A0A087Y3G4_POEFO Loading...

Polyhomeotic homolog 1

AlphaFold DB , UniProt , Accession A0A087Y3G4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 669 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
1M35Very low46Very low233 Ų233135.1 Ų135.1100%1.14880%0.796SS**  0158.90-69.6150.272.600108.8
2S37.8Very low45.4Very low115 Ų115132.8 Ų132.880%0.80479%0.792SS**  trans42.9117157.9-46.50000120.5
3S49.8Very low44.8Very low106 Ų106129.7 Ų129.774%0.74179%0.791SS**  trans-78.8164.3150.6-1660000109.5
4P61.3Low44.2Very low127 Ų127129.4 Ų129.483%0.82579%0.789SS**  -145.7-179.794.437.8-20.3000116.7
5R46.4Very low43.8Very low231 Ų231129.5 Ų129.587%0.87279%0.79SS**  trans-97.1-164.5173.8-109.7-179.3-179.5-178.90.7109.6
6P69.3Low43.1Very low87 Ų87129.6 Ų129.657%0.56579%0.791SS**  cis-133.4-165.4-3836.5-18.2000112.4
7H35.6Very low42.7Very low184 Ų184127.1 Ų127.185%0.85279%0.786SS**  163.4170.5124.6-86.8-70.2000114.2
8G28.1Very low42.2Very low65 Ų65128.7 Ų128.767%0.6779%0.788SS**  trans-149.9-148.1172.800000108.4
9P60.8Low41.5Very low131 Ų131129.4 Ų129.485%0.85179%0.787SS**  cis-142.2-147.1-13.542.5-20.4000113.4
10A39.6Very low41.2Very low77 Ų77131.2 Ų131.264%0.63679%0.786SS**  trans91.2121.1155.700000120.8
11T42Very low40.9Very low130 Ų130129.2 Ų129.280%0.79878%0.779SS**  89.9153.296.8550000116.4
12S38.4Very low40.9Very low107 Ų107125.3 Ų125.375%0.74877%0.767SS**  cis-175.4-179.5-15.4-87.80000112.1
13A37.6Very low41Very low93 Ų93127.1 Ų127.177%0.76977%0.767SS**  trans79.8158.115800000120.3
14T37.3Very low40.3Very low126 Ų126130.4 Ų130.477%0.77378%0.776SS**  cis-175155.2-20.4-89.10000113.6
15T37.3Very low38.8Very low131 Ų131128 Ų12880%0.80477%0.774SS**  trans84.8171.7156.8-75.40000122.4
16T33.2Very low38.1Very low131 Ų131120.3 Ų120.380%0.80477%0.767SS**  trans-139.3159.2-143.7-40.80000113.9
17A36Very low36.4Very low86 Ų86124.4 Ų124.471%0.71178%0.783SS**  trans130.1147.2132.300000121.3
18L33.8Very low36.6Very low157 Ų157121.5 Ų121.582%0.82278%0.784SS**  trans67.797.1151.9-70.8170.2000125.1
19N28.8Very low37Very low141 Ų141123.9 Ų123.975%0.75480%0.797SS**  55.1134.4113.2-112-34.4000126
20Q35.3Very low36Very low166 Ų166120.6 Ų120.678%0.77679%0.787SS**  trans67.7152.7154.2-64.2-141.984.300121.3
21S35.8Very low35.9Very low90 Ų90126.9 Ų126.963%0.62980%0.803SS**  cis-175.5120.5-24.8-89.10000110.8
22V35.1Very low35.5Very low150 Ų150124 Ų12491%0.90980%0.8SS**  trans-150.5144.1162.3178.20000110.6
23L38.7Very low35.3Very low153 Ų153128.2 Ų128.280%0.80181%0.807SS**  trans-99.2148.4173.7-65.4159.6000109.6
24L36.8Very low35.3Very low176 Ų176131.7 Ų131.792%0.92181%0.81SS**  -168.1158.866.2-75155.5000107.5
25G28.5Very low35.2Very low76 Ų76137 Ų13778%0.78482%0.817SS**  cis-179.2-173.8-0.600000109
26G31.1Very low35.1Very low70 Ų70137.5 Ų137.572%0.72281%0.814SS**  trans115.747.417200000117.5
27N33.6Very low35.5Very low172 Ų172143 Ų14392%0.9282%0.82SS**  trans29.3101160.2-64.812.7000118.8
28S39.8Very low35.4Very low124 Ų124144.1 Ų144.187%0.86782%0.818SS**  trans-115.3149167.1-65.10000111.7
29A37.6Very low35.7Very low114 Ų114144.7 Ų144.794%0.94282%0.822SS**  trans-149.571.3165.800000110.3
30G39.8Very low36.1Very low62 Ų62148 Ų14864%0.63982%0.824SS**  trans-121.2169.1172.900000111.3
31Q36.8Very low36.1Very low210 Ų210145.4 Ų145.498%0.98183%0.825SS**  trans69148.6-173-45.1-178.819.600113.2
32G34.8Very low36.2Very low70 Ų70148.6 Ų148.672%0.72283%0.834SS**  cis147.694.3-2.100000110.1
33Q34.3Very low36.5Very low194 Ų194152.5 Ų152.591%0.90783%0.832SS**  trans-92.5137.8-177.8-67.8-159.62.600112.7
34M36.3Very low36.3Very low167 Ų167152.7 Ų152.782%0.82383%0.834SS**  trans-84.2137-178.3-60.9-155.5-65.200111.9L36M34-L36 PolarHBondContact O-N 2.78Å
35Y36.7Very low36.6Very low236 Ų236150.2 Ų150.293%0.92583%0.828SS**  trans-73.488.5174.4-86.9-94.4000111.9R37Y35-R37 PolarHBondContact O-N 3.06Å; Y35-R37 VanDerWaalsContact O-N 3.13Å
36L34.5Very low37Very low142 Ų142154.5 Ų154.574%0.74383%0.832SS**  trans-70.5102.2159.8-84.187.6000109.5M34 V38M34-L36 PolarHBondContact O-N 2.78Å; L36-V38 VanDerWaalsContact C-N 3.25Å; L36-V38 HydrophobicContact CB-CG2 4.24Å; L36-V38 PolarHBondContact O-N 3.29Å
37R41.7Very low37.1Very low247 Ų247157.8 Ų157.893%0.93284%0.838SS**  trans-74.276.4171.4-174-175-74.7164.8-3.8110.4Y35 N39Y35-R37 PolarHBondContact O-N 3.06Å; Y35-R37 VanDerWaalsContact O-N 3.13Å; R37-N39 PolarHBondContact O-N 3.32Å
38V34.1Very low36.9Very low110 Ų110155 Ų15567%0.66783%0.833SS**  trans-80.2112.5172.8-175.60000109.6L36 R40L36-V38 VanDerWaalsContact C-N 3.25Å; L36-V38 HydrophobicContact CB-CG2 4.24Å; L36-V38 PolarHBondContact O-N 3.29Å; V38-R40 HydrophobicContact CG1-CB 4.42Å; V38-R40 PolarHBondContact O-N 2.71Å
39N38.9Very low36.6Very low169 Ų169157.3 Ų157.390%0.90483%0.83SS**  trans-81.4104.5174.4-150.7-3.8000108.3R37R37-N39 PolarHBondContact O-N 3.32Å
40R37Very low36.6Very low209 Ų209160.3 Ų160.379%0.78983%0.829SS**  trans-126109.6-177.1-158.8170.2-168.5166.23.9112.2V38V38-R40 HydrophobicContact CG1-CB 4.42Å; V38-R40 PolarHBondContact O-N 2.71Å
41S35.9Very low36.4Very low113 Ų113164 Ų16479%0.7983%0.833SS**  trans-62.2137.3167.6-176.70000110.4
42L38.8Very low36.3Very low156 Ų156164 Ų16482%0.81783%0.83SS**  trans-112.3100.2175.8-69.6176.9000110.2
43R39.8Very low36.4Very low233 Ų233168 Ų16888%0.87983%0.832SS**PPolyproline II helixtrans-79.8159.4151.1-93.8-178.1165.3175.7-5.3109.1
44N35.7Very low37Very low156 Ų156165 Ų16583%0.83483%0.829SS**PPolyproline II helixtrans-55.5142.4177.9-60.227.9000112
45P42.8Very low36.8Very low124 Ų124160.3 Ų160.381%0.80582%0.824SS**PPolyproline II helixtrans-74.2140.816132.3-32.2000110.4
46L37.3Very low36.7Very low167 Ų167152.7 Ų152.787%0.87482%0.816SS**PPolyproline II helixtrans-90.5169.6158.7-79.7168.1000109.8S48L46-S48 PolarHBondContact O-N 3.32Å
47T32.5Very low36.9Very low138 Ų138152.8 Ų152.885%0.84782%0.823SS**PPolyproline II helixtrans-61.3127.1-17548.30000113.5
48S30.5Very low36.5Very low115 Ų115147.6 Ų147.680%0.80482%0.819SS**PPolyproline II helixtrans-76.4129.6166.6-62.20000111.1L46L46-S48 PolarHBondContact O-N 3.32Å
49Q33.3Very low36.6Very low172 Ų172147.4 Ų147.480%0.80483%0.829SS**PPolyproline II helixtrans-71.2154.1157.4-65.1174-8.400109.7
50L38.2Very low36.4Very low176 Ų176144.1 Ų144.192%0.92183%0.825SS**  trans-128.1125.8161-75.4175.7000108.8
51I35.7Very low36.3Very low141 Ų141140.6 Ų140.672%0.72383%0.827SS**  trans-105.9127.9170.8-64171.5000107.1
52F34.1Very low36.2Very low208 Ų208139.1 Ų139.191%0.91282%0.821SS**  trans-149.7135.2155.5-123.3-84.2000109.6
53M37Very low36Very low156 Ų156137.6 Ų137.677%0.76882%0.819SS**  trans-86.5155.7174.3-62.1-178.672.100110.4
54P46.2Very low35.8Very low130 Ų130132.5 Ų132.584%0.84481%0.813SS**  -126174.8107.736.9-32.3000112.2
55G32.1Very low35.7Very low69 Ų69129.2 Ų129.271%0.71181%0.807SS**  trans-136.1174.1-175.600000114.6
56G35.3Very low35.3Very low75 Ų75132.5 Ų132.577%0.77381%0.812SS**  trans84.8134.9-174.800000112.2
57T38.2Very low35Very low144 Ų144130.4 Ų130.488%0.88381%0.807SS**  cis-146.3172.818.731.20000113.8
58T33.4Very low35Very low138 Ų138132.1 Ų132.185%0.84781%0.805SS**  trans-56142.1179.648.90000117.3
59A35.8Very low35Very low107 Ų107132.8 Ų132.888%0.88480%0.804SS**  trans-158144.6135.800000109.8
60A34.1Very low34.8Very low99 Ų99133.1 Ų133.182%0.81881%0.806SS**  trans-149.9129.6-179.700000113.4
61V35.3Very low35.3Very low136 Ų136129.2 Ų129.282%0.82479%0.791SS**  trans-154.3125.5166-135.60000103.7
62A33.3Very low35.1Very low81 Ų81130.3 Ų130.367%0.66979%0.793SS**  63.7133.750.400000111.5
63T34.6Very low35Very low125 Ų125127.1 Ų127.177%0.76778%0.781SS**  cis-165.417010.4-10.60000111.1
64V36.4Very low34.9Very low126 Ų126125.8 Ų125.876%0.76477%0.773SS**  trans65.7124.9154171.10000116.7
65A33.4Very low34.4Very low86 Ų86126 Ų12671%0.71176%0.763SS**  cis85.1101.816.100000118.1
66Q33.9Very low34.5Very low194 Ų194128.9 Ų128.991%0.90776%0.758SS**  trans-163.9177.2149.4-113.4167.122.200113.1
67T32.1Very low34.6Very low123 Ų123132.2 Ų132.276%0.75575%0.753SS**  trans-144.2178.4-154.147.80000114.2
68Q33Very low34.2Very low173 Ų173131.6 Ų131.681%0.80874%0.744SS**  trans81.5150.5171.8-49.8-172.96.300115.5
69T28.7Very low34.1Very low130 Ų130129.2 Ų129.280%0.79874%0.738SS**  cis-149.6170.46-16.10000113.4
70Q29.6Very low33.9Very low178 Ų178128.4 Ų128.483%0.83273%0.731SS**  trans-85.7-171.5171.4-109.9-169.511.200112.6
71P49.3Very low33.7Very low95 Ų95128.4 Ų128.462%0.61773%0.726SS**  cis-128.2170.93.230-6.6000115.4
72Q30.8Very low33.5Very low163 Ų163128.3 Ų128.376%0.76273%0.725SS**  155.7168105.5-94.2176-88.800107.9
73Q33.4Very low33.4Very low141 Ų141129.9 Ų129.966%0.65973%0.727SS**  cis-173.7174.9-25.9-112.6-175.7-47.100106.6
74Q33.5Very low33.1Very low128 Ų128129.9 Ų129.960%0.59873%0.727SS**  cis-165.7123.4-7.4163.3169.11.800111.3
75Q35.2Very low32.6Very low135 Ų135129.6 Ų129.663%0.63173%0.729SS**  trans63.2157.6150.2-75.7173.3-45.100121.5
76Q35.3Very low32.4Very low130 Ų130129.4 Ų129.461%0.60773%0.727SS**  cis-152.6140.12.9-145.9145.7-16.300117.2
77H36.3Very low32.1Very low145 Ų145129 Ų12967%0.67173%0.726SS**  trans61.2159.7143.8-79-143.8000122.1
78D30.2Very low32.1Very low131 Ų131127.2 Ų127.270%0.70172%0.724SS**  cis-146.7167.64.9-137-41.8000114.6
79A32.7Very low32Very low87 Ų87126 Ų12672%0.71972%0.723SS**  trans22.2152.4156.500000123.4
80A31.6Very low32.1Very low90 Ų90126.8 Ų126.874%0.74472%0.722SS**  cis176.2170.4-1200000108.4
81S29.9Very low32.4Very low100 Ų100124.8 Ų124.870%0.69972%0.717SS**  cis-173.2157.4-31-84.50000110.6
82T30.7Very low31.6Very low133 Ų133129 Ų12982%0.81673%0.728SS**  trans65.8150.9160.148.70000119.5
83T30.2Very low31.8Very low114 Ų114127.2 Ų127.270%0.69973%0.728SS**  cis-157.7158.510.5-9.50000113.6
84T28.2Very low32Very low126 Ų126128.3 Ų128.377%0.77373%0.733SS**  trans54.1129.1156.147.10000120.3
85C26.9Very low31.9Very low120 Ų120127.8 Ų127.881%0.81174%0.735SS**  cis73.1136.839.8-149.90000113.3
86A28.4Very low32Very low81 Ų81128.9 Ų128.967%0.66974%0.744SS**  cis-144.6156.215.500000111.1
87Q28.1Very low31.9Very low186 Ų186126.3 Ų126.387%0.86975%0.745SS**  86.613776.5-168176.3-27.300117
88A31.4Very low31.9Very low86 Ų86126.7 Ų126.771%0.71175%0.751SS**  trans76.8104.2162.500000122.4
89D31.1Very low32.1Very low148 Ų148129.6 Ų129.679%0.79176%0.76SS**  39.4117.4110.7-156-78.5000122
90N31.3Very low31.9Very low146 Ų146130.9 Ų130.978%0.78176%0.762SS**  trans-161151.7142.6-141.4-112.7000114.6
91D35.3Very low31.8Very low135 Ų135131.1 Ų131.172%0.72276%0.764SS**  trans-94.4137.4-179.9-123.9-53.9000112.6
92Q33.2Very low31.9Very low185 Ų185131.3 Ų131.386%0.86477%0.766SS**  trans-163.3146.2150.8-122.2154.8104.400115.3
