų162135.9 Ų135.975%0.7578%0.781SS**  trans71.7156.3150.4-64.1-35.2000119.7
388S27.2Very low30.1Very low101 Ų101135.4 Ų135.471%0.70678%0.78SS**  cis-173.3163.2-23.158.20000113.6
389N25.9Very low30.1Very low131 Ų131138.8 Ų138.870%0.70178%0.777SS**  trans76.3155.9141.3-145.613.7000123.4
390L29.2Very low30.2Very low135 Ų135135.7 Ų135.771%0.70777%0.766SS**  trans65.2149.3160-99.617.5000118.3
391E30.1Very low30Very low186 Ų186137.1 Ų137.187%0.86976%0.758SS**  cis-129.8-173.310.8-110-163.4157.100115.3
392Q32.2Very low29.9Very low175 Ų175138.5 Ų138.582%0.81875%0.752SS**  trans-143.7142.1-164.5168.7-167.12.400111.1
393E30.4Very low29.6Very low145 Ų145139.8 Ų139.868%0.67875%0.745SS**  trans-142.9129.9156.8-112-142.6149.100115.2
394R29.4Very low29.5Very low219 Ų219142.2 Ų142.283%0.82674%0.735SS**  trans44.2138.5158-47.7-166.7-160-110-10.6121.2
395G31.1Very low29.6Very low75 Ų75141.6 Ų141.677%0.77373%0.729SS**  trans-166.3-34.8171.400000116.8
396K33.1Very low30Very low191 Ų191144.6 Ų144.683%0.8372%0.722SS**  trans70100.2-179.7-64.1-176176.8-176.70117.6
397E26Very low30Very low163 Ų163146.8 Ų146.876%0.76273%0.727SS**  54.2109.4103-173.4-174.7112.100119
398N29.7Very low30Very low158 Ų158142.9 Ų142.985%0.84572%0.718SS**  -151.9162.8110.8-124.8-49.5000113.1
399E29.4Very low29.9Very low142 Ų142147.4 Ų147.466%0.66473%0.725SS**  trans-93.3139.4-156.4-85.7-154.4-17.700117.8K401E399-K401 IonicContact OE1-NZ 3.35Å
400L33.5Very low30.3Very low119 Ų119149.5 Ų149.562%0.62374%0.735SS**  trans58.4174.7131.1-57.5178000118.6
401K30.1Very low30.3Very low139 Ų139151 Ų15160%0.60474%0.741SS**  cis-138.2141.69.7-125116.8-172.1158.90108.6E399E399-K401 IonicContact OE1-NZ 3.35Å
402Q28.5Very low30.4Very low138 Ų138149.4 Ų149.465%0.64573%0.731SS**  57.3143.798.3-72.6-174.3-63.800115.8
403E26.3Very low30.6Very low143 Ų143152.2 Ų152.267%0.66873%0.734SS**  cis-170.1175.8-9.7-176.6172.3144.900109.2
404E28.5Very low30.5Very low133 Ų133148.9 Ų148.962%0.62174%0.739SS**  trans79175150.4-123.3-161.8140.500118.4R406E404-R406 WeakPolarHBondContact OE1-CD 3.24Å; E404-R406 IonicContact OE1-CZ 3.26Å; E404-R406 IonicContact OE1-NE 2.73Å; E404-R406 PolarHBondContact OE1-NE 2.85Å; E404-R406 IonicContact OE1-NH1 3.15Å; E404-R406 PolarHBondContact OE1-NH1 3.23Å
405G32.4Very low30.8Very low69 Ų69145.6 Ų145.671%0.71174%0.738SS**  trans138.3-10.9170.700000118.1
406R37.5Very low31Very low181 Ų181148.4 Ų148.468%0.68374%0.739SS**  trans27.7125.6153.7-65.8170.8169163.2-5.5120.1E404E404-R406 WeakPolarHBondContact OE1-CD 3.24Å; E404-R406 IonicContact OE1-CZ 3.26Å; E404-R406 IonicContact OE1-NE 2.73Å; E404-R406 PolarHBondContact OE1-NE 2.85Å; E404-R406 IonicContact OE1-NH1 3.15Å; E404-R406 PolarHBondContact OE1-NH1 3.23Å
407K32.5Very low31.3Very low178 Ų178146 Ų14677%0.77473%0.734SS**  trans74.5107.2131.590.3-160.7167.71790121.9
408S26.3Very low31.6Very low80 Ų80145.2 Ų145.256%0.55974%0.736SS**  73.6133.3110.775.80000123.5
409F26.1Very low31.8Very low196 Ų196147.8 Ų147.886%0.8674%0.735SS**  trans63.4119.4156.4-42.3-62.6000119.2
410L33Very low32.2Very low175 Ų175146.1 Ų146.192%0.91674%0.739SS**  -163.2164.8103.5-157.156.3000112.2
411M29.6Very low32.2Very low167 Ų167146 Ų14682%0.82375%0.748SS**  trans-91.4163.8-178.9-164.6-163.2-161.600112.3
412K33.6Very low32.4Very low152 Ų152145.1 Ų145.166%0.66176%0.76SS**  trans96108.2136.6-164.4-179.7-177.9178.90121.2
413R34.8Very low32.6Very low233 Ų233141.6 Ų141.688%0.87976%0.761SS**  trans62.2152.3153.4-60.7177-172174.6-1.1116.3
414G29.9Very low32.8Very low76 Ų76142 Ų14278%0.78477%0.772SS**  cis144.2175.911.300000108.3
415D35.1Very low32.9Very low150 Ų150140.8 Ų140.880%0.80278%0.778SS**  cis-172.8128.2-5.7-173.66.6000108.2
416V34.1Very low32.9Very low134 Ų134143.5 Ų143.581%0.81278%0.782SS**  trans-153.9116168.3-177.30000110.7
417L40.3Very low33Very low139 Ų139141.5 Ų141.573%0.72878%0.784SS**  trans15.5144.2146.1-86.358.6000120.6
418D32Very low33.1Very low148 Ų148141.3 Ų141.379%0.79179%0.786SS**  cis-146.9161.233.8-110.2-44.8000117.6
419Y34.4Very low33.7Very low211 Ų211141.2 Ų141.283%0.82779%0.79SS**  trans-51.6128-169.4-161.9-102.7000121.5
420S37.4Very low34.2Very low108 Ų108137.2 Ų137.276%0.75579%0.787SS**  171146.3127.9-75.70000115.6
421S34.7Very low34.8Very low115 Ų115134.5 Ų134.580%0.80478%0.78SS**  trans-84.3167-178.2-48.60000113.7
422S33.4Very low35Very low122 Ų122134.6 Ų134.685%0.85378%0.783SS**  cis-172.9170.9-330.30000108
423G33.5Very low35.3Very low64 Ų64134 Ų13466%0.6679%0.787SS**  cis144.2152.6-0.100000112.3
424V30.6Very low35.9Very low151 Ų151129 Ų12992%0.91578%0.784SS**  trans75.5145.2-176.3107.30000114.4
425S30.3Very low36.3Very low107 Ų107133.2 Ų133.275%0.74879%0.787SS**  cis-136.6-169.316.3-156.60000114.7
426T32.3Very low36.4Very low127 Ų127131.9 Ų131.978%0.77979%0.785SS**  trans-117.2166.1-161.656.20000116.4
427N38.6Very low37.3Very low138 Ų138133.5 Ų133.574%0.73878%0.783SS**  trans-52.8151167.6-55.3-1.1000114.1
428E36.3Very low37.8Very low175 Ų175136 Ų13682%0.81879%0.791SS**  -176.5173.9105.9-96.9-54.2146.200111.9