93V34.9Very low31.9Very low124 Ų124132.8 Ų132.875%0.75277%0.769SS**  trans-110.5129.5-175.8173.20000110.3
94Q37.3Very low32.1Very low165 Ų165132.2 Ų132.277%0.77178%0.775SS**  trans-151.7128.2152.7-16558.9-40.200116.8
95N32Very low32.3Very low117 Ų117135.9 Ų135.963%0.62678%0.78SS**  trans0.6127158.5-85.6-77.6000124
96L37.8Very low32.5Very low157 Ų157134.9 Ų134.982%0.82278%0.781SS**  100.1131.4108.3-170.363.7000122.6
97A31.6Very low32.6Very low76 Ų76137.7 Ų137.763%0.62879%0.79SS**  trans75.5116.2152.600000123.2
98L38Very low32.7Very low153 Ų153133.5 Ų133.580%0.80179%0.786SS**  31.7126.8126.8-70.1160.2000120.5
99H33.3Very low32.8Very low193 Ų193136.4 Ų136.489%0.89480%0.795SS**  -160.5-174.7116-106.7-67.7000111.4
100C28.1Very low32.7Very low113 Ų113137 Ų13776%0.76479%0.791SS**  trans-111.5170.9-159.1-57.90000115.1
101A30.1Very low32.9Very low95 Ų95134.5 Ų134.579%0.78579%0.79SS**  trans95.9124.9150.500000120.8
102S32Very low32.5Very low105 Ų105135.7 Ų135.773%0.73479%0.791SS**  trans17.4114.7139.9-47.70000121
103N31.7Very low32.4Very low164 Ų164131.7 Ų131.788%0.87778%0.784SS**  -177.3147102.5-97-25.4000112.4
104A33.4Very low32.4Very low101 Ų101131.7 Ų131.784%0.83578%0.784SS**  trans-123.4127.9164.700000108.6
105K32Very low32.1Very low203 Ų203129.6 Ų129.688%0.88377%0.774SS**  trans-84.6145.1179-72.9-178.6177.1177.70110.7
106A31.6Very low32.3Very low99 Ų99133.9 Ų133.982%0.81878%0.782SS**  trans-73.4153.8165.500000111.1
107V31.4Very low31.9Very low141 Ų141134.5 Ų134.586%0.85578%0.778SS**  trans-112.7131.5163.6174.40000107.3
108A30Very low31.8Very low97 Ų97137.2 Ų137.280%0.80278%0.782SS**  trans-115.2141.4175.800000109.6
109V31.8Very low31.4Very low147 Ų147134.7 Ų134.789%0.89178%0.783SS**  trans-104.6132.4171.7179.10000108.1
110K29.9Very low31.1Very low161 Ų161128.8 Ų128.870%0.777%0.774SS**  trans-100.2140.7-174.6-179-170.1170.6-158.60110.4E112K110-E112 WeakPolarHBondContact CE-OE2 3.45Å; K110-E112 IonicContact NZ-OE1 3.92Å; K110-E112 IonicContact NZ-OE2 3.17Å; K110-E112 PolarHBondContact NZ-OE2 2.56Å
111A36.3Very low31.1Very low94 Ų94129.5 Ų129.578%0.77778%0.781SS**  trans-104.6153.8166.100000111.1
112E26Very low31.3Very low159 Ų159134.7 Ų134.774%0.74379%0.786SS**  trans-152.9163.4172.8-159155.589.300109.6K110K110-E112 WeakPolarHBondContact CE-OE2 3.45Å; K110-E112 IonicContact NZ-OE1 3.92Å; K110-E112 IonicContact NZ-OE2 3.17Å; K110-E112 PolarHBondContact NZ-OE2 2.56Å
113S32.1Very low31.9Very low102 Ų102135.8 Ų135.871%0.71379%0.79SS**  trans-162.3172.3-158.453.60000115.7
114V34.2Very low31.9Very low123 Ų123135.5 Ų135.575%0.74579%0.788SS**  trans77.4138.4171.3-1500000112.3
115E29.7Very low31.5Very low122 Ų122136.6 Ų136.657%0.5778%0.784SS**  -176.2138.755.6-178135.1118.200116.3
116R37Very low31.5Very low207 Ų207134 Ų13478%0.78178%0.775SS**  trans55.1160.5145.7-75166.4-160.91515.9121.4
117K30.2Very low31.4Very low170 Ų170136 Ų13674%0.73977%0.768SS**  cis-173.4152.1-8.8155.8177.7174.2-172.30113.6
118D29.6Very low31.3Very low133 Ų133135.9 Ų135.971%0.71176%0.758SS**  trans84.5151.5155.5-104.6-57.2000126.7
119A28.1Very low31.4Very low99 Ų99138 Ų13882%0.81875%0.751SS**  trans56.6145165.100000120.6
120G27.6Very low31.3Very low69 Ų69138.1 Ų138.171%0.71174%0.742SS**  cis172167.9-7.400000113.9
121S27.6Very low31.3Very low129 Ų129135.6 Ų135.690%0.90274%0.74SS**  trans72.2128.1166.5-580000121.7
122F34.1Very low30.9Very low203 Ų203140.6 Ų140.689%0.8975%0.745SS**  trans-84.7165.5153.2-84.9-92.3000110.4
123P46.4Very low30.9Very low129 Ų129137.6 Ų137.684%0.83874%0.742SS**  -140176.1103.338.1-25.2000115.9
124L30.8Very low30.8Very low158 Ų158140.8 Ų140.883%0.82775%0.745SS**  trans-98.5144.4-174.616774.4000112.4
125T25.5Very low30.6Very low123 Ų123142.1 Ų142.176%0.75574%0.743SS**  trans167.6159.8148.836.30000110.8
126Q30.8Very low31Very low149 Ų149143 Ų14370%0.69675%0.747SS**  cis-177.6138.7-20.8172.5178.840.400109.9
127Q30Very low31.2Very low142 Ų142140 Ų14066%0.66474%0.743SS**  trans61.7173.2160.9-77.6177.2-59.400117.8
128Q29.3Very low31.1Very low138 Ų138138.6 Ų138.665%0.64574%0.74SS**  cis-167.4169.5-33.9-159.2164.1-8100104.8
129Q31.6Very low31.5Very low141 Ų141136 Ų13666%0.65974%0.738SS**  cis-148.8-130.421.7-168.6139.5-10.400113.2
130Q31.2Very low31.8Very low150 Ų150140.5 Ų140.570%0.70174%0.738SS**  trans-112.9-175.4-176.2-59.4138.5-59.800108.6
131T28.6Very low32Very low108 Ų108141.9 Ų141.966%0.66374%0.743SS**  cis-170.1145.438.129.30000112.1
132F29.5Very low32Very low198 Ų198138.6 Ų138.687%0.86873%0.73SS**  trans60.6165.9150.6-76.3-120000117.1
133S24.2Very low31.7Very low97 Ų97138.5 Ų138.568%0.67873%0.729SS**  cis-167.5-179.8-26.960.20000107.1
134Q30.4Very low30.9Very low169 Ų169139.1 Ų139.179%0.7973%0.726SS**  cis-154.9143.26.1-170.9167.3-84.300112.7
135Q30.8Very low31Very low150 Ų150138.4 Ų138.470%0.70172%0.718SS**  trans0.4125.1140.6-140.1159.1-8.500119.2
136Q37.8Very low31.6Very low141 Ų141138.4 Ų138.466%0.65972%0.72SS**  75.7161.683.2-120.9-176.614.300113.3
137Q40.8Very low31.5Very low145 Ų145135.9 Ų135.968%0.67872%0.719SS**  cis-165.7169.63.9-160.3165.332.100110.4
138M29.1Very low31.4Very low139 Ų139133.2 Ų133.269%0.68572%0.721SS**  170.4134.3129.1-79-96.9-175.300107.5
139A36.4Very low31.3Very low80 Ų80132 Ų13266%0.66173%0.728SS**  cis84.1150.144.500000112.5
140K35Very low31.1Very low192 Ų192130.7 Ų130.784%0.83573%0.734SS**  cis-164.1150.217.9-154.8173.6-175.1174.10112.5
141A32.8Very low30.7Very low99 Ų99128.6 Ų128.682%0.81873%0.732SS**  trans49.9159.815200000122
142G26Very low30.7Very low60 Ų60130.7 Ų130.762%0.61974%0.738SS**  cis145.8132.8-13.700000115.2
143F29.8Very low30.5Very low200 Ų200126.6 Ų126.688%0.87773%0.729SS**  trans64.5162.5174-72.7-89.8000115.9
144N27.9Very low30.7Very low142 Ų142128.6 Ų128.676%0.75974%0.737SS**  cis-144.7172.28.4-144.3-29000112.9
145Q34.3Very low30.7Very low144 Ų144129 Ų12967%0.67374%0.737SS**  trans-91.2163.4176-151.8-158.988.100112.4S147Q145-S147 PolarHBondContact OE1-OG 2.93Å
146P37.5Very low30.6Very low122 Ų122127.6 Ų127.679%0.79274%0.738SS**  trans-137.5179.4130.139.3-28000113.9
147S27.8Very low30.2Very low97 Ų97123.7 Ų123.768%0.67874%0.736SS**  trans-136.1174.9-157.7-34.10000114.7Q145Q145-S147 PolarHBondContact OE1-OG 2.93Å
148A28.7Very low30Very low85 Ų85123.4 Ų123.470%0.70274%0.739SS**  trans89111.9147.400000122
149S26.9Very low30.3Very low112 Ų112124.9 Ų124.978%0.78375%0.745SS**  80.8146.7125.4-58.90000123
150S27.6Very low30.1Very low114 Ų114125.4 Ų125.480%0.79775%0.749SS**  trans75.9154.6155.3-80.10000119.4
151T23.8Very low29.9Very low107 Ų107119.7 Ų119.766%0.65674%0.738SS**  cis-176.7150.1-18.2-94.10000109
152L28.6Very low30.1Very low152 Ų152122.8 Ų122.880%0.79674%0.737SS**  trans63.2163.9171.6-71.4167.2000116.5
153T25.2Very low30.4Very low111 Ų111125.7 Ų125.768%0.68174%0.743SS**  cis-166.7-179-44.426.40000108.4
154V28.2Very low30.7Very low139 Ų139122.3 Ų122.384%0.84274%0.738SS**  trans82.7145.7160.3-175.30000116.1
155K29.5Very low30.8Very low178 Ų178119.4 Ų119.477%0.77473%0.734SS**  cis-175.8161.9-33.8-169.4179.9173.2-177.90107.9
156T28.7Very low31.7Very low120 Ų120118.3 Ų118.374%0.73674%0.74SS**  trans83134.8159.4-38.30000115.5
157G29.1Very low31.5Very low60 Ų60117 Ų11762%0.61974%0.739SS**  cis139.2145.1-12.400000114.3
158N36.6Very low31.7Very low138 Ų138119.4 Ų119.474%0.73875%0.749SS**  trans172.9114147-90.1-17.3000109.8
159Q35.3Very low32Very low171 Ų171120.7 Ų120.780%0.79975%0.753SS**  92.1133.795.6-78-166.995.200113.1
160A32.6Very low32.4Very low90 Ų90122.5 Ų122.574%0.74476%0.759SS**  cis-156.8-170.6-7.900000108.3
161A31.8Very low32.6Very low73 Ų73121.1 Ų121.160%0.60375%0.754SS**  cis-158.8178.88.100000111.1
162M37.4Very low33.7Very low164 Ų164121.3 Ų121.381%0.80876%0.758SS**  trans69.6152.9170.2-39.4-52.9-175.900115.5
163T31.7Very low33.8Very low121 Ų121119 Ų11974%0.74275%0.754SS**  cis77.5153.18.6-15.30000113.8
164V34.7Very low34.1Very low128 Ų128118.9 Ų118.978%0.77676%0.758SS**  cis-134.6129.85.9-157.70000106.4
165A31.1Very low34.2Very low82 Ų82117.5 Ų117.568%0.67875%0.754SS**  70158.550.100000113.8
166P53.9Low34.3Very low121 Ų121114.5 Ų114.579%0.78676%0.756SS**  cis-106.5169.6-6.539.2-27.2000112.7
167A32.4Very low34.4Very low94 Ų94114.1 Ų114.178%0.77776%0.758SS**  cis86.9122.432.300000116.6
168V31.7Very low34.8Very low148 Ų148116.6 Ų116.690%0.89777%0.766SS**  trans-179163.4151.6143.20000109
169S35.2Very low35.6Very low111 Ų111116 Ų11678%0.77677%0.769SS**  trans-123.9-170.5-170.9-50.80000113.8
170V35Very low35.4Very low150 Ų150112 Ų11291%0.90977%0.766SS**  trans99.6145.2166.3-173.60000116.5
171A31.4Very low35.7Very low85 Ų85115.6 Ų115.670%0.70277%0.772SS**  trans-125.3171.3178.300000108.4
172P48.6Very low36.9Very low112 Ų112117.7 Ų117.773%0.72778%0.779SS**  cis-153.9-16637.344.6-21.6000117.7
173S29.4Very low36.7Very low103 Ų103117 Ų11772%0.7278%0.777SS**  trans64.6115.3145.9-60.90000124.2
174S30.9Very low36.9Very low109 Ų109115.2 Ų115.276%0.76277%0.77SS**  81.2118.3125.5-58.50000124.9
175S31.2Very low36.9Very low110 Ų110117.5 Ų117.577%0.76977%0.772SS**  93.8146.2128.776.70000123.4
176S31.6Very low37.1Very low114 Ų114120 Ų12080%0.79777%0.773SS**  trans68.8147.7169.972.10000118.4
177S31.5Very low36.2Very low113 Ų113121 Ų12179%0.7977%0.772SS**  cis-162.5150.8-15.944.90000111.6
178S35.8Very low36.2Very low111 Ų111123.9 Ų123.978%0.77677%0.773SS**  trans-80168.7175.7-46.30000113.4
179P53.5Low36.4Very low126 Ų126120.7 Ų120.782%0.81876%0.762SS**  -125.2-162.986.342.4-35.5000111.1
180A31.4Very low37.2Very low87 Ų87120.9 Ų120.972%0.71976%0.761SS**  cis-153.4176.47.100000112
181L40.5Very low37Very low166 Ų166119.7 Ų119.787%0.86976%0.759SS**  trans-140.9159.6163.5-70176.2000109.4
182P55.8Low37Very low117 Ų117120.8 Ų120.876%0.7676%0.762SS**  -147.1160.911437.4-22.2000113.7
183L34.4Very low37.2Very low148 Ų148120.8 Ų120.878%0.77576%0.762SS**  cis-160154.3-12.8-142.178.3000109.3
184S35.9Very low37.5Very low84 Ų84121.5 Ų121.559%0.58776%0.762SS**  trans53.6151.6143.3-69.90000122.1
185Q34.7Very low37.6Very low176 Ų176123.3 Ų123.382%0.82276%0.761SS**  cis-159.2169.75.7-127.8163.253.700111.8
186L35.3Very low37.6Very low134 Ų134125.9 Ų125.970%0.70277%0.765SS**  -168.4104.8-60.8-171.473.5000112.1
187L34.1Very low37.9Very low143 Ų143126.1 Ų126.175%0.74976%0.762SS**  trans57.8-177.6151.9-47.5174.3000117.4
188L32.9Very low38.8Very low155 Ų155125.8 Ų125.881%0.81276%0.757SS**  cis-150.2175.2-16.9-150.864.4000110
189A34.8Very low38.8Very low80 Ų80126.7 Ų126.766%0.66176%0.758SS**  trans-95.5-169.216500000110.9
190P52Low38Very low115 Ų115125.4 Ų125.475%0.74775%0.752SS**  cis-144.4-163.52.444.6-24000116.9
191S31.4Very low38.2Very low125 Ų125128 Ų12887%0.87475%0.754SS**  trans91.2171.5152.277.30000121.8
192S31.5Very low37.9Very low108 Ų108125.9 Ų125.976%0.75575%0.747SS**  trans-126.1-176-162.6-146.40000109.7
193P53.6Low36.7Very low112 Ų112126.5 Ų126.573%0.72775%0.749SS**  cis-147.2-158.114.136.4-9.6000117.2
194V33.9Very low36.7Very low119 Ų119125.4 Ų125.472%0.72175%0.749SS**  trans113.7102.8152.8-173.60000120
195I33.2Very low36.4Very low146 Ų146126.8 Ų126.875%0.74976%0.758SS**  trans40.9121.9133.5-52.8172.6000121.5
196L32.8Very low36.3Very low164 Ų164123.9 Ų123.986%0.85975%0.753SS**  -164.2159.1118.9-106.2174.2000113
197V36.1Very low36.3Very low119 Ų119126.9 Ų126.972%0.72176%0.763SS**  trans-148.3134.5-169.3161.80000107.8
198P50.6Low36Very low107 Ų107123.8 Ų123.870%0.69577%0.766SS**  -157.6137.1102.238.7-18.1000119
199T36.8Very low36.2Very low130 Ų130127.3 Ų127.380%0.79877%0.77SS**  trans56.3158.6137.168.50000121
200S36.8Very low37Very low98 Ų98128.4 Ų128.469%0.68577%0.77SS**  cis-153.9148.819.754.90000115.1
201N35.6Very low36.1Very low142 Ų142130.8 Ų130.876%0.75978%0.775SS**  trans46.4118.4138.7-62.612.4000121.5
202V33.1Very low36.1Very low121 Ų121128.2 Ų128.273%0.73377%0.768SS**  73.9122.571.61690000112.3
203T32.1Very low36.2Very low131 Ų131129.1 Ų129.180%0.80478%0.775SS**  -148.8-149.691.8-44.30000112.9
204T33.2Very low35.2Very low124 Ų124130 Ų13076%0.76178%0.777SS**  trans-160.4178.6-151.455.90000113.2
205S29.9Very low35.2Very low113 Ų113128.6 Ų128.679%0.7978%0.778SS**  trans122.5173.9139.7-150.50000118.4
206T32.8Very low36.1Very low115 Ų115127.9 Ų127.971%0.70678%0.783SS**  trans-150.5149.5-150.9-54.70000113
207Q35.4Very low36.1Very low197 Ų197129.4 Ų129.492%0.92178%0.783SS**  trans63.8142.1165.8-87.6175.2-23.700119.7
208G28.6Very low35.7Very low78 Ų78128.6 Ų128.680%0.80479%0.788SS**  trans157.298.8163.900000117.2
209Y35.2Very low34.6Very low230 Ų230128.5 Ų128.590%0.90279%0.79SS**  trans-84.1170.2155.9-87.9-76.5000108.9
210P52.8Low34.5Very low102 Ų102131.5 Ų131.566%0.66280%0.798SS**  cis-162.8-169.645.748-25000119.8
211I33.1Very low34.4Very low166 Ų166132.6 Ų132.685%0.85180%0.796SS**  trans62.9139.8162.4-53.8172.2000116.9
212G31.5Very low34.7Very low70 Ų70131.8 Ų131.872%0.72280%0.798SS**  cis147.1125.9-4.500000112.4
213S32.4Very low34.8Very low128 Ų128133.7 Ų133.790%0.89580%0.799SS**  trans-151.4171.6-178.9-167.20000112.6
214V32.9Very low34.9Very low130 Ų130133.8 Ų133.879%0.78880%0.8SS**  trans-146.7132.9-154177.70000114.7
215A34.7Very low34.8Very low89 Ų89135.1 Ų135.174%0.73680%0.801SS**  trans70.7166.3155.400000119.2
216P51.2Low34.8Very low132 Ų132135.1 Ų135.186%0.85780%0.796SS**  cis-125.2-171.34.543.1-27.9000116.7
217K32.5Very low34.6Very low196 Ų196135.6 Ų135.685%0.85280%0.799SS**  trans-112.2139-168.1166.1-170.1179-176.80110.6
218A29.7Very low34.6Very low101 Ų101134.2 Ų134.284%0.83579%0.793SS**  trans-144.9135.8166.900000111.8
219S26.8Very low35.5Very low105 Ų105135.4 Ų135.473%0.73479%0.786SS**  trans-147.6119.1170.959.30000108.8
220M35.1Very low35.1Very low194 Ų194130.8 Ų130.896%0.95678%0.776SS**  trans-159.9150.4163.947.4-159.4-177.900111.7
221N33Very low34.1Very low121 Ų121131.8 Ų131.865%0.64777%0.772SS**  trans-128.8130.5-170.1167.82.2000107.9Q223N221-Q223 PolarHBondContact OD1-N 2.84Å
222P42.8Very low34.1Very low125 Ų125131.7 Ų131.781%0.81277%0.768SS**  trans-88.2101.4165.133.4-27.6000111
223Q36.3Very low34.1Very low160 Ų160132.7 Ų132.775%0.74877%0.77SS**  trans-74.3180165.4-63.4-179.6-24.600111.3N221N221-Q223 PolarHBondContact OD1-N 2.84Å
224T33Very low34.1Very low133 Ų133134 Ų13482%0.81677%0.767SS**  trans104.1124.1168.1-51.70000113.3
225L31.9Very low34.3Very low152 Ų152131.7 Ų131.780%0.79676%0.761SS**  cis-165.8178.8-4.1-122.3-176.6000112.1
226V30.3Very low34.1Very low113 Ų113134.3 Ų134.369%0.68576%0.763SS**  trans84.7102.8147161.50000121.7
227V28.6Very low33.4Very low126 Ų126135.3 Ų135.376%0.76476%0.758SS**  69.2116.6124.5-178.90000122.3
228Q35.3Very low33.3Very low168 Ų168132.8 Ų132.879%0.78575%0.749SS**  6.9157.5126.5-12462.491.500118.4
229P46.1Very low33.3Very low102 Ų102135.9 Ų135.966%0.66274%0.744SS**  cis-157.8-173.726.245-21.8000119.9
230L26.6Very low33.6Very low133 Ų133134 Ų13470%0.69674%0.74SS**  trans80.4150.1135.4-143.360.3000123.8
231Q32.4Very low34.6Very low124 Ų124130.2 Ų130.258%0.57973%0.73SS**  trans48.3117.5156.9-93.647.7118.300119.7
232Q33.1Very low34.6Very low163 Ų163130.8 Ų130.876%0.76274%0.738SS**  79.7121.559.9-77.2-178.9-12.900116.5
233A32.3Very low35.2Very low92 Ų92129.8 Ų129.876%0.7673%0.731SS**  -175.1142.1123.500000108.7
234N32.6Very low35.1Very low156 Ų156130 Ų13083%0.83474%0.736SS**  cis71.2142.729.9-76.75.4000115.1
235A37.1Very low35.2Very low80 Ų80130.4 Ų130.466%0.66173%0.728SS**  cis-152-179.4-8.700000109.6
236N29.1Very low36Very low145 Ų145128.5 Ų128.578%0.77573%0.725SS**  -166.5125.291-133.40.3000107.9
237M36Very low36.2Very low152 Ų152131 Ų13175%0.74973%0.727SS**  64.8140.874.4-129.9103.273.200113.7
238E32.1Very low36.7Very low143 Ų143130.9 Ų130.967%0.66873%0.727SS**  cis-140.9-163.67.9-146-146.8151.600108.3
239K29.8Very low36.9Very low167 Ų167126.3 Ų126.373%0.72672%0.718SS**  cis-161.2148.29.3-179165.7-148.572.80111
240G32.5Very low36.5Very low64 Ų64129.6 Ų129.666%0.6672%0.724SS**  trans114.8150.7144.900000119.1
241P55.3Low36.8Very low115 Ų115126.1 Ų126.175%0.74772%0.72SS**  trans-139.2151.6-154.140.1-19.9000119.3
242V34.2Very low37.1Very low134 Ų134128.7 Ų128.781%0.81273%0.732SS**  trans65.3154.1134.3171.80000119.4
243P55.3Low37.3Very low104 Ų104132.4 Ų132.468%0.67574%0.739SS**  cis-123.6-176.2-23.727.7-5.9000114.4
244I33Very low37.5Very low163 Ų163135.3 Ų135.384%0.83674%0.741SS**  157.3143.1124.8-80.3166.6000112.1
245Q35Very low38.3Very low142 Ų142133.3 Ų133.366%0.66474%0.736SS**  trans-125154.7175.4-142.2-171.767.300109.1
246P48.7Very low38.3Very low113 Ų113136.4 Ų136.473%0.73475%0.747SS**  -138.2168.983.131.6-11.2000113
247K36Very low38.7Very low164 Ų164137.5 Ų137.571%0.71375%0.747SS**  cis68.3140.544.4-92.8-178179.9176.30113
248T39.3Very low38.7Very low124 Ų124138.4 Ų138.476%0.76175%0.754SS**  cis-152.5179.63.7-18.40000107
249A39.3Very low39Very low72 Ų72136.4 Ų136.460%0.59576%0.756SS**  cis-153.7155.56.900000110.1
250Q36.6Very low39.9Very low172 Ų172134.5 Ų134.580%0.80476%0.761SS**  65.9143.997.1-62.5-177.6-13.800118.1
251G34.1Very low40.2Very low59 Ų59143.5 Ų143.561%0.60878%0.775SS**  cis157171-7.200000115.2
252H38.3Very low39.8Very low178 Ų178146.7 Ų146.782%0.82478%0.78SS**  trans74.2142.9175.6-44.8-77.7000116.2
253R37.7Very low40.5Very low241 Ų241145.7 Ų145.791%0.90978%0.776SS**  cis-149.7153.9-2.1-157.4-173.1175.7178-2.3111.3
254L35.9Very low40.5Very low153 Ų153146.6 Ų146.680%0.80178%0.782SS**  trans-80.3177.2167.2-63.7173.5000111.6
255P49.7Very low41.4Very low114 Ų114144.7 Ų144.774%0.7478%0.78SS**  cis-137175.84.941.4-23.9000116.4
256V36.1Very low41.8Very low145 Ų145145.2 Ų145.288%0.87979%0.786SS**  -179.2152.1121.2147.60000110.4
257Q37.3Very low41.2Very low168 Ų168147.3 Ų147.379%0.78579%0.79SS**  trans-105.6143.1-172.7161.9-172.9-12.600111.1
258L36.2Very low41.7Very low171 Ų171145.6 Ų145.690%0.89580%0.796SS**  trans-174.7164.3142.3-102.3167.5000112.1
259S39.4Very low41.7Very low101 Ų101144.3 Ų144.371%0.70680%0.798SS**  trans-98.8162.3-161.5-56.50000114.3
260P48.4Very low42.1Very low128 Ų128146.7 Ų146.783%0.83181%0.807SS**  trans-81.9163.4-169.234-37.2000113.9
261R38.1Very low42.8Very low253 Ų253144.7 Ų144.796%0.95581%0.809SS**  trans-139.5143.9166.9-128.5-177.3-178.9-144.6-5.2114.3
262Q47.1Very low42.9Very low181 Ų181147.5 Ų147.585%0.84682%0.819SS**PPolyproline II helixtrans-85.8167-178.6-85.6171-35.700112.6
263P50.1Low42.7Very low114 Ų114146.7 Ų146.774%0.7482%0.821SS**PPolyproline II helixtrans-71.2161.9-17329.2-37.7000114.6
264P54.8Low42.6Very low122 Ų122139.1 Ų139.179%0.79281%0.805SS**PPolyproline II helixtrans-80.4141.2179.932.3-34.8000113.5
265P50.6Low42.5Very low123 Ų123141 Ų14180%0.79981%0.81SS**  trans-90.4-176.9168.537.4-35.1000112.9
266I43.4Very low41.8Very low153 Ų153140 Ų14079%0.78581%0.811SS**  trans-109166.9-174.7-55.8171.3000110.3
267L36.9Very low41.7Very low158 Ų158140.5 Ų140.583%0.82781%0.808SS**  trans84.5161.9171.8-50.2174.6000116.2
268P45.8Very low41.5Very low127 Ų127136.6 Ų136.683%0.82581%0.805SS**  cis-126.8-166.4-23.328.6-6.3000112.9
269A39Very low41.3Very low97 Ų97132.5 Ų132.580%0.80280%0.804SS**  trans-107.5147.8-179.800000114.8
270P47.7Very low41Very low122 Ų122131.4 Ų131.479%0.79281%0.809SS**  trans-107.9175.2167.4320.4000114.9
271P52.7Low40.6Very low131 Ų131134.6 Ų134.685%0.85181%0.812SS**  trans-112.7-169.8-152.343.3-37.7000118.7
272S34.7Very low40.8Very low118 Ų118129.8 Ų129.883%0.82581%0.805SS**  trans-92.1155.8-158.5-25.70000119
273N34.7Very low40.9Very low160 Ų160126.8 Ų126.886%0.85680%0.802SS**  -177161.9124.6-128.5-15.1000109.3
274S35.6Very low40.7Very low82 Ų82127.5 Ų127.557%0.57381%0.807SS**  cis-165154.89.250.70000112.2
275Q34.8Very low40Very low194 Ų194129.8 Ų129.891%0.90781%0.806SS**  trans64.6147.2161-72.1179.5-19.800117.6
276A34.3Very low39.9Very low91 Ų91129.5 Ų129.575%0.75280%0.797SS**  cis-153.7161.18.200000114.4
277N33.7Very low40.1Very low156 Ų156127.9 Ų127.983%0.83480%0.796SS**  trans57.4118.2144.8-139.731.5000124.1
278A34.1Very low40.1Very low87 Ų87126.7 Ų126.772%0.71980%0.795SS**  trans43.7109.913700000123.3
279G31.4Very low39.6Very low85 Ų85128.1 Ų128.188%0.87679%0.791SS**  102.5151.1123.300000119.5
280G33.5Very low39.6Very low78 Ų78130.4 Ų130.480%0.80479%0.789SS**  trans97.6107.2163.300000116.7
281H39.1Very low39.1Very low194 Ų194130.9 Ų130.990%0.89879%0.789SS**  trans-78.2123.7161.1-84.3-98.7000110.2
282N42.3Very low38.2Very low152 Ų152128 Ų12881%0.81378%0.784SS**  trans-170.5133.8149.1-115.4-84.6000111.4
283P49.3Very low38.2Very low119 Ų119126.5 Ų126.577%0.77378%0.778SS**PPolyproline II helixtrans-92.3119.8164.733.1-27.3000110.9
284P47.2Very low38.5Very low129 Ų129128.9 Ų128.984%0.83878%0.775SS**PPolyproline II helixtrans-78.9160.6176.731.9-34.4000113.3
285H38.7Very low38.5Very low169 Ų169132.6 Ų132.678%0.78278%0.783SS**PPolyproline II helixtrans-85.9160.8-171.1177.7-85.1000114.5
286I48.1Very low38.3Very low118 Ų118126.8 Ų126.861%0.60578%0.776SS**PPolyproline II helixtrans-52150.9173.9-60.5151000113.8V288I286-V288 HydrophobicContact CG2-CG2 3.88Å
287P48.5Very low38.3Very low118 Ų118130.8 Ų130.877%0.76678%0.784SS**  trans-114.4117.8151.734.2-23.8000112.7
288V36.8Very low38.1Very low134 Ų134128.1 Ų128.181%0.81278%0.783SS**  trans-128124.2160.4174.20000106.5I286I286-V288 HydrophobicContact CG2-CG2 3.88Å