429A38.3Very low38.5Very low77 Ų77135.2 Ų135.264%0.63679%0.787SS**  trans-107.8149.6-147.900000120.1
430S35.6Very low39.2Very low113 Ų113133.8 Ų133.879%0.7979%0.788SS**  trans70.5176148.1-480000117.8
431P46.7Very low39.2Very low118 Ų118136.4 Ų136.477%0.76679%0.786SS**  -124.7156.7-96.833.1-14.1000114.2
432L33.8Very low39.3Very low169 Ų169136 Ų13689%0.88578%0.783SS**  trans-135.8156.1174.1-72175.9000111.8
433D39.3Very low39.3Very low140 Ų140136.3 Ų136.375%0.74978%0.775SS**  trans-68153.2-167-58.5-76.1000114.5I435D433-I435 PolarHBondContact O-N 3.14Å
434P47.2Very low39.4Very low127 Ų127141 Ų14183%0.82578%0.779SS**  trans-68.1102.3172.929-34.2000110.4
435I39.4Very low39.5Very low164 Ų164139.7 Ų139.784%0.84178%0.777SS**  trans-59.4136.2168.149.1174.8000110.7D433D433-I435 PolarHBondContact O-N 3.14Å
436T37.4Very low39.5Very low123 Ų123138.3 Ų138.376%0.75578%0.78SS**  trans-67.7168.1169.647.60000111.3
437E51.5Low39.4Very low168 Ų168136.6 Ų136.679%0.78577%0.773SS**  trans-65-177.7174.560.2-116.891.700114.6
438E51.2Low39.3Very low190 Ų190138.6 Ų138.689%0.88878%0.775SS**  trans82.699.9-178.7-50.8-165.9126.100117.1
439D45.8Very low39.2Very low132 Ų132137.1 Ų137.171%0.70677%0.772SS**  174.2139.3109.9-170.415.5000111.3K441D439-K441 IonicContact OD1-NZ 2.67Å; D439-K441 PolarHBondContact OD1-NZ 3.2Å; D439-K441 WeakPolarHBondContact OD2-CE 3.44Å; D439-K441 IonicContact OD2-NZ 2.64Å; D439-K441 PolarHBondContact OD2-NZ 2.87Å
440E50.3Low38.8Very low182 Ų182140.7 Ų140.785%0.8578%0.78SS**  trans-110.1119-177.6-177.2-168.9119.900111
441K37.4Very low39.2Very low162 Ų162141.2 Ų141.270%0.70478%0.78SS**  trans-173.8163.9158.138.3-161.3155.3-83.60114.4D439D439-K441 IonicContact OD1-NZ 2.67Å; D439-K441 PolarHBondContact OD1-NZ 3.2Å; D439-K441 WeakPolarHBondContact OD2-CE 3.44Å; D439-K441 IonicContact OD2-NZ 2.64Å; D439-K441 PolarHBondContact OD2-NZ 2.87Å
442S35.6Very low38.3Very low106 Ų106138.9 Ų138.974%0.74178%0.778SS**  trans-101.1172.5-156.5-48.60000116.6
443D34.5Very low38.2Very low129 Ų129140.5 Ų140.569%0.6978%0.778SS**  trans85.4116.6145.8-76.3-63.2000122.5
444Q35.1Very low37.8Very low162 Ų162142.8 Ų142.876%0.75778%0.781SS**  trans67.9109.1131.9-66175.555.800122.1
445S32.1Very low36.8Very low125 Ų125141.5 Ų141.587%0.87478%0.775SS**  44.6108119.8-57.80000120.1
446G31.6Very low36.2Very low78 Ų78139.1 Ų139.180%0.80477%0.773SS**  trans-161.532.5-17800000121.9
447S29.9Very low35.8Very low90 Ų90141 Ų14163%0.62977%0.773SS**  trans25.5117.5147.2154.40000120.9
448K36.1Very low35Very low180 Ų180143.6 Ų143.678%0.78378%0.776SS**  trans91.2123.9144.2-65.7163-163.1156.90121.9
449L33.9Very low34.7Very low144 Ų144139.8 Ų139.875%0.75477%0.768SS**  trans65110.8131.5-58.9171.3000120.7
450L30.3Very low33.9Very low152 Ų152138.4 Ų138.480%0.79677%0.768SS**  33.7153116.9-59.2-177.4000121
451P44Very low33.3Very low124 Ų124136.4 Ų136.481%0.80576%0.763SS**  cis-139.1-179.2-27.139.5-22.9000113.5
452G27.6Very low33.2Very low70 Ų70136.9 Ų136.972%0.72277%0.765SS**  trans143.1104.714400000119.7
453K31.3Very low33Very low202 Ų202139.4 Ų139.488%0.87877%0.765SS**  trans16141136.3-66.2173.7173.1175.30120.7
454K31.1Very low32.8Very low188 Ų188139.7 Ų139.782%0.81777%0.772SS**  trans81.3120.9139.369.7152.9-176.5172.30121.6
455S25.9Very low32.7Very low100 Ų100138.4 Ų138.470%0.69977%0.77SS**  69.3126.1127.868.50000122.4
456S27.9Very low32.7Very low114 Ų114138.4 Ų138.480%0.79776%0.76SS**  trans88.6145.9133.6-157.70000119.7
457E28.4Very low32.8Very low163 Ų163142.3 Ų142.376%0.76276%0.755SS**  trans-69.6170.9-175.2-45.1166.2103.100115
458R35.4Very low33.3Very low222 Ų222145.1 Ų145.184%0.83876%0.762SS**  trans75.6163.9150.2-83.2-177.3170.4-173.6-1.8118.7
459P44.4Very low33.1Very low110 Ų110146 Ų14671%0.71477%0.766SS**  cis-143.4174.7-27.637.6-20000116.6
460S29.6Very low33.1Very low103 Ų103142.5 Ų142.572%0.7277%0.765SS**  trans66.4123.5135.4172.30000122.3
461L36.1Very low33Very low141 Ų141141 Ų14174%0.73877%0.767SS**  trans-156.5116.8134.4-143.973.9000113.7
462F35.3Very low32.4Very low172 Ų172138 Ų13875%0.75476%0.758SS**  trans51.7168.7166.9-55.4-53.5000120.5
463Q32.5Very low32.7Very low158 Ų158141 Ų14174%0.73876%0.757SS**  173.9124.2-56.9169.1172.753.600109.1
464T30.7Very low32.8Very low135 Ų135140 Ų14083%0.82875%0.748SS**  trans135142.1158.647.70000112.1
465D32.2Very low32.7Very low136 Ų136140.9 Ų140.973%0.72775%0.748SS**  cis-160.6169.2-28.5-157.9-3.7000110
466L32.7Very low32.8Very low125 Ų125143.9 Ų143.965%0.65475%0.75SS**  trans65.2136.9168.7-8754.4000118.9
467K33.3Very low32.8Very low159 Ų159146.6 Ų146.669%0.69175%0.748SS**  cis-166.8122.1-23.2-155.2145.357.4-169.90113.1
468L41.5Very low33.3Very low150 Ų150146.3 Ų146.379%0.78575%0.751SS**  trans60.1156.4149.6-100.271000119.1
469K31.9Very low33.8Very low197 Ų197141.1 Ų141.186%0.85775%0.746SS**  cis-158.7150.4-3-162.1-177.7-167.8-179.60108.5
470G32.1Very low33Very low71 Ų71140.8 Ų140.873%0.73275%0.746SS**  trans154.7111.9160.900000115
471S28.7Very low33.4Very low120 Ų120142.8 Ų142.884%0.83975%0.749SS**  trans-64.8130.7173.1-172.40000111.2