289Q36.5Very low37.8Very low157 Ų157127 Ų12773%0.73478%0.78SS**  trans-12893.8-151.2-172.874.9-800114
290L37.9Very low37.8Very low144 Ų144131 Ų13175%0.75478%0.782SS**  trans62.3163.8162.7-71.486.7000116.6
291V36.9Very low37.7Very low132 Ų132131 Ų13180%0.877%0.774SS**  cis-128.8158.713.6176.40000107.8
292G33.5Very low37.3Very low72 Ų72130.6 Ų130.674%0.74277%0.772SS**  cis118.5166.515.100000110.5
293A35.7Very low36.6Very low85 Ų85126.7 Ų126.770%0.70276%0.761SS**  cis-167.6176.6-0.100000111.4
294R40.2Very low35.5Very low210 Ų210128 Ų12879%0.79277%0.767SS**  trans82.9145.2161.6-58177.7179.4-96-2.5118.1
295Q36.2Very low34.6Very low160 Ų160125.3 Ų125.375%0.74876%0.755SS**  cis-162.9149.1-12.6-120170-48.600113.9
296G30.4Very low34.2Very low73 Ų73125.3 Ų125.375%0.75376%0.76SS**  trans82.7160.6150.600000118.9
297L33.5Very low33.4Very low174 Ų174123 Ų12391%0.91176%0.759SS**  cis-158.8144.1-21-170.764.7000110.9
298A31.3Very low32.6Very low100 Ų100126.3 Ų126.383%0.82676%0.764SS**  trans-2.1146169.300000123.3
299G27.6Very low32.1Very low63 Ų63125.1 Ų125.165%0.64976%0.757SS**  trans148.7107.5134.500000119.2
300N31.3Very low31.9Very low171 Ų171128.3 Ų128.391%0.91476%0.762SS**  trans64.3170.4150.3-52.3-18.3000118.8
301A30.1Very low31.7Very low77 Ų77125.6 Ų125.664%0.63676%0.755SS**  cis-176.4165.9-48.600000108.1
302Q30.6Very low31.5Very low186 Ų186126.7 Ų126.787%0.86976%0.756SS**  trans70.7159.8174.2-48.9-68.9-27.300116.5
303A28.8Very low31.4Very low70 Ų70127.2 Ų127.258%0.57975%0.754SS**  cis-176.2145.4-42.500000110.6
304V26.8Very low31.1Very low147 Ų147127.4 Ų127.489%0.89176%0.755SS**  trans67.6147.1151168.60000115.1
305A28.2Very low30.7Very low72 Ų72124.6 Ų124.660%0.59576%0.755SS**  cis-148155.324.100000114.6
306L29.3Very low30.3Very low168 Ų168125.1 Ų125.188%0.8876%0.758SS**  trans44.3144.7130-56.8171.6000121.8
307A30.8Very low30.4Very low70 Ų70126.4 Ų126.458%0.57976%0.755SS**  cis-174154.7-13.100000112.1
308Q31.7Very low31.3Very low187 Ų187123.1 Ų123.187%0.87474%0.744SS**  trans65157.3154.3-70.8170.56.500117.1
309V26Very low31.4Very low110 Ų110124.4 Ų124.467%0.66775%0.747SS**  cis-145.7132.98.494.50000108.1
310R33.9Very low31.5Very low224 Ų224125 Ų12585%0.84575%0.754SS**  61130.5103.1-164.6178.5-167.6175.45.1114.8
311S33.7Very low31.5Very low86 Ų86122 Ų12260%0.60175%0.753SS**  cis-173.6154.9-6.5-111.30000111.5
312N31.4Very low31.5Very low155 Ų155122.7 Ų122.783%0.82976%0.758SS**  trans60.9163.7149.1-53.818.7000117.2
313A31.8Very low31.7Very low84 Ų84120.4 Ų120.469%0.69476%0.757SS**  cis-143.4155.21.600000109.4
314A29.4Very low31.7Very low88 Ų88122.1 Ų122.173%0.72776%0.764SS**  64.9157.398.800000116.7
315L32.1Very low31.9Very low151 Ų151120 Ų12079%0.79176%0.756SS**  cis-173.6153.3-22.1-94.6174.8000104.9
316E28.2Very low32.4Very low172 Ų172123.1 Ų123.180%0.80477%0.767SS**  cis-156.1-79.7-13-169.7-172.193.600112
317S31.4Very low33.3Very low99 Ų99121 Ų12169%0.69276%0.763SS**  trans-170.5-177.6-172.9-124.40000109.4
318P54.1Low33.4Very low106 Ų106123.2 Ų123.269%0.68878%0.775SS**  cis-134.9-176.3-14.939.5-21.9000114.9
319S32.4Very low33.3Very low126 Ų126120.6 Ų120.688%0.88178%0.777SS**  trans61126.8148.8-640000123.3
320G30.2Very low33.8Very low77 Ų77120.6 Ų120.679%0.79479%0.789SS**  trans155.287.8148.400000121.1
321A30.6Very low33.9Very low108 Ų108114.3 Ų114.389%0.89379%0.785SS**  trans64.5152.5147.700000124.3
322A31.3Very low33.9Very low91 Ų91119 Ų11975%0.75280%0.799SS**  trans87.3134.8147.700000123.8
323V33.1Very low33.9Very low138 Ų138115.8 Ų115.884%0.83679%0.794SS**  trans51.2123.1149.9-60.90000125.3
324S29Very low34Very low106 Ų106121.2 Ų121.274%0.74180%0.802SS**  63.3130.7129-155.40000124.4
325S30.7Very low34.7Very low102 Ų102123.1 Ų123.171%0.71381%0.807SS**  trans64.4108.7143.549.20000122.4
326V38.4Very low34.8Very low137 Ų137123.3 Ų123.383%0.8381%0.808SS**  trans-36.4164.1147.8-95.60000116.3
327P50.1Low35Very low123 Ų123122 Ų12280%0.79981%0.812SS**  cis-130.2174.58.331.7-10.2000117
328S31.1Very low34.9Very low118 Ų118120.7 Ų120.783%0.82581%0.814SS**  trans-88.3165.2-176-49.70000115.5
329S30.6Very low33.8Very low131 Ų131121 Ų12192%0.91682%0.819SS**  trans-150177.3170.1-85.70000112.9
330A37Very low33.7Very low111 Ų111122.2 Ų122.292%0.91782%0.815SS**  trans-88.1-174-15200000118
331A35.4Very low33.7Very low91 Ų91126 Ų12675%0.75281%0.809SS**  trans-115.3177.7-155.200000117.3
332M33Very low33.9Very low184 Ų184131.2 Ų131.291%0.90681%0.806SS**  trans-154.8160.1-178.3-82.8-63.8172.600109.6
333A32.7Very low33.7Very low88 Ų88135.9 Ų135.973%0.72781%0.809SS**  cis-150.2-119.1-9.400000111
334K34.2Very low33.7Very low198 Ų198133.7 Ų133.786%0.86180%0.8SS**  trans-151155-179.3-68.5-175.6179.6175.10112.8
335P43.9Very low33.5Very low129 Ų129135.9 Ų135.984%0.83880%0.799SS**  -149.7-168.3112.738.8-21.7000114.4
336L32.7Very low33.4Very low154 Ų154136 Ų13681%0.80680%0.799SS**  -165.8109.1-60.8-171.970.9000113.5
337V34Very low32.8Very low146 Ų146136.5 Ų136.589%0.88580%0.797SS**  trans66.2136152.1178.30000122.4
338G27.3Very low31.7Very low71 Ų71134.5 Ų134.573%0.73279%0.791SS**  trans178.1149162.600000112.7
339S31.6Very low32.4Very low113 Ų113133.8 Ų133.879%0.7978%0.784SS**  trans-165.6168.8-170.3-158.90000118.8
340L31.3Very low32.3Very low151 Ų151134.1 Ų134.179%0.79178%0.775SS**  trans80.1159.5167.1-43.8178.4000117.7
341K29.1Very low31.8Very low157 Ų157135.1 Ų135.168%0.68376%0.761SS**  cis-164.6137.78.3-147.3167.168.8-174.80117
342R34.6Very low31.5Very low216 Ų216138.2 Ų138.282%0.81576%0.762SS**  trans35138.6146.6-62.1-179.2-139.2170.5-0.2126.9
343K26.9Very low31.5Very low189 Ų189133.3 Ų133.382%0.82275%0.746SS**  -173138.5114.3-109.3-157.5165.9-1580111.5
344S34.2Very low31.3Very low93 Ų93137.2 Ų137.265%0.6575%0.749SS**  61.8142.692.4-124.70000115.6
345E24.5Very low31.2Very low152 Ų152131.9 Ų131.971%0.7174%0.742SS**  cis-169.5155.428.5-156.4143.39900113.9
346S28.5Very low30.8Very low104 Ų104131.2 Ų131.273%0.72774%0.74SS**  trans49.8163.5158-88.10000122.5
347D26.1Very low30.7Very low147 Ų147130.7 Ų130.779%0.78674%0.738SS**  cis-147.4-168.3-1.4-141.4-88.2000113.3
348A27.9Very low30.6Very low82 Ų82128 Ų12868%0.67873%0.726SS**  trans-120.7-148.1177.900000111.3
349P44.3Very low31.1Very low103 Ų103128.4 Ų128.467%0.66972%0.722SS**  cis-135179.92.945.6-28.2000117
350N28.8Very low31.5Very low137 Ų137129 Ų12973%0.73372%0.723SS**  trans60.7152.4151.2-71.221.1000120
351E25.9Very low31.4Very low132 Ų132129.7 Ų129.762%0.61773%0.725SS**  cis-167.9-175.7-9.9-112.9-48.383.900108.5
352M29.9Very low31.6Very low156 Ų156131.1 Ų131.177%0.76873%0.731SS**  cis-160.3174.3-2.649.7-176.2-177.800110.4
353S33.2Very low31.4Very low82 Ų82127.5 Ų127.557%0.57373%0.728SS**  trans14.8148.4140.5-71.70000123.3
354E29.3Very low31.5Very low169 Ų169123 Ų12379%0.7973%0.726SS**  cis-168.1165.4-3.3-124.6167.2106.100113.5
355A32.1Very low31.3Very low86 Ų86123.1 Ų123.171%0.71173%0.732SS**  trans58.6152.8147.400000120.5
356S34.7Very low32.8Very low116 Ų116121.2 Ų121.281%0.81173%0.733SS**  cis-177.4160.9-16.3-93.50000106.6
357D30.7Very low33.7Very low143 Ų143122.4 Ų122.477%0.76574%0.738SS**  cis-163.1-151.5-17.8-173.7-138000103.8
358S32.8Very low34Very low90 Ų90123.3 Ų123.363%0.62974%0.742SS**  cis-158.2154.35-66.80000111.2
359A36Very low34.4Very low79 Ų79124.7 Ų124.765%0.65375%0.747SS**  trans67.8159.6149.800000119.2M361A359-M361 HydrophobicContact CB-SD 4.39Å
360P40.1Very low34.3Very low125 Ų125126 Ų12681%0.81276%0.756SS**  cis-109.71772.640.8-31.4000115.5
361M30.8Very low34.4Very low166 Ų166123.9 Ų123.982%0.81876%0.757SS**  trans-105.7162.3-162.330.6-79.1174.300114.3A359A359-M361 HydrophobicContact CB-SD 4.39Å
362K33.4Very low35.3Very low186 Ų186122.8 Ų122.881%0.80976%0.761SS**  trans-82.4-171.7168.4-48.9178.4-174.8175.10109.5
363D28.7Very low35.2Very low141 Ų141121.9 Ų121.975%0.75477%0.765SS**  cis-164.8-163.318.8-146.2-68.5000109.8
364A29.5Very low35Very low94 Ų94126.4 Ų126.478%0.77777%0.774SS**  trans118125.3147.900000119.2
365A29.9Very low34.7Very low95 Ų95123.9 Ų123.979%0.78577%0.766SS**  trans-165-177.3161.900000107.8
366P55.8Low34.7Very low112 Ų112125.2 Ų125.273%0.72777%0.77SS**  -106.3-164.6-63.739.6-28.3000111.1
367P48.2Very low34.4Very low130 Ų130124.2 Ų124.284%0.84477%0.769SS**  -143.7-158.6116.536.3-18.8000114.7
368L32.1Very low35.4Very low166 Ų166123.4 Ų123.487%0.86977%0.771SS**  trans-112.4172.7-153.4-64.8171.2000117.3
369S36.1Very low35.3Very low111 Ų111123.2 Ų123.278%0.77678%0.775SS**  trans-61.4167.8-171.9-26.30000117.4
370P42.2Very low35.2Very low131 Ų131125.5 Ų125.585%0.85178%0.781SS**  -149-163.67041.4-20.4000116.5
371A30.8Very low34.9Very low91 Ų91126.6 Ų126.675%0.75278%0.78SS**  trans-120.9-176176.800000110.5
372P45.6Very low34.9Very low110 Ų110122.3 Ų122.371%0.71477%0.771SS**  cis-138.5-154.16.636.9-11.9000115
373T28.4Very low34.7Very low137 Ų137118.6 Ų118.684%0.8476%0.764SS**  trans72.7160.1169.972.70000118.7
374K28.6Very low34.9Very low177 Ų177121.2 Ų121.277%0.7777%0.769SS**  cis-169.2148.4-37-173.6-148.7-177-140.50109.7
375D23.3Very low35Very low116 Ų116122 Ų12262%0.6277%0.768SS**  trans92.1155.4148.2-132.1-70.2000122.6
376S30.9Very low35.2Very low113 Ų113121.9 Ų121.979%0.7977%0.768SS**  trans84.6149.6159.5-68.60000121.5
377A29.7Very low35.1Very low95 Ų95122.2 Ų122.279%0.78577%0.77SS**  trans-145.8-149.3-155.800000109.1
378P50.8Low35.1Very low127 Ų127120.7 Ų120.783%0.82576%0.76SS**  cis-114.9-157.1-1543.8-27.9000110.4
379A30.9Very low34.9Very low86 Ų86118.7 Ų118.771%0.71176%0.755SS**  cis-144.3-166.21.100000107.6
380V34.5Very low34.7Very low126 Ų126121.3 Ų121.376%0.76476%0.759SS**  cis-140.6-169.114.1-70.40000108.4
381D31.7Very low33.9Very low148 Ų148120.4 Ų120.479%0.79176%0.756SS**  cis-154.5-157.66.4-145.1-66000111
382A31.8Very low34.4Very low77 Ų77123.7 Ų123.764%0.63676%0.76SS**  trans-74.3170-176.900000117.6
383T29.3Very low33.7Very low108 Ų108124.3 Ų124.366%0.66376%0.764SS**  cis177.6133.9-30.3-91.90000110.5
384F32.6Very low33.9Very low196 Ų196124.8 Ų124.886%0.8676%0.761SS**  trans56.4160.7167.5-64.1-40000118.6
385S32.1Very low35.2Very low109 Ų109121.1 Ų121.176%0.76276%0.755SS**  cis-159.6162.5-27-101.40000108.9
386A33.8Very low35.5Very low93 Ų93122.8 Ų122.877%0.76976%0.763SS**  trans-95.6178.2176.100000112.3
387P53.5Low35.5Very low119 Ų119122.6 Ų122.677%0.77376%0.762SS**  cis-121.8-133.8-10.740.3-20.1000109.4
388P47.9Very low35.7Very low99 Ų99129.9 Ų129.964%0.64377%0.769SS**  cis-133.6172.1-2937.9-19.6000116.7
389T28.7Very low34.7Very low123 Ų123127.6 Ų127.676%0.75577%0.768SS**  trans51.1132.3147.847.60000124.7
390L30.8Very low34.8Very low166 Ų166126.9 Ų126.987%0.86977%0.77SS**  trans80.6150.4142.3-73.9171.9000122.3
391S27.1Very low34.7Very low113 Ų113130.8 Ų130.879%0.7978%0.779SS**  trans76.9116.7160.6-59.70000120.3
392L39.8Very low34.7Very low160 Ų160127.1 Ų127.184%0.83878%0.776SS**  trans-71.4155.4159-73.6163.2000110.9
393P32Very low34.9Very low123 Ų123131.6 Ų131.680%0.79979%0.789SS**  -138.1155.4120.637.2-26.9000115.3
394L32.9Very low35.3Very low147 Ų147135.5 Ų135.577%0.7780%0.797SS**  trans-108.1176.3160-92.179.9000108.1
395P56Low35.7Very low100 Ų100132.9 Ų132.965%0.64980%0.797SS**  cis-130.4-177.4-13.425.3-2.3000113
396L29.1Very low36.3Very low151 Ų151133.3 Ų133.379%0.79180%0.797SS**  169.3132.3112-88.6166.8000115
397S30.5Very low36.5Very low109 Ų109137.9 Ų137.976%0.76280%0.803SS**  trans48115.1142.5-590000122.4
398R33.7Very low36.2Very low248 Ų248136.9 Ų136.994%0.93680%0.804SS**  172.2141.5101172.6172.2-77.9-176.6-3.9113.1
399G31Very low36.1Very low78 Ų78138.3 Ų138.380%0.80481%0.81SS**  trans75.4107.815200000116.6
400G31.9Very low36.9Very low72 Ų72138.8 Ų138.874%0.74281%0.813SS**  trans-97173.8-175.300000116.1
401H33.3Very low37.8Very low208 Ų208137.6 Ų137.696%0.96380%0.801SS**  trans63.5111.2164.5-82.9-117.3000118.2
402G31.8Very low38.8Very low70 Ų70137.2 Ų137.272%0.72280%0.796SS**  cis168.3139.9-8.700000115.2
403D35.8Very low39.4Very low172 Ų172137.3 Ų137.392%0.9279%0.792SS**  trans-108.1163.7170.7-100-63.9000112
404K38.2Very low40.2Very low190 Ų190136.2 Ų136.283%0.82678%0.783SS**  trans-123.1151.8-178-56.4177.3-172176.20109
405V40.3Very low41.4Very low141 Ų141133.8 Ų133.886%0.85577%0.77SS**  trans78.1139.9-175.1-170.40000113.2
406P44.6Very low41.7Very low117 Ų117132.5 Ų132.576%0.7676%0.76SS**  cis-118141.9-27.333-17.9000112.5A408P406-A408 PolarHBondContact O-N 3.11Å
407Q37Very low43.1Very low190 Ų190131 Ų13189%0.88875%0.749SS**  trans-84116.5169.2-84.4-169-900111.7V409Q407-V409 PolarHBondContact O-N 3.04Å
408A47Very low44.7Very low97 Ų97131.3 Ų131.380%0.80274%0.742SS**  trans-75.3115.2164.100000109.6P406 V410P406-A408 PolarHBondContact O-N 3.11Å; A408-V410 PolarHBondContact O-N 3.23Å
409V46.1Very low46.2Very low129 Ų129124.3 Ų124.378%0.78272%0.722SS**  trans-79.9100.8-177.7178.60000110.4Q407 K411Q407-V409 PolarHBondContact O-N 3.04Å; V409-K411 PolarHBondContact O-N 3.15Å
410V45.1Very low47.9Very low133 Ų133129.6 Ų129.681%0.80673%0.725SS**  trans-70.51101641780000108.1A408 P412A408-V410 PolarHBondContact O-N 3.23Å; V410-P412 VanDerWaalsContact O-CD 3.3Å; V410-P412 WeakPolarHBondContact O-CD 3.45Å
411K51.3Low49.4Very low141 Ų141129.7 Ų129.761%0.61373%0.726SS**  trans-70.7114.8-179.6-173.5175.2-179.4177.70109.7V409 Q413 A428V409-K411 PolarHBondContact O-N 3.15Å; K411-Q413 PolarHBondContact O-N 3.11Å; K411-A428 PolarHBondContact NZ-O 3.47Å
412P47.5Very low50.7Low105 Ų105127.5 Ų127.568%0.68272%0.715SS**  trans-71.6118.817828.9-33000110V410 V414V410-P412 VanDerWaalsContact O-CD 3.3Å; V410-P412 WeakPolarHBondContact O-CD 3.45Å; P412-V414 PolarHBondContact O-N 3.03Å; P412-V414 VanDerWaalsContact O-N 3.17Å
413Q51.9Low52.5Low162 Ų162128.7 Ų128.776%0.75771%0.707SS**  trans-7798.5169-81.6-179.1-5000109.4K411 L415K411-Q413 PolarHBondContact O-N 3.11Å; Q413-L415 PolarHBondContact O-N 3.28Å; Q413-L415 VanDerWaalsContact O-N 3.15Å
414V48.9Very low53.6Low100 Ų100124.6 Ų124.661%0.60669%0.685SS**  trans-77.795.3173.4-175.30000108.2P412 T416P412-V414 PolarHBondContact O-N 3.03Å; P412-V414 VanDerWaalsContact O-N 3.17Å; V414-T416 HydrophobicContact CG1-CG2 3.97Å; V414-T416 PolarHBondContact O-N 3.42Å
415L57.5Low54.5Low96 Ų96122.6 Ų122.650%0.50368%0.678SS.*  trans-71.299.7174.3-173.177.9000109.2Q413 L418 V423 I424Q413-L415 PolarHBondContact O-N 3.28Å; Q413-L415 VanDerWaalsContact O-N 3.15Å; L415-L418 HydrophobicContact CD2-CD1 4.42Å; L415-V423 HydrophobicContact CD1-CG1 3.77Å; L415-I424 WeakPolarHBondContact CD1-O 3.21Å
416T64Low55.4Low73 Ų73122.2 Ų122.245%0.44867%0.667SS.*  trans-81-34.6-170.656.40000114.5V414V414-T416 HydrophobicContact CG1-CG2 3.97Å; V414-T416 PolarHBondContact O-N 3.42Å
417H58.8Low56.2Low120 Ų120119.3 Ų119.356%0.55666%0.658SS**  trans-145139.1-173.2-61.588.2000114.4
418L63.2Low57Low116 Ų116114.1 Ų114.161%0.60765%0.648SS**EExtended strand (participates in β ladder)trans-120.8126.6168-98.6160.7000107.7L415 V423L415-L418 HydrophobicContact CD2-CD1 4.42Å; L418-V423 HydrophobicContact CD2-CG2 4.11Å
419I64.9Low57.5Low101 Ų101117.5 Ų117.552%0.51865%0.648SS.*EExtended strand (participates in β ladder)trans-134.2125.1177-56.5179.4000108.2G421 F422I419-G421 VanDerWaalsContact C-N 3.26Å; I419-G421 PolarHBondContact O-N 3.06Å; I419-F422 PolarHBondContact O-N 2.87Å
420E67.8Low58.2Low188 Ų188117 Ų11788%0.87965%0.647SS**THydrogen-bonded Turntrans4344.3167.9-60.8-174.4161.700115.7
421G62.9Low58.3Low74 Ų74120 Ų12076%0.76365%0.649SS**THydrogen-bonded Turntrans92.2-5172.400000116I419I419-G421 VanDerWaalsContact C-N 3.26Å; I419-G421 PolarHBondContact O-N 3.06Å
422F59.4Low58.5Low163 Ų163119.2 Ų119.272%0.71566%0.659SS**EExtended strand (participates in β ladder)trans-104.7130.1178.5-65.8-86.8000112I419I419-F422 PolarHBondContact O-N 2.87Å
423V70Confident58.8Low94 Ų94120.9 Ų120.957%0.5767%0.667SS**EExtended strand (participates in β ladder)trans-85.2110.3177.4-176.90000109L415 L418 Q425L415-V423 HydrophobicContact CD1-CG1 3.77Å; L418-V423 HydrophobicContact CD2-CG2 4.11Å; V423-Q425 PolarHBondContact O-N 2.94Å
424I60.1Low58.6Low87 Ų87117.7 Ų117.745%0.44667%0.668SS.*  trans-83.7101174.6-55.5177.7000108.3L415L415-I424 WeakPolarHBondContact CD1-O 3.21Å
425Q56.8Low58.2Low147 Ų147116.2 Ų116.269%0.68767%0.673SS**PPolyproline II helixtrans-76.2122.5165.2-75.7-172.1-9.700109.6V423V423-Q425 PolarHBondContact O-N 2.94Å
426E59.3Low57.6Low133 Ų133118.2 Ų118.262%0.62168%0.683SS**PPolyproline II helixtrans-65.8132168.7-170.9170.8176.900109.5
427G59.8Low56.9Low56 Ų56121.6 Ų121.658%0.57770%0.698SS**PPolyproline II helixtrans-59139.8-179.400000111.4E429G427-E429 PolarHBondContact O-N 3Å; G427-E429 VanDerWaalsContact O-N 3.11Å
428A55.8Low56.2Low82 Ų82125.6 Ų125.668%0.67871%0.714SS**SBendtrans-65.4-16.5-178.100000113.6K411K411-A428 PolarHBondContact NZ-O 3.47Å
429E55.7Low55.1Low168 Ų168123.9 Ų123.979%0.78571%0.705SS**SBendtrans-115.4143.7173.4-57.6-162.4135.100110.6G427G427-E429 PolarHBondContact O-N 3Å; G427-E429 VanDerWaalsContact O-N 3.11Å
430P61.4Low54Low119 Ų119125.6 Ų125.677%0.77371%0.705SS**  trans-67.3149.1175.430.2-35.3000111.1
431F47.1Very low52.8Low195 Ų195122.7 Ų122.786%0.85570%0.696SS**  trans-50.1131.4174.1-69.6-86000111V433F431-V433 PolarHBondContact O-N 3.28Å
432P56.3Low52Low124 Ų124126.2 Ų126.281%0.80569%0.69SS**  trans-69.592.5-175.227-34.6000111.1A434P432-A434 PolarHBondContact O-N 3.33Å
433V52.7Low51.3Low140 Ų140121.4 Ų121.485%0.84868%0.681SS**  trans-57.6110.6163179.70000106.7F431 G435F431-V433 PolarHBondContact O-N 3.28Å; V433-G435 PolarHBondContact O-N 2.97Å
434A49.3Very low50.2Low96 Ų96121.7 Ų121.779%0.79368%0.678SS**  trans-45.497.8-160.200000113.7P432 L436P432-A434 PolarHBondContact O-N 3.33Å; A434-L436 VanDerWaalsContact C-N 3.32Å; A434-L436 PolarHBondContact O-N 3.13Å
435G40.4Very low49.7Very low68 Ų68122 Ų12270%0.70168%0.684SS**  trans-75.679.8-174.700000111.5V433 L437V433-G435 PolarHBondContact O-N 2.97Å; G435-L437 PolarHBondContact O-N 3.46Å
436L43.5Very low49.4Very low138 Ų138115.7 Ų115.772%0.72366%0.659SS**  trans-73.859.2173.8-149173.9000110.5A434 D439A434-L436 VanDerWaalsContact C-N 3.32Å; A434-L436 PolarHBondContact O-N 3.13Å; L436-D439 HydrophobicContact CD2-CB 3.6Å
437L50.4Low48.8Very low145 Ų145118 Ų11876%0.75966%0.662SS**  trans-102.351.6174.2-69.9-178.8000110.9G435 R440G435-L437 PolarHBondContact O-N 3.46Å; L437-R440 HydrophobicContact CD2-CG 4.2Å
438K44.3Very low48.2Very low204 Ų204120.1 Ų120.189%0.88766%0.664SS**SBendtrans-140.738.1157.3-152.8166-176.1175.10112.4
439D39.3Very low48Very low80 Ų80124.8 Ų124.843%0.42867%0.671SS.*  trans-144.850.2172.5-162.3-115.1000110.1L436 F442L436-D439 HydrophobicContact CD2-CB 3.6Å; D439-F442 WeakPolarHBondContact OD2-CD2 3.31Å
440R41.2Very low47.9Very low136 Ų136124 Ų12451%0.51367%0.673SS.*  trans-84.8-16.5-172.5-95.5-95.546.9173.4-4.7113.8L437L437-R440 HydrophobicContact CD2-CG 4.2Å
441D42.3Very low48.1Very low128 Ų128119.5 Ų119.568%0.68465%0.648SS**SBendtrans-84.1-44.5-173.8-55.8-86.8000112.7A443 L444D441-A443 PolarHBondContact O-N 3.21Å; D441-L444 PolarHBondContact O-N 3.21Å; D441-L444 VanDerWaalsContact O-N 3.07Å
442F46.3Very low49.4Very low147 Ų147114 Ų11465%0.64563%0.632SS**THydrogen-bonded Turntrans-62.7-25.5176.8-78.3-74.6000113.6D439 L444D439-F442 WeakPolarHBondContact OD2-CD2 3.31Å; F442-L444 VanDerWaalsContact C-N 3.33Å; F442-L444 PolarHBondContact O-N 3.35Å
443A45Very low50.5Low62 Ų62112 Ų11251%0.51262%0.619SS.*THydrogen-bonded Turntrans-79-8.217700000114.7D441D441-A443 PolarHBondContact O-N 3.21Å
444L46.8Very low52.3Low100 Ų100108.2 Ų108.252%0.52459%0.593SS.*THydrogen-bonded Turntrans-94.9-26.6-179.3-93.2162.7000114D441 F442 G446 R447D441-L444 PolarHBondContact O-N 3.21Å; D441-L444 VanDerWaalsContact O-N 3.07Å; F442-L444 VanDerWaalsContact C-N 3.33Å; F442-L444 PolarHBondContact O-N 3.35Å; L444-G446 PolarHBondContact O-N 2.72Å; L444-R447 PolarHBondContact O-N 3.29Å
445V49.9Very low54.4Low94 Ų94106.3 Ų106.357%0.5757%0.57SS**THydrogen-bonded Turntrans-55.8-22.4177.4-175.30000112.8F463V445-F463 HydrophobicContact CG1-CZ 4.41Å
446G50.9Low56.9Low15 Ų15108 Ų10816%0.15556%0.558CS.*THydrogen-bonded Turntrans-87.42.117900000117L444 L454L444-G446 PolarHBondContact O-N 2.72Å; G446-L454 PolarHBondContact O-N 2.88Å
447R46.9Very low59.3Low182 Ų182101.5 Ų101.569%0.68752%0.524SS*.  trans-127.4105.9178.6-79.9-173.1176.7-105.46.5112.4L444L444-R447 PolarHBondContact O-N 3.29Å
448T47.7Very low61.3Low100 Ų10099.3 Ų99.361%0.61351%0.51SS*.  trans-70.2143.7143.6490000108.5N450 G451T448-N450 PolarHBondContact O-N 3.49Å; T448-G451 PolarHBondContact O-N 3.48Å; T448-G451 WeakPolarHBondContact OG1-CA 3.46Å
449E50.2Low63.5Low179 Ų17993.9 Ų93.984%0.83648%0.484SS*.THydrogen-bonded Turntrans-53.7-35.1-164.2-166.9176.192.800114.5
450N55.1Low66.1Low152 Ų15292.5 Ų92.581%0.81348%0.48SS*.THydrogen-bonded Turntrans-119.120.8180-67.6-81.3000112.9T448T448-N450 PolarHBondContact O-N 3.49Å
451G63.8Low68.3Low25 Ų2587.7 Ų87.726%0.25847%0.473SS..SBendtrans-95.1158.5-174.700000115.6T448T448-G451 PolarHBondContact O-N 3.48Å; T448-G451 WeakPolarHBondContact OG1-CA 3.46Å
452P74.9Confident70.6Confident79 Ų7985 Ų8551%0.51346%0.464SS..PPolyproline II helixtrans-66.9144.4170.130.2-34.8000110.7L454 P465P452-L454 PolarHBondContact O-N 2.79Å; P452-P465 HydrophobicContact CG-CB 4.22Å; P452-P465 HydrophobicContact CG-CG 4.39Å