472G31.5Very low33.5Very low61 Ų61144.4 Ų144.463%0.62975%0.752SS**  trans-77.1166.6159.800000111.4
473L35.2Very low33.9Very low134 Ų134144.3 Ų144.370%0.70276%0.76SS**  trans-168.3123.3162.1-99.1-169.5000112.3
474R33Very low34.6Very low182 Ų182145.2 Ų145.269%0.68776%0.764SS**  trans53131.113885.9-144.5-70.4152.1-10.7122.6
475Y28.6Very low34.9Very low206 Ų206144.4 Ų144.481%0.80876%0.764SS**  trans65.5137.5145.6-70.8-60.1000122.8
476Q28.2Very low35.1Very low162 Ų162141.3 Ų141.376%0.75776%0.764SS**  trans68.3111.2143-65.6-865.500120.1
477K28.1Very low35.1Very low172 Ų172142 Ų14275%0.74877%0.774SS**  77.7105.5122-161172.5-175.3178.30120
478L38.1Very low35.3Very low156 Ų156142 Ų14282%0.81778%0.776SS**  30.5148.1125.9-54.5175.7000120.6
479P46.3Very low35.1Very low113 Ų113143 Ų14373%0.73478%0.777SS**  cis-135.7-151.8-12.241.5-21.1000112.8
480S27.9Very low35.4Very low104 Ų104138.9 Ų138.973%0.72777%0.773SS**  trans74.2142.4174.7-64.20000115.5
481D38.4Very low35.5Very low144 Ų144141.9 Ų141.977%0.7777%0.772SS**  cis70.7134.842-142.225.3000109.6
482E38.2Very low35.6Very low175 Ų175142.7 Ų142.782%0.81877%0.767SS**  cis-134.2-176.821.4-62.2146.7130.300112.1
483D42.6Very low36Very low171 Ų171146.1 Ų146.191%0.91478%0.776SS**  trans-132.8149165.1-151.2-19.6000109.9
484E47.7Very low36.3Very low176 Ų176144.8 Ų144.882%0.82278%0.775SS**  trans-111.1134.7-142.5-175-179.1104.100116.1
485S36.2Very low36.5Very low118 Ų118143.5 Ų143.583%0.82578%0.781SS**  trans174.3106131.538.10000117.5
486G36.3Very low36.7Very low71 Ų71141.1 Ų141.173%0.73278%0.782SS**  trans58114.8133.900000124.1
487T33.5Very low37Very low139 Ų139141.1 Ų141.185%0.85378%0.779SS**  -161.1173.7100.224.90000110.7
488E37.8Very low37.2Very low160 Ų160138.8 Ų138.875%0.74878%0.775SS**  trans-93.9172.2-152.560.9-103.266.300120
489E36.2Very low37.1Very low171 Ų171138 Ų13880%0.79977%0.771SS**  trans95.394.8138.7-164.8155.493.900123.1
490S38.7Very low36.3Very low110 Ų110140.4 Ų140.477%0.76977%0.77SS**  trans71155.1136.978.40000121.7
491D35.1Very low36.6Very low134 Ų134139.6 Ų139.672%0.71776%0.758SS**  cis174.5165.7-20.6-176.419.6000106.4
492N29.6Very low36.4Very low138 Ų138141 Ų14174%0.73876%0.757SS**  trans76.8132166.4-65.5-71.5000122.2
493T40.1Very low36Very low132 Ų132142.4 Ų142.481%0.8176%0.76SS**  trans-99.2-177.4171.41.90000109.5
494P43Very low35.5Very low106 Ų106139.2 Ų139.269%0.68876%0.758SS**  cis-155.7168.641.144.1-21.1000121.3
495L36.6Very low34.5Very low155 Ų155140.1 Ų140.181%0.81276%0.762SS**  trans30.8139.8138.9-62.5164.7000122.2
496L32.4Very low34.2Very low156 Ų156137.4 Ų137.482%0.81775%0.753SS**  -171.5118.2114.3-100.3168.9000115.6
497K35Very low34Very low163 Ų163144.1 Ų144.171%0.70976%0.762SS**  trans62.9106.4132.6-107.3159176.81670125
498D31.8Very low33.9Very low122 Ų122142.4 Ų142.465%0.65276%0.761SS**  57132.1109.6-44.7-11.2000124
499D34.9Very low33.4Very low139 Ų139142.8 Ų142.874%0.74376%0.763SS**  trans68.2109.4132.4-82.6-61.2000124.5
500K31.1Very low33.3Very low164 Ų164145.5 Ų145.571%0.71377%0.766SS**  90160.9102.7-162-176.4166.3-112.70122.3
501D33.2Very low32.8Very low87 Ų87147 Ų14747%0.46577%0.77SS.*  trans80.499158.6-84.8-40.7000121.9
502K34.1Very low32.5Very low174 Ų174144.3 Ų144.376%0.75777%0.767SS**  48.8136.4125-61.2-174.2-169.787.60122.6
503K30.3Very low32.4Very low204 Ų204147.3 Ų147.389%0.88777%0.774SS**  trans45.7126.5141.7-76.1-165.3172.3-167.30119.3
504A32.7Very low31.7Very low105 Ų105146.5 Ų146.587%0.86877%0.773SS**  -163.8159.2103.700000112.9
505E26Very low31.5Very low195 Ų195146.3 Ų146.391%0.91177%0.772SS**  trans-98.9150.9169.6177.8-162.8162.500109.2
506G30.7Very low30.9Very low60 Ų60146.5 Ų146.562%0.61977%0.769SS**  trans130111.9146.200000118.7
507K32.1Very low30.8Very low213 Ų213147.1 Ų147.193%0.92677%0.767SS**  trans43.7118.8141.3-56.6179.8-178.8-179.80119.6
508A31Very low30.4Very low102 Ų102143.6 Ų143.684%0.84376%0.763SS**  -164.5127.6109.600000114.2
509E27.2Very low30.3Very low169 Ų169143.5 Ų143.579%0.7977%0.767SS**  trans-31.7128.5153.7-176.2-154.4134.600116.9
510R34.2Very low30.1Very low227 Ų227145.3 Ų145.386%0.85777%0.77SS**  -168.9155.4113.8-110.5175.8-75.7-170.9-3.7116.9
511V28.5Very low30.8Very low141 Ų141141.9 Ų141.986%0.85577%0.765SS**  trans-84.2136.2176.1170.50000110.9
512A29.1Very low30.8Very low79 Ų79144.2 Ų144.265%0.65378%0.776SS**  trans172.8128.9130.800000115.7
513K27.1Very low30.9Very low201 Ų201146.6 Ų146.687%0.87478%0.78SS**  trans57119.8131.5-59.8178.8179.4179.50122.2
514S23.9Very low31.1Very low114 Ų114141.5 Ų141.580%0.79777%0.766SS**  trans-49.5168.1143.6-1420000112.6
515P39.7Very low31.2Very low102 Ų102145 Ų14566%0.66276%0.762SS**  cis-127.9-150.918.631.4-4.5000112.5
516E24Very low32Very low159 Ų159142.6 Ų142.674%0.74375%0.754SS**  cis-172.7152.522.6-156.3153-143.300113
517H29.9Very low32.3Very low169 Ų169149 Ų14978%0.78277%0.765SS**  trans63.2157.1158.6-106.8-107.5000118.9
518S26.6Very low32.5Very low90 Ų90143.5 Ų143.563%0.62976%0.759SS**  cis-149.9152.2-5.3-28.90000112.3
519V30.4Very low32.7Very low120 Ų120146 Ų14673%0.72775%0.751SS**  trans30.5116.3132.2-169.80000120.5