453P80.5Confident72.8Confident83 Ų8382.1 Ų82.154%0.53945%0.451SS..PPolyproline II helixtrans-62.1128.3-174.525-34.5000111.7A466P453-A466 HydrophobicContact CG-CB 4.33Å; P453-A466 WeakPolarHBondContact O-CB 3.48Å; P453-A466 PolarHBondContact O-N 2.85Å
454L90.3Very high74.9Confident59 Ų5979.8 Ų79.831%0.30943%0.431SS..EExtended strand (participates in β ladder)trans-85.9149175.9-52.6-177.8000111.2G446 P452 A464 P465G446-L454 PolarHBondContact O-N 2.88Å; P452-L454 PolarHBondContact O-N 2.79Å; L454-A464 WeakPolarHBondContact CA-O 3.44Å; L454-P465 HydrophobicContact CD2-CB 4.34Å; L454-P465 HydrophobicContact CD2-CG 3.84Å
455L91.8Very high77Confident57 Ų5776.4 Ų76.430%0.29842%0.415SS..EExtended strand (participates in β ladder)trans-125.3145.5171.3-62.3176000109.7F463 A464 A466 F469 K473L455-F463 VanDerWaalsContact O-CA 3.3Å; L455-F463 WeakPolarHBondContact O-CA 3.44Å; L455-A464 PolarHBondContact N-O 3.47Å; L455-A464 PolarHBondContact O-N 3.21Å; L455-A466 HydrophobicContact CD1-CB 3.74Å; L455-A466 HydrophobicContact CG-CB 3.95Å; L455-F469 HydrophobicContact CB-CD1 4.43Å; L455-F469 HydrophobicContact CB-CD2 4.04Å; L455-F469 HydrophobicContact CB-CE1 4.1Å; L455-F469 HydrophobicContact CB-CE2 3.69Å; L455-F469 HydrophobicContact CB-CG 4.41Å; L455-F469 HydrophobicContact CB-CZ 3.73Å; L455-F469 HydrophobicContact CD1-CB 4.46Å; L455-F469 HydrophobicContact CD1-CD1 4.45Å; L455-F469 HydrophobicContact CD1-CD2 4.36Å; L455-F469 HydrophobicContact CD1-CG 4.18Å; L455-F469 VanDerWaalsContact O-CE2 3.28Å; L455-F469 WeakPolarHBondContact O-CE2 3.39Å; L455-F469 WeakPolarHBondContact O-CZ 3.41Å; L455-K473 HydrophobicContact CD1-CB 4.15Å
456K93.8Very high78.7Confident103 Ų10373.3 Ų73.345%0.44840%0.4SS..EExtended strand (participates in β ladder)trans-83.2133.1174.8-153.5171.8-169.7160.60109.9G461 F463 E669K456-G461 VanDerWaalsContact CE-O 3.23Å; K456-G461 WeakPolarHBondContact CE-O 3.2Å; K456-G461 WeakPolarHBondContact CG-O 3.4Å; K456-F463 HydrophobicContact CB-CD1 3.93Å; K456-F463 HydrophobicContact CB-CE1 3.72Å; K456-F463 HydrophobicContact CB-CZ 4.19Å; K456-F463 HydrophobicContact CD-CE1 3.99Å; K456-F463 HydrophobicContact CD-CE2 3.89Å; K456-F463 HydrophobicContact CD-CZ 3.52Å; K456-F463 HydrophobicContact CG-CD1 4.15Å; K456-F463 HydrophobicContact CG-CD2 4.32Å; K456-F463 HydrophobicContact CG-CE1 3.85Å; K456-F463 HydrophobicContact CG-CE2 4.03Å; K456-F463 HydrophobicContact CG-CG 4.39Å; K456-F463 HydrophobicContact CG-CZ 3.8Å; K456-E669 IonicContact NZ-OE1 3.94Å; K456-E669 PolarHBondContact NZ-OE1 3.41Å
457C94.3Very high80.4Confident2 Ų277.4 Ų77.41%0.01443%0.426CS..  trans-81.8120.8176.8-178.40000110.9Y459 C460 G461 C462 F469 C476C457-Y459 PolarHBondContact O-N 3.29Å; C457-Y459 VanDerWaalsContact O-N 3.14Å; C457-C460 PolarHBondContact O-N 3.38Å; C457-C460 PolarHBondContact SG-SG 3.13Å; C457-G461 WeakPolarHBondContact O-CA 3.49Å; C457-G461 PolarHBondContact O-N 2.79Å; C457-C462 WeakPolarHBondContact CB-O 3.24Å; C457-C462 PolarHBondContact N-O 3Å; C457-F469 HydrophobicContact CB-CE1 4.28Å; C457-F469 HydrophobicContact CB-CZ 4.08Å; C457-C476 HydrophobicContact CB-CB 4.07Å; C457-C476 PolarHBondContact SG-N 3.02Å; C457-C476 VanDerWaalsContact SG-N 3.43Å
458E91.2Very high82.1Confident99 Ų9974 Ų7446%0.46342%0.418SS..THydrogen-bonded Turntrans-69.2-14.3-173.7-154-171.9126.600114.2R474 F475 Y484E458-R474 PolarHBondContact N-O 3.3Å; E458-R474 IonicContact OE1-CZ 2.81Å; E458-R474 IonicContact OE1-NH2 2.71Å; E458-R474 PolarHBondContact OE1-NH2 3.41Å; E458-R474 IonicContact OE2-CZ 2.98Å; E458-R474 IonicContact OE2-NE 3.33Å; E458-R474 PolarHBondContact OE2-NE 3.4Å; E458-R474 IonicContact OE2-NH2 2.66Å; E458-R474 PolarHBondContact OE2-NH2 3.23Å; E458-F475 HydrophobicContact CB-CE1 4.15Å; E458-Y484 HydrophobicContact CG-CE2 4.22Å; E458-Y484 VanDerWaalsContact OE1-CE2 3.28Å; E458-Y484 WeakPolarHBondContact OE1-CE2 3.44Å; E458-Y484 VanDerWaalsContact OE1-CZ 3.24Å; E458-Y484 PolarHBondContact OE1-OH 3.37Å
459Y92.4Very high84.1Confident89 Ų8969.8 Ų69.835%0.34939%0.391SS..THydrogen-bonded Turntrans-95.3-33.1176.6176.9-100.1000114C457 C480 R483C457-Y459 PolarHBondContact O-N 3.29Å; C457-Y459 VanDerWaalsContact O-N 3.14Å; Y459-C480 HydrophobicContact CD1-CB 3.84Å; Y459-C480 HydrophobicContact CG-CB 4.2Å; Y459-R483 HydrophobicContact CD1-CB 4.39Å; Y459-R483 HydrophobicContact CD2-CB 4.15Å; Y459-R483 HydrophobicContact CE1-CB 3.86Å; Y459-R483 HydrophobicContact CE1-CG 4.39Å; Y459-R483 HydrophobicContact CE2-CB 3.6Å; Y459-R483 VanDerWaalsContact CZ-CB 3.47Å; Y459-R483 VanDerWaalsContact OH-CD 3.22Å; Y459-R483 WeakPolarHBondContact OH-CD 3.3Å
460C92Very high85.5Confident51 Ų5169.5 Ų69.535%0.34538%0.382SS..THydrogen-bonded Turntrans-128.47.3-170.271.70000114.6C457 C462C457-C460 PolarHBondContact O-N 3.38Å; C457-C460 PolarHBondContact SG-SG 3.13Å; C460-C462 PolarHBondContact O-N 3.43Å; C460-C462 PolarHBondContact O-SG 3.39Å; C460-C462 VanDerWaalsContact O-SG 3.38Å; C460-C462 VanDerWaalsContact SG-SG 3.61Å
461G89.1Confident86.4Confident35 Ų3566.1 Ų66.136%0.36138%0.384SS..  trans70.9-25.9178.500000115.5K456 C457 F463K456-G461 VanDerWaalsContact CE-O 3.23Å; K456-G461 WeakPolarHBondContact CE-O 3.2Å; K456-G461 WeakPolarHBondContact CG-O 3.4Å; C457-G461 WeakPolarHBondContact O-CA 3.49Å; C457-G461 PolarHBondContact O-N 2.79Å; G461-F463 PolarHBondContact O-N 2.87Å
462C89.9Confident87Confident72 Ų7268.2 Ų68.249%0.48640%0.395SS..  trans-56.3132.6-175.5-53.80000113C457 C460C457-C462 WeakPolarHBondContact CB-O 3.24Å; C457-C462 PolarHBondContact N-O 3Å; C460-C462 PolarHBondContact O-N 3.43Å; C460-C462 PolarHBondContact O-SG 3.39Å; C460-C462 VanDerWaalsContact O-SG 3.38Å; C460-C462 VanDerWaalsContact SG-SG 3.61Å
463F92.4Very high87.6Confident87 Ų8771.3 Ų71.338%0.38240%0.4SS..EExtended strand (participates in β ladder)trans-81.2137.7166.5-66.1-92.6000110.5V445 L455 K456 G461V445-F463 HydrophobicContact CG1-CZ 4.41Å; L455-F463 VanDerWaalsContact O-CA 3.3Å; L455-F463 WeakPolarHBondContact O-CA 3.44Å; K456-F463 HydrophobicContact CB-CD1 3.93Å; K456-F463 HydrophobicContact CB-CE1 3.72Å; K456-F463 HydrophobicContact CB-CZ 4.19Å; K456-F463 HydrophobicContact CD-CE1 3.99Å; K456-F463 HydrophobicContact CD-CE2 3.89Å; K456-F463 HydrophobicContact CD-CZ 3.52Å; K456-F463 HydrophobicContact CG-CD1 4.15Å; K456-F463 HydrophobicContact CG-CD2 4.32Å; K456-F463 HydrophobicContact CG-CE1 3.85Å; K456-F463 HydrophobicContact CG-CE2 4.03Å; K456-F463 HydrophobicContact CG-CG 4.39Å; K456-F463 HydrophobicContact CG-CZ 3.8Å; G461-F463 PolarHBondContact O-N 2.87Å
464A88.7Confident88.1Confident12 Ų1272.2 Ų72.210%0.09939%0.393CS..EExtended strand (participates in β ladder)trans-149.6158.7171.900000111.2L454 L455 A466 F469L454-A464 WeakPolarHBondContact CA-O 3.44Å; L455-A464 PolarHBondContact N-O 3.47Å; L455-A464 PolarHBondContact O-N 3.21Å; A464-A466 PolarHBondContact O-N 2.91Å; A464-F469 HydrophobicContact CB-CE2 3.87Å; A464-F469 WeakPolarHBondContact O-CE2 3.21Å
465P90.4Very high88.3Confident29 Ų2970.2 Ų70.219%0.18838%0.381CS..EExtended strand (participates in β ladder)trans-55.5139.3177.8-26.634.7000112.8P452 L454 S467 Q468P452-P465 HydrophobicContact CG-CB 4.22Å; P452-P465 HydrophobicContact CG-CG 4.39Å; L454-P465 HydrophobicContact CD2-CB 4.34Å; L454-P465 HydrophobicContact CD2-CG 3.84Å; P465-S467 PolarHBondContact O-N 3.41Å; P465-Q468 HydrophobicContact CB-CG 4.44Å; P465-Q468 WeakPolarHBondContact O-CB 3.39Å; P465-Q468 PolarHBondContact O-N 3.33Å
466A86.6Confident88.4Confident29 Ų2969 Ų6924%0.2438%0.377CS..THydrogen-bonded Turntrans-57.5-18.6-177.200000114.5P453 L455 A464P453-A466 HydrophobicContact CG-CB 4.33Å; P453-A466 WeakPolarHBondContact O-CB 3.48Å; P453-A466 PolarHBondContact O-N 2.85Å; L455-A466 HydrophobicContact CD1-CB 3.74Å; L455-A466 HydrophobicContact CG-CB 3.95Å; A464-A466 PolarHBondContact O-N 2.91Å
467S86.3Confident88.2Confident102 Ų10265.9 Ų65.971%0.71337%0.368SS*.THydrogen-bonded Turntrans-74.4-23.3173.352.80000114.4P465P465-S467 PolarHBondContact O-N 3.41Å
468Q82.9Confident88Confident109 Ų10971.1 Ų71.151%0.50940%0.396SS..THydrogen-bonded Turntrans-80.9-29.5176.5-59.7-173.15.100111.8P465P465-Q468 HydrophobicContact CB-CG 4.44Å; P465-Q468 WeakPolarHBondContact O-CB 3.39Å; P465-Q468 PolarHBondContact O-N 3.33Å
469F90.2Very high88Confident12 Ų1270.4 Ų70.45%0.05340%0.399CS..SBendtrans-65.6131.8177.3-81.1-107.3000111.8L455 C457 A464 K473 F475 C476L455-F469 HydrophobicContact CB-CD1 4.43Å; L455-F469 HydrophobicContact CB-CD2 4.04Å; L455-F469 HydrophobicContact CB-CE1 4.1Å; L455-F469 HydrophobicContact CB-CE2 3.69Å; L455-F469 HydrophobicContact CB-CG 4.41Å; L455-F469 HydrophobicContact CB-CZ 3.73Å; L455-F469 HydrophobicContact CD1-CB 4.46Å; L455-F469 HydrophobicContact CD1-CD1 4.45Å; L455-F469 HydrophobicContact CD1-CD2 4.36Å; L455-F469 HydrophobicContact CD1-CG 4.18Å; L455-F469 VanDerWaalsContact O-CE2 3.28Å; L455-F469 WeakPolarHBondContact O-CE2 3.39Å; L455-F469 WeakPolarHBondContact O-CZ 3.41Å; C457-F469 HydrophobicContact CB-CE1 4.28Å; C457-F469 HydrophobicContact CB-CZ 4.08Å; A464-F469 HydrophobicContact CB-CE2 3.87Å; A464-F469 WeakPolarHBondContact O-CE2 3.21Å; F469-K473 WeakPolarHBondContact CD1-O 3.15Å; F469-F475 VanDerWaalsContact CD1-O 3.3Å; F469-F475 WeakPolarHBondContact CD1-O 3.14Å; F469-C476 HydrophobicContact CE1-CB 4.46Å; F469-C476 HydrophobicContact CE2-CB 4.16Å; F469-C476 HydrophobicContact CZ-CB 4.08Å
470R78.8Confident88.1Confident173 Ų17366.7 Ų66.765%0.65339%0.386SS*.  trans-97.9124.8-175.5-61.7-61-175156.80.8112.1S472R470-S472 VanDerWaalsContact C-N 3.35Å; R470-S472 PolarHBondContact O-N 3.44Å; R470-S472 PolarHBondContact O-OG 3.31Å
471G74.8Confident88Confident81 Ų8165.6 Ų65.684%0.83538%0.38SS*.SBendtrans60.3-82.816800000114.4K473G471-K473 PolarHBondContact O-N 2.89Å
472S76.7Confident88.1Confident70 Ų7071.3 Ų71.349%0.4940%0.395SS..SBendtrans-62.6-12.8-178.665.30000116.4R470 R474R470-S472 VanDerWaalsContact C-N 3.35Å; R470-S472 PolarHBondContact O-N 3.44Å; R470-S472 PolarHBondContact O-OG 3.31Å; S472-R474 PolarHBondContact O-N 3.21Å
473K85.9Confident88Confident143 Ų14374.9 Ų74.962%0.62240%0.398SS*.SBendtrans56.96.6-172.6-64-175.1179.1-179.90116.8L455 F469 G471L455-K473 HydrophobicContact CD1-CB 4.15Å; F469-K473 WeakPolarHBondContact CD1-O 3.15Å; G471-K473 PolarHBondContact O-N 2.89Å
474R92.5Very high87.8Confident103 Ų10373.4 Ų73.439%0.38939%0.391SS..SBendtrans-94.7-20.9179.8-68171.166-150.42.9114.9E458 S472 Y484E458-R474 PolarHBondContact N-O 3.3Å; E458-R474 IonicContact OE1-CZ 2.81Å; E458-R474 IonicContact OE1-NH2 2.71Å; E458-R474 PolarHBondContact OE1-NH2 3.41Å; E458-R474 IonicContact OE2-CZ 2.98Å; E458-R474 IonicContact OE2-NE 3.33Å; E458-R474 PolarHBondContact OE2-NE 3.4Å; E458-R474 IonicContact OE2-NH2 2.66Å; E458-R474 PolarHBondContact OE2-NH2 3.23Å; S472-R474 PolarHBondContact O-N 3.21Å; R474-Y484 VanDerWaalsContact NH2-CZ 3.28Å; R474-Y484 PolarHBondContact NH2-OH 3.12Å
475F93.9Very high87.5Confident16 Ų1677.8 Ų77.87%0.0741%0.413CS..  trans-129.4131.4-174-49.6-66.5000112.4E458 F469 S477 C480 A481 Y484E458-F475 HydrophobicContact CB-CE1 4.15Å; F469-F475 VanDerWaalsContact CD1-O 3.3Å; F469-F475 WeakPolarHBondContact CD1-O 3.14Å; F475-S477 PolarHBondContact O-N 3.01Å; F475-C480 HydrophobicContact CB-CB 4.12Å; F475-C480 HydrophobicContact CD1-CB 4.43Å; F475-A481 HydrophobicContact CB-CB 4.01Å; F475-A481 HydrophobicContact CD2-CB 3.54Å; F475-A481 HydrophobicContact CE2-CB 4.23Å; F475-A481 HydrophobicContact CG-CB 3.84Å; F475-Y484 HydrophobicContact CE1-CD1 4.03Å; F475-Y484 AromaticContact CE1-CD2 3.6Å; F475-Y484 HydrophobicContact CE1-CD2 3.6Å; F475-Y484 HydrophobicContact CE1-CE2 4.22Å; F475-Y484 AromaticContact CE1-CG 3.48Å; F475-Y484 HydrophobicContact CE1-CG 3.48Å; F475-Y484 VanDerWaalsContact CE1-CG 3.48Å; F475-Y484 AromaticContact CZ-CD1 3.57Å; F475-Y484 HydrophobicContact CZ-CD1 3.57Å; F475-Y484 AromaticContact CZ-CD2 3.99Å; F475-Y484 HydrophobicContact CZ-CD2 3.99Å; F475-Y484 HydrophobicContact CZ-CE1 4.06Å; F475-Y484 HydrophobicContact CZ-CE2 4.41Å; F475-Y484 AromaticContact CZ-CG 3.54Å; F475-Y484 HydrophobicContact CZ-CG 3.54Å
476C92.7Very high86.9Confident32 Ų3280.1 Ų80.122%0.21643%0.426CS..SBendtrans-69.5-17.3176.6650000113.4C457 F469 C480C457-C476 HydrophobicContact CB-CB 4.07Å; C457-C476 PolarHBondContact SG-N 3.02Å; C457-C476 VanDerWaalsContact SG-N 3.43Å; F469-C476 HydrophobicContact CE1-CB 4.46Å; F469-C476 HydrophobicContact CE2-CB 4.16Å; F469-C476 HydrophobicContact CZ-CB 4.08Å; C476-C480 VanDerWaalsContact SG-SG 3.68Å
477S91.1Very high86.2Confident37 Ų3782.1 Ų82.126%0.25944%0.438SS..SBendtrans-152.1158-178.966.40000113.4F475 T479 C480 A481F475-S477 PolarHBondContact O-N 3.01Å; S477-T479 PolarHBondContact O-N 3.33Å; S477-C480 WeakPolarHBondContact O-CB 3.34Å; S477-C480 PolarHBondContact O-N 3.23Å; S477-C480 WeakPolarHBondContact OG-CB 3.46Å; S477-C480 PolarHBondContact OG-N 3.09Å; S477-C480 PolarHBondContact OG-SG 3.11Å; S477-A481 PolarHBondContact O-N 3.07Å
478N89.3Confident85.2Confident113 Ų11380 Ų8060%0.60442%0.423SS*.Hα-helixtrans-60.2-29.6171.1-80.1-23.6000112.5K482N478-K482 WeakPolarHBondContact O-CB 3.29Å; N478-K482 VanDerWaalsContact O-CG 3.29Å; N478-K482 WeakPolarHBondContact O-CG 3.17Å; N478-K482 PolarHBondContact O-N 3.23Å
479T91.9Very high84.5Confident84 Ų8477.3 Ų77.352%0.51542%0.416SS..Hα-helixtrans-66.2-45.8175.5-51.20000110.8S477 K482 R483S477-T479 PolarHBondContact O-N 3.33Å; T479-K482 PolarHBondContact O-N 3.43Å; T479-R483 WeakPolarHBondContact O-CG 3.39Å; T479-R483 PolarHBondContact O-N 2.98Å
480C92.9Very high83.1Confident11 Ų1182.7 Ų82.77%0.07444%0.441CS..Hα-helixtrans-60.9-48.4174.8-69.90000111.6Y459 F475 C476 S477 K482 R483 Y484Y459-C480 HydrophobicContact CD1-CB 3.84Å; Y459-C480 HydrophobicContact CG-CB 4.2Å; F475-C480 HydrophobicContact CB-CB 4.12Å; F475-C480 HydrophobicContact CD1-CB 4.43Å; C476-C480 VanDerWaalsContact SG-SG 3.68Å; S477-C480 WeakPolarHBondContact O-CB 3.34Å; S477-C480 PolarHBondContact O-N 3.23Å; S477-C480 WeakPolarHBondContact OG-CB 3.46Å; S477-C480 PolarHBondContact OG-N 3.09Å; S477-C480 PolarHBondContact OG-SG 3.11Å; C480-K482 PolarHBondContact O-N 3.04Å; C480-R483 PolarHBondContact O-N 3.18Å; C480-Y484 WeakPolarHBondContact O-CB 3.45Å; C480-Y484 PolarHBondContact O-N 3.15Å
481A91.5Very high82.1Confident28 Ų2881.8 Ų81.823%0.23144%0.444CS..Hα-helixtrans-59.4-42.9178.100000112.9F475 S477 N485F475-A481 HydrophobicContact CB-CB 4.01Å; F475-A481 HydrophobicContact CD2-CB 3.54Å; F475-A481 HydrophobicContact CE2-CB 4.23Å; F475-A481 HydrophobicContact CG-CB 3.84Å; S477-A481 PolarHBondContact O-N 3.07Å; A481-N485 WeakPolarHBondContact O-CB 3.25Å; A481-N485 PolarHBondContact O-N 3.41Å
482K89.8Confident81.2Confident155 Ų15584.9 Ų84.967%0.67443%0.432SS*.Hα-helixtrans-65.4-47.8176.8-76.7177.9177.8-174.40112.1N478 T479 C480 N485 V486N478-K482 WeakPolarHBondContact O-CB 3.29Å; N478-K482 VanDerWaalsContact O-CG 3.29Å; N478-K482 WeakPolarHBondContact O-CG 3.17Å; N478-K482 PolarHBondContact O-N 3.23Å; T479-K482 PolarHBondContact O-N 3.43Å; C480-K482 PolarHBondContact O-N 3.04Å; K482-N485 PolarHBondContact O-N 2.92Å; K482-V486 WeakPolarHBondContact O-CG2 3.47Å; K482-V486 PolarHBondContact O-N 3.3Å; K482-V486 VanDerWaalsContact O-N 3.08Å
483R88.3Confident80.1Confident146 Ų14689.2 Ų89.255%0.55144%0.442SS*.Hα-helixtrans-63.5-41.9179.6-70.5-174.7-177.5-170.90.1111.9Y459 T479 C480 V486 S487Y459-R483 HydrophobicContact CD1-CB 4.39Å; Y459-R483 HydrophobicContact CD2-CB 4.15Å; Y459-R483 HydrophobicContact CE1-CB 3.86Å; Y459-R483 HydrophobicContact CE1-CG 4.39Å; Y459-R483 HydrophobicContact CE2-CB 3.6Å; Y459-R483 VanDerWaalsContact CZ-CB 3.47Å; Y459-R483 VanDerWaalsContact OH-CD 3.22Å; Y459-R483 WeakPolarHBondContact OH-CD 3.3Å; T479-R483 WeakPolarHBondContact O-CG 3.39Å; T479-R483 PolarHBondContact O-N 2.98Å; C480-R483 PolarHBondContact O-N 3.18Å; R483-V486 PolarHBondContact O-N 3.41Å; R483-S487 PolarHBondContact O-N 3.2Å
484Y87.6Confident78.3Confident56 Ų5686.8 Ų86.822%0.2244%0.443CS..Hα-helixtrans-59.9-47.7174.3-174.1-80.4000112.1E458 R474 F475 C480 V486 S487 C488E458-Y484 HydrophobicContact CG-CE2 4.22Å; E458-Y484 VanDerWaalsContact OE1-CE2 3.28Å; E458-Y484 WeakPolarHBondContact OE1-CE2 3.44Å; E458-Y484 VanDerWaalsContact OE1-CZ 3.24Å; E458-Y484 PolarHBondContact OE1-OH 3.37Å; R474-Y484 VanDerWaalsContact NH2-CZ 3.28Å; R474-Y484 PolarHBondContact NH2-OH 3.12Å; F475-Y484 HydrophobicContact CE1-CD1 4.03Å; F475-Y484 AromaticContact CE1-CD2 3.6Å; F475-Y484 HydrophobicContact CE1-CD2 3.6Å; F475-Y484 HydrophobicContact CE1-CE2 4.22Å; F475-Y484 AromaticContact CE1-CG 3.48Å; F475-Y484 HydrophobicContact CE1-CG 3.48Å; F475-Y484 VanDerWaalsContact CE1-CG 3.48Å; F475-Y484 AromaticContact CZ-CD1 3.57Å; F475-Y484 HydrophobicContact CZ-CD1 3.57Å; F475-Y484 AromaticContact CZ-CD2 3.99Å; F475-Y484 HydrophobicContact CZ-CD2 3.99Å; F475-Y484 HydrophobicContact CZ-CE1 4.06Å; F475-Y484 HydrophobicContact CZ-CE2 4.41Å; F475-Y484 AromaticContact CZ-CG 3.54Å; F475-Y484 HydrophobicContact CZ-CG 3.54Å; C480-Y484 WeakPolarHBondContact O-CB 3.45Å; C480-Y484 PolarHBondContact O-N 3.15Å; Y484-V486 VanDerWaalsContact C-N 3.31Å; Y484-V486 PolarHBondContact O-N 2.94Å; Y484-S487 WeakPolarHBondContact O-CB 3.44Å; Y484-S487 PolarHBondContact O-N 3.04Å; Y484-S487 VanDerWaalsContact O-N 3.1Å; Y484-C488 WeakPolarHBondContact CE1-SG 3.47Å; Y484-C488 PolarHBondContact O-N 3.33Å
485N84.2Confident76.5Confident105 Ų10585.3 Ų85.356%0.56145%0.448SS*.Hα-helixtrans-60.9-39.2179.3-177.8-96.5000112.5A481 K482 S489A481-N485 WeakPolarHBondContact O-CB 3.25Å; A481-N485 PolarHBondContact O-N 3.41Å; K482-N485 PolarHBondContact O-N 2.92Å; N485-S489 VanDerWaalsContact O-CB 3.29Å; N485-S489 WeakPolarHBondContact O-CB 3.42Å; N485-S489 PolarHBondContact O-N 3.44Å; N485-S489 VanDerWaalsContact O-N 3.08Å; N485-S489 PolarHBondContact O-OG 3.02Å
486V76.1Confident74.3Confident78 Ų7893.7 Ų93.747%0.47348%0.479SS..Hα-helixtrans-64.8-43.9172.7173.30000111.2K482 R483 Y484 S489 Q490K482-V486 WeakPolarHBondContact O-CG2 3.47Å; K482-V486 PolarHBondContact O-N 3.3Å; K482-V486 VanDerWaalsContact O-N 3.08Å; R483-V486 PolarHBondContact O-N 3.41Å; Y484-V486 VanDerWaalsContact C-N 3.31Å; Y484-V486 PolarHBondContact O-N 2.94Å; V486-S489 WeakPolarHBondContact O-CB 3.38Å; V486-S489 PolarHBondContact O-N 3.17Å; V486-Q490 PolarHBondContact O-N 3.23Å
487S73.6Confident72.2Confident70 Ų7095.3 Ų95.349%0.4950%0.501SS..Hα-helixtrans-58.8-52.8178.7-165.50000112.2R483 Y484 S489 Q490 H491R483-S487 PolarHBondContact O-N 3.2Å; Y484-S487 WeakPolarHBondContact O-CB 3.44Å; Y484-S487 PolarHBondContact O-N 3.04Å; Y484-S487 VanDerWaalsContact O-N 3.1Å; S487-S489 PolarHBondContact O-N 3.4Å; S487-Q490 PolarHBondContact O-N 3.18Å; S487-Q490 VanDerWaalsContact O-N 3.1Å; S487-H491 PolarHBondContact O-N 3.22Å
488C64.7Low70.2Confident57 Ų57105 Ų10539%0.38553%0.532SS..Hα-helixtrans-61.6-34176-63.40000112.5Y484 Q490 H491 Y492Y484-C488 WeakPolarHBondContact CE1-SG 3.47Å; Y484-C488 PolarHBondContact O-N 3.33Å; C488-Q490 VanDerWaalsContact C-N 3.33Å; C488-Q490 PolarHBondContact O-N 2.92Å; C488-H491 PolarHBondContact O-N 3.21Å; C488-Y492 WeakPolarHBondContact O-CB 3.26Å; C488-Y492 PolarHBondContact O-N 3.48Å
489S68.3Low67.8Low53 Ų53105.6 Ų105.637%0.37155%0.545SS..Hα-helixtrans-69.4-27.4176.3-61.60000113.4N485 V486 S487 K493N485-S489 VanDerWaalsContact O-CB 3.29Å; N485-S489 WeakPolarHBondContact O-CB 3.42Å; N485-S489 PolarHBondContact O-N 3.44Å; N485-S489 VanDerWaalsContact O-N 3.08Å; N485-S489 PolarHBondContact O-OG 3.02Å; V486-S489 WeakPolarHBondContact O-CB 3.38Å; V486-S489 PolarHBondContact O-N 3.17Å; S487-S489 PolarHBondContact O-N 3.4Å; S489-K493 WeakPolarHBondContact O-CD 3.24Å; S489-K493 VanDerWaalsContact O-CG 3.28Å; S489-K493 WeakPolarHBondContact O-CG 3.43Å; S489-K493 PolarHBondContact O-N 3.36Å
490Q60.3Low65.6Low126 Ų126105.6 Ų105.659%0.58956%0.562SS**Hα-helixtrans-75.3-46170.2-69-175.916.600110.6V486 S487 C488 Y492 K493 S494V486-Q490 PolarHBondContact O-N 3.23Å; S487-Q490 PolarHBondContact O-N 3.18Å; S487-Q490 VanDerWaalsContact O-N 3.1Å; C488-Q490 VanDerWaalsContact C-N 3.33Å; C488-Q490 PolarHBondContact O-N 2.92Å; Q490-Y492 VanDerWaalsContact C-N 3.32Å; Q490-Y492 PolarHBondContact O-N 2.74Å; Q490-K493 WeakPolarHBondContact O-CA 3.49Å; Q490-K493 WeakPolarHBondContact O-CB 3.46Å; Q490-K493 PolarHBondContact O-N 3.35Å; Q490-S494 PolarHBondContact O-N 3Å; Q490-S494 PolarHBondContact O-OG 3.03Å
491H59Low62.9Low153 Ų153109.1 Ų109.171%0.70860%0.6SS**Hα-helixtrans-58-42178.9-155.4-117.8000112.5S487 C488 K493 S494 S495S487-H491 PolarHBondContact O-N 3.22Å; C488-H491 PolarHBondContact O-N 3.21Å; H491-K493 VanDerWaalsContact C-N 3.31Å; H491-K493 PolarHBondContact O-N 3.2Å; H491-S494 PolarHBondContact O-N 2.65Å; H491-S495 PolarHBondContact O-N 2.89Å
492Y54.1Low60.5Low146 Ų146111.1 Ų111.157%0.57362%0.623SS**Hα-helixtrans-69.2-22.1174.5-174.8-97.3000114.2C488 Q490 S495 R496C488-Y492 WeakPolarHBondContact O-CB 3.26Å; C488-Y492 PolarHBondContact O-N 3.48Å; Q490-Y492 VanDerWaalsContact C-N 3.32Å; Q490-Y492 PolarHBondContact O-N 2.74Å; Y492-S495 PolarHBondContact O-OG 2.75Å; Y492-S495 VanDerWaalsContact O-OG 3.12Å; Y492-R496 PolarHBondContact OH-NH2 2.83Å