520E31.1Very low33.2Very low176 Ų176143.4 Ų143.482%0.82274%0.739SS**  28.1171.8111.9-101.4-179.3-148.900122.1
521P46.2Very low33.3Very low92 Ų92141.6 Ų141.660%0.59773%0.733SS**  cis-142.2-161.3-6.927.20.2000115.9
522I31.9Very low33.8Very low136 Ų136141.9 Ų141.970%0.69773%0.729SS**  trans76124.1153.6-21.5178.5000121.6
523R36.7Very low34.1Very low225 Ų225142.6 Ų142.685%0.84973%0.729SS**  145.6104.3129-78.8173.4-171.5-179.64111.7
524T34Very low34.7Very low96 Ų96140.4 Ų140.459%0.58973%0.727SS**  65.3113.675.164.50000116.3
525F36Very low35.3Very low179 Ų179138.3 Ų138.379%0.78572%0.717SS**  142136.3124.7-75.8-55.7000118.7
526I41.4Very low35.5Very low144 Ų144140.6 Ų140.674%0.73872%0.722SS**  trans66.895.6136.4-60.3165.9000121.1
527K36.8Very low36.7Very low196 Ų196140.4 Ų140.485%0.85273%0.726SS**  31.1107.7111.6-176.2-164.6176.1-177.50120.7
528A36.2Very low37.2Very low96 Ų96137.6 Ų137.679%0.79372%0.716SS**  trans-168.8141.9134.700000107.7
529K35.7Very low37.9Very low156 Ų156141 Ų14168%0.67872%0.72SS**  cis100.9119.225.4-173.3177.8-173.8-920112.3
530E38.3Very low39.1Very low114 Ų114143.8 Ų143.853%0.53372%0.722SS.*  trans70.6154.9164.8-77.7156-174.800118.1
531Y36.5Very low39.4Very low189 Ų189141.3 Ų141.374%0.74172%0.715SS**  cis-145.3179.63.2-118-47.1000112.8
532L39Very low39.2Very low147 Ų147142.3 Ų142.377%0.7772%0.724SS**  trans-45.1166.2169.2-64.8158.4000114.8
533S35.9Very low39.9Very low93 Ų93141.2 Ų141.265%0.6573%0.728SS**  cis-160.6143.42.9-1170000107.5
534D38.2Very low40.1Very low156 Ų156137.4 Ų137.483%0.83473%0.725SS**  8015679-161.619.4000115.2
535A37.8Very low40.6Very low70 Ų70138 Ų13858%0.57973%0.733SS**  trans87.5107.8163.100000121.6
536L43.4Very low40.9Very low149 Ų149133 Ų13378%0.7873%0.732SS**  trans87.1115.9132.6-58.8163.7000122.9
537L48.7Very low41.3Very low155 Ų155133.4 Ų133.481%0.81274%0.741SS**  68.7147.5125.1-62.4-176000120.6
538D41.4Very low41.8Very low110 Ų110135.6 Ų135.659%0.58874%0.744SS**  cis-168.7170-6.1168.540.9000110.6
539K40.4Very low42.1Very low162 Ų162136.1 Ų136.170%0.70474%0.742SS**  trans73.3117.2162.5-87.6167.6-171.1790121.2
540K54.6Low42.2Very low178 Ų178136.3 Ų136.377%0.77475%0.75SS**  80.4144.5123.4-157.1152.2-179.5169.20116.4
541D37.7Very low42.1Very low125 Ų125139.9 Ų139.967%0.66877%0.767SS**  cis-143.2-177.311.1-144.4-30.2000112.1
542S42.5Very low42.1Very low112 Ų112135.8 Ų135.878%0.78377%0.766SS**  trans112.697.3160-44.80000118
543S47.8Very low42.5Very low113 Ų113134.6 Ų134.679%0.7977%0.769SS**  trans-71.2-173.8148.7-42.90000110.2
544D40.8Very low42.8Very low145 Ų145136 Ų13678%0.77578%0.777SS**  cis-162.1172.311.6-179.335.8000110.6
545S42.9Very low42.6Very low108 Ų108136.2 Ų136.276%0.75578%0.778SS**  trans90145.7147.582.40000119.4
546G42.7Very low42.4Very low75 Ų75142.1 Ų142.177%0.77379%0.793SS**  trans161.6-18.2162.700000120.3R548G546-R548 PolarHBondContact O-N 3.33Å
547V49.4Very low41.9Very low152 Ų152140.2 Ų140.292%0.92179%0.792SS**  trans-72.9114.8-174-71.70000113.4
548R47.2Very low41.2Very low243 Ų243140.4 Ų140.492%0.91779%0.793SS**  trans-147.7146.6161.9-87.9-163.8157.591.93.7110.6G546G546-R548 PolarHBondContact O-N 3.33Å
549S44.1Very low40.7Very low107 Ų107143.2 Ų143.275%0.74880%0.802SS**  trans-129.5154178.3-49.30000110.6
550N37.2Very low40.4Very low159 Ų159141.8 Ų141.885%0.8580%0.802SS**  trans75.6112.6165.6-50.4-0.2000117.3
551E36.2Very low39.6Very low190 Ų190141.9 Ų141.989%0.88881%0.806SS**  trans-124.3144.7151.1-177.969.5-102.100105.7
552S37.1Very low39.3Very low103 Ų103140.7 Ų140.772%0.7281%0.813SS**  trans-111.8156.7-170-73.90000113.6
553S46.1Very low39Very low121 Ų121140.3 Ų140.385%0.84682%0.817SS**  trans-61.4155.5-178.3-41.80000114.7
554P42.2Very low38.3Very low124 Ų124142 Ų14281%0.80582%0.817SS**  trans-133.2159.6130.337.1-27.8000114.2
555N34.7Very low37.8Very low160 Ų160142.7 Ų142.786%0.85682%0.821SS**  trans-75143.9179.6-65-71.5000113
556H33Very low37.5Very low194 Ų194142.6 Ų142.690%0.89882%0.82SS**  trans-160100.1149.2-138.3-81.9000114.5
557S32.9Very low37.1Very low108 Ų108148 Ų14876%0.75583%0.825SS**  -172.2143.6121-160.30000111.3
558L34.7Very low36.4Very low160 Ų160148.4 Ų148.484%0.83882%0.821SS**  trans-97-175.6164.2-79.4166.2000109.8
559H31Very low35.5Very low169 Ų169143.3 Ų143.378%0.78281%0.808SS**  trans79126.3173.9-136.254.9000112.9
560N33.3Very low35.1Very low132 Ų132145.8 Ų145.871%0.70681%0.805SS**  cis-146.416314.2-14910.1000112.1
561E37.7Very low34.9Very low180 Ų180142.5 Ų142.584%0.84180%0.8SS**  trans-114.4159.7175.6-81.7-157.798.800113.4
562A32Very low34.7Very low100 Ų100140.5 Ų140.583%0.82680%0.796SS**  trans53.293.8150.400000120.6
563A36.1Very low34.5Very low104 Ų104142.5 Ų142.586%0.8680%0.798SS**  trans-170.4141142.300000108.6
564D32.5Very low34.1Very low149 Ų149143 Ų14380%0.79779%0.789SS**  cis-156.8141.1-13.8-178.118.2000107.5
565D30.3Very low33.6Very low159 Ų159145 Ų14585%0.8579%0.788SS**  trans177.6104158.1-115.7-30.8000110.1
566S36.6Very low33.7Very low106 Ų106143.9 Ų143.974%0.74178%0.781SS**  trans-155.992.9172-82.40000114.2
567Q34.5Very low33.6Very low187 Ų187142.9 Ų142.987%0.87478%0.777SS**  trans39.987.9138.7-165.4-161.9-82.100118.6
568L34.1Very low33.8Very low161 Ų161144.5 Ų144.584%0.84378%0.777SS**  trans-147157.6161.6-69.4177.9000108.8
569E29.7Very low33.5Very low137 Ų137144.6 Ų144.664%0.6477%0.773SS**  cis-165.3165.3-34.8-150.3-154.4170.200107.1
570K35.4Very low33.6Very low158 Ų158139.6 Ų139.669%0.68777%0.767SS**  trans44.6107.7159.9-69.8179.3179.5860120.8
571A32.8Very low33.7Very low91 Ų91141.9 Ų141.975%0.75277%0.774SS**  35.5134.6116.800000122.4
572N31.2Very low33.3Very low148 Ų148139.6 Ų139.679%0.79178%0.777SS**  trans-170.9135.4135.1-99.2-48.6000112.7
573L32.8Very low33.4Very low145 Ų145138.6 Ų138.676%0.75978%0.776SS**  trans58.9149.2157.2-75.640.3000117.7
574I39.1Very low33.6Very low130 Ų130142.7 Ų142.767%0.66778%0.775SS**  cis-155.5126.2-7.4-106.1158000103.6
575E30.2Very low33.7Very low166 Ų166147.6 Ų147.678%0.77678%0.782SS**  70.6150.880.3-160.9169.6-128.600115
576L38.4Very low33.7Very low137 Ų137143.9 Ų143.972%0.71778%0.781SS**  trans78.4113.2-168.6-48177.9000114.2
577E29.4Very low33.7Very low174 Ų174147 Ų14781%0.81379%0.787SS**  74.6138.257.4-61.9177.7166.800112
578D36.9Very low34.5Very low141 Ų141143.6 Ų143.675%0.75478%0.781SS**  cis-158.9170.817.9-170.121.4000112.4
579E29.6Very low34.4Very low163 Ų163143.6 Ų143.676%0.76278%0.776SS**  trans45.7163.2149.3-97.1-83.762.500124.2
580G31.9Very low34.5Very low64 Ų64141.2 Ų141.266%0.6678%0.775SS**  trans125.570.4151.500000118.4
581H35.8Very low34.5Very low180 Ų180141.4 Ų141.483%0.83378%0.782SS**  trans-81.8159.4163.9-83.273.7000113
582S30.3Very low34.3Very low132 Ų132143.1 Ų143.192%0.92379%0.789SS**  trans88.1157.4163.487.30000119.2
583G33.8Very low34.3Very low78 Ų78139.8 Ų139.880%0.80479%0.789SS**  trans138.2115.817500000114
584K41.1Very low34.3Very low191 Ų191139.8 Ų139.883%0.8379%0.789SS**  trans-123.7141.6172.5-75.3-171.6178.5-177.90111.4
585R34.4Very low34Very low251 Ų251142.9 Ų142.995%0.94780%0.801SS**  trans76.6142.1168.2-56.4173-73.5-162.1-1.5116.4
586G29.2Very low34.3Very low81 Ų81141.1 Ų141.184%0.83580%0.796SS**  trans143.491.715700000115.6
587M38.1Very low35.1Very low173 Ų173139.7 Ų139.785%0.85280%0.796SS**  trans-106.6146155.8-69155.662.400107.3
588P50.7Low35.4Very low115 Ų115136.9 Ų136.975%0.74779%0.79SS**  -148.7158.9103.838.2-22.3000116.6
589H30.7Very low35.6Very low160 Ų160136.4 Ų136.474%0.74179%0.786SS**  trans4.3147.8133.6-54.9-61.3000119.6
590S33.1Very low36.1Very low88 Ų88132.3 Ų132.362%0.61578%0.78SS**  cis-169.4157.26.6-114.50000114.6
591L34.9Very low36.6Very low162 Ų162138.8 Ų138.885%0.84879%0.785SS**  trans47.9127.2142.4-58.1169.5000121.9
592S29.7Very low36.3Very low127 Ų127138.7 Ų138.789%0.88879%0.786SS**  163.7152.995.7-165.20000113.2
593G30.2Very low36.9Very low77 Ų77137.8 Ų137.879%0.79478%0.78SS**  trans162.399.3174.900000112
594L33.5Very low37Very low145 Ų145141.8 Ų141.876%0.75978%0.782SS**  trans-149.7118.7-162.7-165.9178.4000111.7
595Q32.2Very low36.9Very low196 Ų196137.9 Ų137.992%0.91678%0.777SS**  trans-161144.5159.1-120.5130.2108.700112.1
596D36.8Very low37.1Very low128 Ų128130.8 Ų130.868%0.68477%0.766SS**  trans-137.1148.9176.8173.546.9000107.3V598D596-V598 PolarHBondContact OD1-N 3.45Å
597P55.8Low37.5Very low108 Ų108135.4 Ų135.470%0.70177%0.766SS**  -151137.7109.735.4-16.8000117.3
598V35.2Very low37.5Very low114 Ų114132.8 Ų132.869%0.69176%0.755SS**  45.9113.4122-170.10000116.4D596D596-V598 PolarHBondContact OD1-N 3.45Å
599I41.3Very low36.7Very low131 Ų131135.2 Ų135.267%0.67275%0.754SS**  -165.7135.971.1-66.9169.6000105.8R601I599-R601 VanDerWaalsContact CG2-NH2 3.3Å
600A38.7Very low36.9Very low77 Ų77137 Ų13764%0.63676%0.76SS**  -169.5141.565.400000115.3
601R42.8Very low37.3Very low201 Ų201137.7 Ų137.776%0.75877%0.765SS**  trans-6.4140.3146.867.8-145.885-165.74.3117.9I599I599-R601 VanDerWaalsContact CG2-NH2 3.3Å
602M28.9Very low37.4Very low177 Ų177135 Ų13587%0.87276%0.757SS**  cis-138.7151.434.5-70.9162.448.300114.5
603S43.2Very low37.7Very low113 Ų113133.6 Ų133.679%0.7975%0.747SS**  trans-154.6145169.4-48.30000110.7
604I37.6Very low37.7Very low163 Ų163136 Ų13684%0.83674%0.738SS**  trans-151125.3146.244176.1000106.3
605C37.6Very low37.5Very low108 Ų108133.9 Ų133.973%0.7373%0.733SS**  cis79.9130.648.1-650000112.6
606S39.6Very low37.5Very low102 Ų102127.5 Ų127.571%0.71371%0.711SS**  cis-154.5159.3-12.1-65.70000107.7
607E36.7Very low37.6Very low178 Ų178129.1 Ų129.183%0.83272%0.718SS**  24.4118.985.7-163.1152.545.900116.5
608D38.4Very low36.5Very low118 Ų118132.1 Ų132.163%0.63173%0.727SS**  157.8153.9102.2-1472.1000114.9
609K34.1Very low36.3Very low167 Ų167131.1 Ų131.173%0.72673%0.731SS**  trans27.8131.2168-33.1-158.3-177.1-136.10123.5
610K34.6Very low35.8Very low197 Ų197130.1 Ų130.186%0.85774%0.735SS**  125.3112.2107-154.4160.9-177.4-176.30115.6
611S41.7Very low35.6Very low103 Ų103130.9 Ų130.972%0.7274%0.736SS**  trans-69.1155.6160.3-29.60000111.3
612P37.4Very low36.2Very low106 Ų106127 Ų12769%0.68874%0.737SS**  -110.3177.3110.832.6-35.2000112.6
613S36.1Very low36.5Very low97 Ų97126.5 Ų126.568%0.67873%0.732SS**  trans-92.2-144.7-178.339.50000111.1
614E30.5Very low36.2Very low128 Ų128129.6 Ų129.660%0.59873%0.734SS**  trans82.4146.1169.5-40.5151.2-127.300114.3L729E614-L729 HydrophobicContact CB-CB 3.97Å; E614-L729 HydrophobicContact CB-CD2 4.23Å; E614-L729 HydrophobicContact CG-CB 3.85Å; E614-L729 HydrophobicContact CG-CD2 3.8Å; E614-L729 HydrophobicContact CG-CG 4.45Å; E614-L729 PolarHBondContact N-O 2.64Å
615C28.9Very low35.8Very low99 Ų99125.7 Ų125.767%0.66972%0.722SS**  cis-149.9172.70.2-162.80000111.6L729C615-L729 WeakPolarHBondContact CA-OXT 3.18Å
616S31.1Very low35.3Very low63 Ų63131.7 Ų131.744%0.44173%0.729SS.*  trans-105.4147.9-169.2-71.90000117.8I728 L729S616-I728 WeakPolarHBondContact OG-CG2 3.36Å; S616-L729 PolarHBondContact OG-OXT 2.67Å
617L39.2Very low35.4Very low162 Ų162132.7 Ų132.785%0.84873%0.733SS**  trans28.4137.8140.5-55.4173.8000123.5
618I32.4Very low35.2Very low170 Ų170129.3 Ų129.387%0.87273%0.729SS**  trans-163.7143.7131.933.9168000113.7
619A32.2Very low34.6Very low94 Ų94129.2 Ų129.278%0.77774%0.736SS**  trans55144.1150.800000121.7
620S29.6Very low34.3Very low110 Ų110130 Ų13077%0.76974%0.743SS**  cis-161.6147.2-16.6-75.90000107.4
621S35.8Very low34Very low92 Ų92129.7 Ų129.764%0.64374%0.741SS**  47.7139.573.4-113.60000115.5
622P55.1Low33.5Very low120 Ų120128.9 Ų128.978%0.77974%0.741SS**  cis-119.1176.838.419.34000114.2
623E34.7Very low33.2Very low167 Ų167133.7 Ų133.778%0.7875%0.747SS**  cis117.51369.7-78-172.2110.700116.8
624E37.3Very low33Very low177 Ų177136 Ų13683%0.82775%0.752SS**  trans90.6107.5147.3-156.4154.4-160.900125
625S28.6Very low33.2Very low82 Ų82136.9 Ų136.957%0.57376%0.76SS**  trans52.8121.4136.3-68.60000128.4
626W27.6Very low33.4Very low234 Ų234138.8 Ų138.889%0.88676%0.763SS**  62173.6129.9-64.1123.7000119.6
627P42.2Very low33.4Very low122 Ų122145.9 Ų145.979%0.79278%0.78SS**  cis-124.4-151.4-0.744.3-27.8000114.4
628S30.9Very low33Very low107 Ų107143.4 Ų143.475%0.74877%0.772SS**  trans-123.7-180-163.7620000115.3
629C26.1Very low33.3Very low117 Ų117141 Ų14179%0.79177%0.768SS**  trans102.6167147.8-149.30000119.4
630Q29.2Very low33.2Very low183 Ų183141.2 Ų141.286%0.85576%0.763SS**  trans84.8149.7171.7-50.7-172.612.600118.7
631K27.9Very low33.3Very low190 Ų190141.7 Ų141.783%0.82676%0.762SS**  171.9124.2-58.2167.8178.6176.4-179.40110
632A30.3Very low33.3Very low86 Ų86142.9 Ų142.971%0.71177%0.765SS**  trans61.316817700000114
633Y31.4Very low32.2Very low207 Ų207140.5 Ų140.581%0.81275%0.748SS**  cis-146.3140.56.632.5-92.1000106.6
634N32.5Very low32Very low147 Ų147134.1 Ų134.179%0.78672%0.719SS**  cis82.5143.848.1-148.2-19.7000113.9
635L34.3Very low31.8Very low146 Ų146129.3 Ų129.376%0.76470%0.699SS**  trans77.6130.7-169.6-52.6171.5000114.6
636N32.8Very low32.1Very low138 Ų138130.4 Ų130.474%0.73870%0.698SS**  cis-141.7128.213.7-73.7-72.6000115.4
637R31.9Very low32.6Very low212 Ų212124.7 Ų124.780%0.869%0.685SS**  33.2112.5129.6-85.8-177.4-179.9-83.60.1121.4
638T31Very low32Very low111 Ų111124.4 Ų124.468%0.68168%0.681SS**  77.9146.19257.10000116.1
639P37.2Very low31.8Very low120 Ų120122.7 Ų122.778%0.77967%0.673SS**  cis-101.3155.231.13.519.5000114.8
640S30.5Very low32.1Very low97 Ų97123.6 Ų123.668%0.67868%0.678SS**  69.3133.968.7-148.10000112.9
641T32.3Very low32.2Very low121 Ų121120.6 Ų120.674%0.74267%0.672SS**  cis-122.6140.817.952.50000111.6
642V35Very low32.3Very low117 Ų117118.3 Ų118.371%0.70967%0.669SS**  45.476.374.4-170.60000112.9
643T31.5Very low32.2Very low69 Ų69123.8 Ų123.842%0.42367%0.672SS.*  30.9129.7121.350.80000122.6E290E290-T643 WeakPolarHBondContact OE1-CB 3.49Å; E290-T643 PolarHBondContact OE1-OG1 2.97Å; E290-T643 VanDerWaalsContact OE2-CB 3.29Å; E290-T643 WeakPolarHBondContact OE2-CB 3.48Å; E290-T643 PolarHBondContact OE2-OG1 2.77Å; E290-T643 VanDerWaalsContact OE2-OG1 3.09Å
644L32.2Very low32Very low34 Ų34117.7 Ų117.718%0.17866%0.664CS.*  59.792.9119-43.5159.2000121.1F289 E290 N293F289-L644 HydrophobicContact CD1-CB 3.84Å; F289-L644 HydrophobicContact CD1-CD2 3.19Å; F289-L644 HydrophobicContact CD1-CG 4.07Å; F289-L644 HydrophobicContact CE1-CB 4.5Å; F289-L644 HydrophobicContact CE1-CD2 3.26Å; F289-L644 HydrophobicContact CE1-CG 4.42Å; F289-L644 HydrophobicContact CG-CD2 3.96Å; F289-L644 HydrophobicContact CZ-CD2 4.03Å; F289-L644 WeakPolarHBondContact O-CD1 3.46Å; E290-L644 VanDerWaalsContact CA-CD1 3.47Å; E290-L644 HydrophobicContact CB-CB 4.09Å; E290-L644 HydrophobicContact CB-CD1 4.48Å; N293-L644 HydrophobicContact CB-CD1 3.27Å; N293-L644 HydrophobicContact CB-CD2 3.85Å; N293-L644 HydrophobicContact CB-CG 4.23Å
645N32.2Very low31.7Very low76 Ų76117.5 Ų117.541%0.40666%0.663SS.*  69.4148125.2170.492.2000124.4S288 F289S288-N645 PolarHBondContact OG-ND2 2.68Å; F289-N645 HydrophobicContact CB-CB 3.63Å; F289-N645 VanDerWaalsContact CB-CG 3.48Å; F289-N645 HydrophobicContact CD1-CB 3.42Å; F289-N645 VanDerWaalsContact CD1-CB 3.42Å; F289-N645 HydrophobicContact CE1-CB 4.36Å; F289-N645 HydrophobicContact CG-CB 3.99Å; F289-N645 PolarHBondContact N-ND2 3.28Å
646N35.6Very low31.6Very low104 Ų104118.7 Ų118.756%0.55666%0.664SS**  trans-2.3134.8159-68.6-70.8000120.6
647N37Very low31.3Very low115 Ų115119.2 Ų119.262%0.61567%0.667SS**  trans53109131.5-53-23.5000118.9N286N286-N647 PolarHBondContact ND2-O 2.82Å
648T29.2Very low31.1Very low116 Ų116116.8 Ų116.871%0.71266%0.663SS**  -136125.8122.9-750000110.3N286N286-T648 PolarHBondContact ND2-OG1 2.73Å
649A28.4Very low31.1Very low70 Ų70117.4 Ų117.458%0.57966%0.662SS**  trans24.7136163.100000121.6T651A649-T651 PolarHBondContact O-N 2.69Å
650P31.9Very low30.6Very low136 Ų136119.1 Ų119.188%0.88366%0.66SS**  trans-70.798.315432.1-31.6000109.8N652P650-N652 PolarHBondContact O-N 3.21Å
651T31.6Very low30.8Very low120 Ų120122.8 Ų122.874%0.73667%0.67SS**  trans-76.4112.2148.242.40000107.7A649A649-T651 PolarHBondContact O-N 2.69Å
652N29.5Very low30.6Very low143 Ų143123.9 Ų123.977%0.76567%0.667SS**  -179.1152.2116.8-101.3-71000115.6P650P650-N652 PolarHBondContact O-N 3.21Å
653R28.5Very low30.4Very low201 Ų201120.7 Ų120.776%0.75866%0.657SS**  trans-26.4133.1156.4-89.4173.5162.1173.7-6.9118.5
654A27Very low30.1Very low79 Ų79124.6 Ų124.665%0.65368%0.68SS**  100.9145.111000000122
655N26.5Very low30Very low143 Ų143132.6 Ų132.677%0.76571%0.708SS**  trans59.3119.2152.9-60.4-5.2000119.6
656Q31.4Very low29.7Very low170 Ų170138 Ų13879%0.79473%0.731SS**  -142.8142.389.7-60.9-156.52.200108.6
657N26.8Very low29.4Very low150 Ų150139.6 Ų139.680%0.80274%0.744SS**  -132.2134.667.9-91.4-109.1000113.9
658F27.8Very low28.9Very low161 Ų161139 Ų13971%0.70675%0.749SS**  41.2113.3110.4-139.1-100.7000118
659D30.4Very low29Very low123 Ų123142 Ų14266%0.65876%0.755SS**  trans51.9149.9147.6-64.8-101.8000119.5
660E28.4Very low29Very low157 Ų157144.5 Ų144.573%0.73476%0.763SS**  cis-154.6152.934.7-165.1172.78700111.5E662E660-E662 HydrophobicContact CG-CB 4.3Å
661I32.9Very low29Very low174 Ų174145 Ų14589%0.89276%0.757SS**  trans-116.261.6164.4-168.1170.7000111.2
662E28.9Very low28.9Very low144 Ų144147.2 Ų147.267%0.67376%0.763SS**  trans-114.4141.2155.5-82-155.6179.700108.4E660E660-E662 HydrophobicContact CG-CB 4.3Å
663G30.3Very low28.9Very low49 Ų49151.6 Ų151.651%0.50577%0.769SS.*  104.821.250.700000111.5R665G663-R665 PolarHBondContact O-N 3.04Å
664V26.7Very low29.4Very low151 Ų151147.9 Ų147.992%0.91577%0.771SS**  trans-61.983.9163.8-176.20000109.2
665R29Very low29.5Very low203 Ų203147.8 Ų147.877%0.76678%0.778SS**  trans-61.4145.5168.9-73.1165.7-82177.6-7.7109.3G663G663-R665 PolarHBondContact O-N 3.04Å
666E25.8Very low30.1Very low190 Ų190147.6 Ų147.689%0.88879%0.785SS**  trans-51.1138.3177.4-64.8166.1101.300112.5
667T29.2Very low30.2Very low136 Ų136144.8 Ų144.883%0.83478%0.783SS**  trans-111.183.8153.956.90000110
668S26Very low31Very low103 Ų103143.5 Ų143.572%0.7278%0.783SS**  trans63.1121.5153.3-48.70000116.8
669Q31.3Very low31.2Very low179 Ų179143.1 Ų143.184%0.83679%0.789SS**  -169.7139.173.1-88.4175.230.800114.2
670V29.5Very low31.9Very low122 Ų122142.8 Ų142.874%0.73979%0.793SS**  trans60.790.4144.3-168.80000120.4
671I31.4Very low32Very low147 Ų147141.4 Ų141.475%0.75480%0.796SS**  31.2115.4122.5-41.5165.6000118.8
672L29.9Very low31.9Very low167 Ų167137.1 Ų137.187%0.87479%0.786SS**  174163.1119.1-93.1176.8000114.5
673R29Very low32.1Very low235 Ų235136.2 Ų136.289%0.88779%0.79SS**  trans-136.3170.1171.9-90.4-175.8175.7-179.1-0.4107.5
674P38.9Very low32.1Very low122 Ų122141.7 Ų141.779%0.79280%0.803SS**  cis-137.6155.7-15.435.6-16.5000117.1
675G29.9Very low32.4Very low78 Ų78142.2 Ų142.280%0.80480%0.8SS**  trans70.6178.9159.200000118
676P39.1Very low32.7Very low139 Ų139140.7 Ų140.790%0.90380%0.802SS**  cis-118.4-154.7-6.542.5-27.9000113.4
677S32.2Very low33Very low110 Ų110138 Ų13877%0.76979%0.794SS**  trans-101.5172.2-178.474.20000113.7
678P45Very low33.6Very low123 Ų123138.4 Ų138.480%0.79979%0.79SS**  -150.2178.870.941-20.2000118.9
679N31.6Very low34.1Very low154 Ų154143.2 Ų143.282%0.82480%0.798SS**  trans-53.6165.7168.4-82.3-13000115.1
680P44.3Very low34Very low116 Ų116140.5 Ų140.575%0.75380%0.799SS**  cis-145.6-17448.243.6-21.7000116.2
681T31.3Very low34.1Very low128 Ų128143.8 Ų143.879%0.78581%0.808SS**  cis-153.915616.3-27.80000113.5
682A30.8Very low34Very low84 Ų84141.1 Ų141.169%0.69481%0.809SS**  trans66.398.9149.500000122.5
683V33.2Very low34.1Very low125 Ų125141.8 Ų141.876%0.75881%0.807SS**  44.995.9120.7-177.50000116.7
684Q31.2Very low34.4Very low163 Ų163139.8 Ų139.876%0.76281%0.805SS**  53.7128.572.6-66.6-167.6-27.300117
685N31.9Very low34Very low162 Ų162144.9 Ų144.987%0.86681%0.808SS**  -153.2132.1113.3-101.8-54000110.4
686E35.8Very low33.8Very low172 Ų172146.7 Ų146.780%0.80481%0.809SS**  trans-100.2167.6-172.8-94.4-66.7162.700112.4
687N32.2Very low33.7Very low134 Ų134148 Ų14872%0.71780%0.803SS**  trans-89170-172.1-139.3-56.1000113.8
688L41.9Very low33.7Very low143 Ų143153.1 Ų153.175%0.74981%0.805SS**  trans64.3121.2163-59.6160.1000119.1
689K36.1Very low32.9Very low204 Ų204152.2 Ų152.289%0.88780%0.801SS**  175.4125.8119.2-93.2147.3-167.2159.60113.4
690S29.7Very low32.9Very low123 Ų123149.4 Ų149.486%0.8679%0.794SS**  172.5149120.245.70000112.3
691M31.7Very low32.2Very low190 Ų190152.1 Ų152.194%0.93679%0.791SS**  trans-133.5128.6159.8-72.7-154.6-57.800108.5
692A29.3Very low32.2Very low92 Ų92153 Ų15376%0.7680%0.796SS**  trans-168.1121.5153.100000112.8
693H31.6Very low32.6Very low181 Ų181158.6 Ų158.684%0.83880%0.799SS**  trans1.2128.9158.2-44-72.9000121.3
694K34.7Very low32.6Very low193 Ų193160.9 Ų160.984%0.83981%0.806SS**  179.2141.796.7-99.6174.3-178.3171.10115.6
695R30Very low32.4Very low228 Ų228158.4 Ų158.486%0.8681%0.807SS**  trans37.6110.2140.1-176.9-172.1-76.3173.1-7.7119.2
696S26.6Very low32.6Very low117 Ų117159.9 Ų159.982%0.81881%0.805SS**  -173.3171.7100.7-156.70000112
697Q35.9Very low32.2Very low166 Ų166158.8 Ų158.878%0.77681%0.805SS**  trans-125.8139.5171.4-92.4-140.711.600112.5
698R32.7Very low32.2Very low218 Ų218157 Ų15782%0.82381%0.809SS**  trans58.6150141.2-153.5174.2-171.7177.63.4120.6
699S28.6Very low31.8Very low103 Ų103154.8 Ų154.872%0.7281%0.805SS**  trans73.9150.1164-78.20000117.9
700S32.3Very low31.6Very low96 Ų96153.2 Ų153.267%0.67180%0.801SS**  cis-176.3164.4-20.950.50000110.8
701Y28.8Very low31.8Very low173 Ų173155.4 Ų155.468%0.67880%0.802SS**  trans76.2130.1147.2-132.5-100.4000119.2R703Y701-R703 HydrophobicContact CD1-CB 4.37Å; Y701-R703 HydrophobicContact CD1-CG 4.38Å; Y701-R703 HydrophobicContact CE1-CB 3.83Å; Y701-R703 HydrophobicContact CE1-CG 3.54Å; Y701-R703 PolarHBondContact OH-NE 3.02Å
702T31.6Very low31.7Very low147 Ų147154.4 Ų154.490%0.90280%0.795SS**  trans-137.7121.6149.5410000109.7
703R39Very low31.6Very low201 Ų201154.1 Ų154.176%0.75879%0.793SS**  trans-131.5130.7160.1-85.4-168.1-171.2-140.14.1107.4Y701Y701-R703 HydrophobicContact CD1-CB 4.37Å; Y701-R703 HydrophobicContact CD1-CG 4.38Å; Y701-R703 HydrophobicContact CE1-CB 3.83Å; Y701-R703 HydrophobicContact CE1-CG 3.54Å; Y701-R703 PolarHBondContact OH-NE 3.02Å
704L33.8Very low31.4Very low173 Ų173150.4 Ų150.491%0.90679%0.793SS**  trans-161.8148.5150.5-89.3-176.9000105.8
705S26.4Very low31.2Very low110 Ų110146.1 Ų146.177%0.76979%0.788SS**  cis-140175.1-7.4-163.50000109.6
706K35.2Very low31.5Very low193 Ų193139.7 Ų139.784%0.83978%0.778SS**  trans-128.8121.5170.9172.7-174.3174.1-177.30108.4
707D27.8Very low32Very low149 Ų149140.8 Ų140.880%0.79778%0.775SS**  trans-157.2140153.3-141-19000111.9
708A32.1Very low32.1Very low96 Ų96137.6 Ų137.679%0.79377%0.77SS**  trans169.2113.6171.700000108.4
709S34.2Very low32.3Very low97 Ų97133.9 Ų133.968%0.67877%0.772SS**  trans-109.1151.9-176.6-65.50000113
710E30.9Very low32.6Very low172 Ų172132.2 Ų132.280%0.80477%0.771SS**  trans36118.7147.3-61.2177.7117.500120.3
711L34.1Very low32.7Very low168 Ų168138 Ų13888%0.8879%0.785SS**  -142.7149.4127.6-84.6-169.5000112.2
712H29.2Very low33Very low169 Ų169132.7 Ų132.778%0.78278%0.782SS**  trans-58.6167.3175.6-56.8-71.9000114.6
713A27.1Very low33.3Very low86 Ų86133.6 Ų133.671%0.71178%0.776SS**  cis-177.1170.9-19.800000109.2
714A29.2Very low33.5Very low103 Ų103132 Ų13285%0.85178%0.777SS**  trans58.4148.5152.600000119.7
715S29.5Very low34.2Very low103 Ų103135 Ų13572%0.7278%0.777SS**  cis-161.3166.7-11.2-176.80000108.5
716S37.3Very low35.2Very low94 Ų94138.8 Ų138.866%0.65778%0.782SS**  trans71148153.9-75.60000118.6
717D35.7Very low35.8Very low140 Ų140134 Ų13475%0.74977%0.773SS**  cis-148.2164.53-107.3-16000113.5
718S37.7Very low36.7Very low98 Ų98132.8 Ų132.869%0.68577%0.765SS**  trans16.3150.8151.577.40000121.3
719T37.7Very low37.3Very low141 Ų141133.9 Ų133.987%0.86576%0.757SS**  cis-167.1165-3.220.50000106.1
720G35.9Very low37.5Very low68 Ų68135.7 Ų135.770%0.70176%0.761SS**  cis-172.1178.22.400000109.4
721F32.7Very low37.8Very low218 Ų218133.8 Ų133.896%0.95676%0.759SS**  trans-85161.9-174.4-98.2-113.8000114.6
722G36.1Very low38Very low60 Ų60131.9 Ų131.962%0.61975%0.752SS**  trans161.8101.4168.200000107.6
723E38.3Very low38.6Very low166 Ų166129.7 Ų129.778%0.77675%0.75SS**  65.812973.1-70.6176.7136.500111.8
724E42.8Very low39.3Very low168 Ų168132.4 Ų132.479%0.78575%0.753SS**  cis-156.5-157.5155.6-139.8116.200113.2
725R49.2Very low40Very low236 Ų236134.4 Ų134.489%0.89175%0.746SS**  trans-126.8104.2-170-66.7167.2169.4-108.24.2111.9
726E46.8Very low40.7Very low190 Ų190136.6 Ų136.689%0.88875%0.748SS**  trans-135.8120162.4-63.1-169.7141.600107.5
727S46.6Very low41Very low93 Ų93139.9 Ų139.965%0.6576%0.755SS**  cis79.576.311.3-154.80000116.7
728I47.9Very low41.4Very low122 Ų122139.9 Ų139.963%0.62676%0.755SS**  trans77.7125.6152.4-52.2159.4000115.4S616S616-I728 WeakPolarHBondContact OG-CG2 3.36Å
729L45.2Very low41.7Very low119 Ų119143.7 Ų143.762%0.62376%0.762SS**  -143.20111.6-72-44.9000109.8E614 C615 S616E614-L729 HydrophobicContact CB-CB 3.97Å; E614-L729 HydrophobicContact CB-CD2 4.23Å; E614-L729 HydrophobicContact CG-CB 3.85Å; E614-L729 HydrophobicContact CG-CD2 3.8Å; E614-L729 HydrophobicContact CG-CG 4.45Å; E614-L729 PolarHBondContact N-O 2.64Å; C615-L729 WeakPolarHBondContact CA-OXT 3.18Å; S616-L729 PolarHBondContact OG-OXT 2.67Å

Retrieved 729 of 729 residues in 365.5 ms (Link to these results)