493K54Low58.4Low161 Ų161109.5 Ų109.570%0.763%0.628SS**Hα-helixtrans-80.8-42.3174.6-77.7175.2178.6-175.30111.6S489 Q490 H491 S495 R496S489-K493 WeakPolarHBondContact O-CD 3.24Å; S489-K493 VanDerWaalsContact O-CG 3.28Å; S489-K493 WeakPolarHBondContact O-CG 3.43Å; S489-K493 PolarHBondContact O-N 3.36Å; Q490-K493 WeakPolarHBondContact O-CA 3.49Å; Q490-K493 WeakPolarHBondContact O-CB 3.46Å; Q490-K493 PolarHBondContact O-N 3.35Å; H491-K493 VanDerWaalsContact C-N 3.31Å; H491-K493 PolarHBondContact O-N 3.2Å; K493-S495 VanDerWaalsContact C-N 3.29Å; K493-S495 PolarHBondContact O-N 3.06Å; K493-R496 PolarHBondContact O-N 3.19Å
494S49.2Very low56.3Low93 Ų93108.6 Ų108.665%0.6564%0.641SS**Hα-helixtrans-63.1-33.6177.4-60.10000112.8Q490 H491 R496 G497Q490-S494 PolarHBondContact O-N 3Å; Q490-S494 PolarHBondContact O-OG 3.03Å; H491-S494 PolarHBondContact O-N 2.65Å; S494-R496 PolarHBondContact O-N 2.86Å; S494-G497 PolarHBondContact O-N 3.48Å
495S54Low53.9Low71 Ų71113.8 Ų113.850%0.49767%0.672SS.*G310 helixtrans-65.8-17-179.266.70000114.9H491 Y492 K493 G497H491-S495 PolarHBondContact O-N 2.89Å; Y492-S495 PolarHBondContact O-OG 2.75Å; Y492-S495 VanDerWaalsContact O-OG 3.12Å; K493-S495 VanDerWaalsContact C-N 3.29Å; K493-S495 PolarHBondContact O-N 3.06Å; S495-G497 VanDerWaalsContact C-N 3.3Å
496R47.7Very low52.1Low193 Ų193114 Ų11473%0.72868%0.679SS**G310 helixtrans-81.5-4.8172.2-67-166.3-179.4-153.80.6114Y492 K493 S494Y492-R496 PolarHBondContact OH-NH2 2.83Å; K493-R496 PolarHBondContact O-N 3.19Å; S494-R496 PolarHBondContact O-N 2.86Å
497G47.8Very low50.5Low65 Ų65116.6 Ų116.667%0.6770%0.698SS**G310 helixtrans-86.6-13.1-176.800000116S494 S495S494-G497 PolarHBondContact O-N 3.48Å; S495-G497 VanDerWaalsContact C-N 3.3Å
498R50.8Low48.8Very low242 Ų242120.4 Ų120.491%0.91371%0.713SS**  trans-144.791.6-177.3-74.4-169.2174.1-155.7-0.3113
499S39.1Very low47.9Very low124 Ų124122.5 Ų122.587%0.86773%0.726SS**  trans-137.476165.6-66.10000110.4
500G45.4Very low46.4Very low85 Ų85125.6 Ų125.688%0.87674%0.743SS**  trans-15997.417800000110.3
501G36.1Very low45.2Very low84 Ų84127 Ų12787%0.86675%0.749SS**  trans143.176.7-172.900000111.8
502G40.6Very low44Very low70 Ų70126 Ų12672%0.72275%0.749SS**PPolyproline II helixtrans-95.2148.2169.100000111.2
503P46.2Very low43Very low121 Ų121124.3 Ų124.379%0.78676%0.758SS**PPolyproline II helixtrans-72.2159.717531.2-35.1000112.2
504P43.3Very low42.1Very low127 Ų127120.7 Ų120.783%0.82576%0.758SS**PPolyproline II helixtrans-78.6161.4-173.732.4-36.7000114.1
505L38.3Very low41.7Very low165 Ų165125.5 Ų125.586%0.86477%0.768SS**  trans-124.2155.1174.5-78.1169.7000111.3
506P44.8Very low41Very low110 Ų110132 Ų13271%0.71478%0.781SS**  trans-74.8168.2-176.430.6-35.8000114.5
507P43Very low40.4Very low133 Ų133133.1 Ų133.186%0.86479%0.785SS**  trans-80.3170.9-167.432.8-37.8000115.6
508N37.8Very low39.6Very low150 Ų150133.7 Ų133.780%0.80279%0.791SS**  trans-138.4138.8-161.6-176.157.9000113.6
509P47.1Very low39.2Very low101 Ų101128.3 Ų128.366%0.65679%0.787SS**  trans-120.2156.9153.939.1-28.1000111.2
510T35.6Very low39.5Very low118 Ų118128.3 Ų128.372%0.72479%0.788SS**  cis-155.5151.113-150000111.9
511E34.8Very low39.3Very low156 Ų156134.7 Ų134.773%0.72979%0.785SS**  trans54.5140.2148.3-87.7-173.2101.400126.8
512N34.3Very low39.5Very low132 Ų132141.3 Ų141.371%0.70678%0.784SS**  trans65.1123.2143.8-62.6-22.4000121.1
513S34.4Very low38.9Very low110 Ų110141.2 Ų141.277%0.76978%0.783SS**  cis175.3-178.622.457.10000112.2
514A35Very low38.4Very low84 Ų84140.7 Ų140.769%0.69478%0.782SS**  trans70.586.1152.400000123.8
515K39.7Very low38.7Very low195 Ų195139.1 Ų139.185%0.84877%0.774SS**  50113.7121.7-67.4168.4-179.1166.90123.1
516R39.6Very low38.5Very low208 Ų208138.3 Ų138.379%0.78577%0.77SS**  trans72.2114.8130.4-61.7-160-159-88.816.8123.4
517R34.3Very low38.1Very low216 Ų216137.6 Ų137.682%0.81577%0.768SS**  85.170.2117.5-156-163.1-67.4-124.75.7122.3
518G31.6Very low38Very low76 Ų76136.4 Ų136.478%0.78476%0.759SS**  trans72.5-178.4142.300000119.1
519P42.8Very low37.9Very low129 Ų129136.9 Ų136.984%0.83875%0.75SS**  cis-117.3169.8-5.841.2-29.4000114.5
520S44.6Very low37.4Very low125 Ų125136.7 Ų136.787%0.87475%0.752SS**  trans-97.8112.9178.3-175.70000114.2
521R40.7Very low37.4Very low219 Ų219138 Ų13883%0.82675%0.747SS**  trans-160.5152.7166.2-66.8-162.6-156.5-95.710.2106.6
522R40.7Very low37.3Very low223 Ų223136.9 Ų136.984%0.84275%0.751SS**  cis-168.7154.3-2.3151.4-164.1-70.6-94.88.7107.6
523G27.8Very low37.2Very low67 Ų67135.3 Ų135.369%0.69175%0.75SS**  trans95.2123.5162.600000113.5
524S36.8Very low36.9Very low110 Ų110135.9 Ų135.977%0.76975%0.754SS**  cis80.7124.712.2-162.20000118.2
525S48.8Very low36.7Very low95 Ų95141.4 Ų141.466%0.66476%0.762SS**  trans64.9119144.151.50000121.9
526N35.1Very low36.2Very low147 Ų147140.3 Ų140.379%0.78676%0.76SS**  -156.5152.7107.8-94.6-12.9000109.5
527S35.4Very low35.8Very low95 Ų95136.8 Ų136.866%0.66476%0.756SS**  cis81.7143.636.7-153.50000111.6
528T41.4Very low35.6Very low109 Ų109131.1 Ų131.167%0.66975%0.75SS**  cis-167.3166.227.6-32.50000113.9
529Y34.5Very low35.4Very low159 Ų159133.1 Ų133.162%0.62475%0.746SS**  trans85.1157140.2-124.6-143.6000121K531Y529-K531 HydrophobicContact CE1-CB 4.02Å; Y529-K531 HydrophobicContact CE1-CD 3.76Å; Y529-K531 HydrophobicContact CE1-CG 4.27Å; Y529-K531 HydrophobicContact CE2-CB 4.31Å; Y529-K531 VanDerWaalsContact OH-CD 3.29Å; Y529-K531 WeakPolarHBondContact OH-CD 3.46Å; Y529-K531 WeakPolarHBondContact OH-CE 3.5Å; Y529-K531 WeakPolarHBondContact OH-CG 3.41Å; Y529-K531 PolarHBondContact OH-NZ 3.06Å
530S36.6Very low34.6Very low98 Ų98135.3 Ų135.369%0.68574%0.743SS**  cis-141.8136.821.7-54.80000114.1
531K37.1Very low33.5Very low146 Ų146133.4 Ų133.464%0.63573%0.728SS**  75.8127.294.3-153175.8-157.2139.40114.1Y529Y529-K531 HydrophobicContact CE1-CB 4.02Å; Y529-K531 HydrophobicContact CE1-CD 3.76Å; Y529-K531 HydrophobicContact CE1-CG 4.27Å; Y529-K531 HydrophobicContact CE2-CB 4.31Å; Y529-K531 VanDerWaalsContact OH-CD 3.29Å; Y529-K531 WeakPolarHBondContact OH-CD 3.46Å; Y529-K531 WeakPolarHBondContact OH-CE 3.5Å; Y529-K531 WeakPolarHBondContact OH-CG 3.41Å; Y529-K531 PolarHBondContact OH-NZ 3.06Å
532V31.8Very low32.9Very low132 Ų132131 Ų13180%0.873%0.726SS**  -141.4153.157.9-74.20000111.6
533S32.7Very low32.3Very low98 Ų98124.9 Ų124.969%0.68572%0.717SS**  cis87.3104.335.9-177.70000116.5
534S27.1Very low32.5Very low123 Ų123129.6 Ų129.686%0.8672%0.722SS**  trans-176.3174.8135.5-83.50000113
535K31.8Very low32.1Very low199 Ų199129.8 Ų129.887%0.86572%0.723SS**  trans-134.6141.3-163.1-46.4168-175.7173.60114
536H30.1Very low31.4Very low173 Ų173130.5 Ų130.580%0.80173%0.728SS**  trans-163.3139.3145.8-135.4-115.2000106.7
537L30.5Very low31.3Very low134 Ų134133.6 Ų133.670%0.70273%0.728SS**  cis68.8143.237.8-61.6173.8000112.8
538S29.6Very low31.2Very low97 Ų97134.7 Ų134.768%0.67874%0.736SS**  cis-171.9-164.6-15.5-177.10000108
539V28Very low30.9Very low118 Ų118135.9 Ų135.972%0.71573%0.734SS**  trans106.6126.5144.4-1680000118.3
540K25Very low30.8Very low175 Ų175135.6 Ų135.676%0.76174%0.743SS**  trans69.1133.8164.1-98.233.3-174.5168.70116.2
541C22.1Very low30.7Very low85 Ų85137.7 Ų137.757%0.57475%0.752SS**  cis68.2135.240.1-55.30000112.6
542H28.3Very low30.8Very low167 Ų167135.9 Ų135.977%0.77376%0.757SS**  cis-159.8-169.9-7.1-109.1-48.8000107.6
543S28.7Very low30.8Very low95 Ų95134.7 Ų134.766%0.66476%0.755SS**  trans77139.1157.1-65.10000119.1
544E30.1Very low30.8Very low167 Ų167138.2 Ų138.278%0.7876%0.761SS**  cis-167.5166.6-23.646.3-156.347.200110.8
545S29.8Very low31.2Very low113 Ų113135.3 Ų135.379%0.7975%0.751SS**  trans68.9146.4171.7-110.40000117.6
546S33.4Very low31.4Very low110 Ų110134 Ų13477%0.76975%0.747SS**  cis-156.7174.6-18.6-113.70000111.5
547R34.2Very low31.6Very low212 Ų212134 Ų13480%0.875%0.748SS**  trans-92153.3-174.9-54159.773.7149.53.6111.9E549R547-E549 IonicContact CZ-OE1 3.69Å; R547-E549 IonicContact NE-OE1 3.2Å; R547-E549 IonicContact NH2-OE1 2.61Å; R547-E549 PolarHBondContact NH2-OE1 3.02Å
548S31.8Very low32Very low118 Ų118134.9 Ų134.983%0.82575%0.748SS**  trans-155.5130136.955.10000110
549E35.8Very low32.4Very low134 Ų134138.4 Ų138.463%0.62675%0.754SS**  trans-86.8148.5158.5-64.7141-116.600105.4R547R547-E549 IonicContact CZ-OE1 3.69Å; R547-E549 IonicContact NE-OE1 3.2Å; R547-E549 IonicContact NH2-OE1 2.61Å; R547-E549 PolarHBondContact NH2-OE1 3.02Å
550D32.4Very low32.6Very low153 Ų153140.2 Ų140.282%0.81876%0.76SS**  158.3176.695.6-89.5-59.8000110.9
551V34.5Very low32.9Very low143 Ų143138.1 Ų138.187%0.86776%0.757SS**  trans91141.9157.6103.30000120.9
552S38.7Very low33.3Very low107 Ų107138 Ų13875%0.74876%0.757SS**  trans-85.7164.1178.5-43.20000113.4
553S32.2Very low33.6Very low108 Ų108134.9 Ų134.976%0.75575%0.754SS**  -172176.3110.4-112.60000113.2
554E32.1Very low33.7Very low171 Ų171135.8 Ų135.880%0.79976%0.761SS**  trans-80.6-179.1176.357-92.778.400114.6
555G37Very low33.8Very low63 Ų63135.4 Ų135.465%0.64976%0.763SS**  trans118.1108.2-179.600000111.3
556E35.6Very low33.7Very low170 Ų170134.4 Ų134.479%0.79476%0.756SS**  7911750.9-60.3-179.9171.400113.7
557E34.8Very low33.4Very low175 Ų175140.1 Ų140.182%0.81876%0.761SS**  trans64154.3150.6-60.1173.3-159.600118
558E37.8Very low33Very low151 Ų151134.9 Ų134.971%0.70676%0.756SS**  cis-157.7179.9-19.2-107.6-66-169.400107.9
559E37.3Very low32.8Very low171 Ų171134.5 Ų134.580%0.79975%0.754SS**  trans29.6128.6152.8-58.6177.4149.900120.1
560D32.6Very low32.6Very low157 Ų157134.4 Ų134.484%0.8476%0.757SS**  173.8168.663.1-166.1-154.9000114.3
561D31Very low32.6Very low130 Ų130137.9 Ų137.970%0.69576%0.759SS**  trans46.6134.3156.7-150.1-141.5000127.2
562S31.7Very low32.3Very low82 Ų82135.8 Ų135.857%0.57375%0.75SS**  trans48.5112.2145.5-79.80000126.4
563S34Very low31.6Very low102 Ų102136 Ų13671%0.71375%0.751SS**  78.991.8110.9-57.40000121.4
564S32Very low31.6Very low115 Ų115136.7 Ų136.780%0.80476%0.755SS**  trans81.3129.9138.2820000120.5
565L32Very low31.6Very low158 Ų158139.8 Ų139.883%0.82776%0.76SS**  -172.1127.3116.6-101.2172.4000113.6
566S27.5Very low31.2Very low93 Ų93141 Ų14165%0.6576%0.763SS**  trans39124.1146.1-660000124
567R25.8Very low30.8Very low230 Ų230141.3 Ų141.387%0.86877%0.765SS**  trans81.3115.9132.5-82.5-178.3164.9133.5-2.2122.1
568S25.7Very low30.8Very low101 Ų101140.7 Ų140.771%0.70676%0.761SS**  trans87.1140.2130.8-58.90000120.2
569S28.5Very low30.5Very low111 Ų111139.5 Ų139.578%0.77677%0.77SS**  trans69155.5160.2-70.10000117.6
570L30.8Very low30.3Very low131 Ų131135.9 Ų135.969%0.68677%0.769SS**  cis-176.9118.9-36.7-116170.7000106.3
571R33.5Very low31.2Very low227 Ų227134 Ų13486%0.85777%0.766SS**  trans69164.4170.2-40.2172.4-176.4-154.5-2.1113.6
572S28.7Very low31.8Very low99 Ų99133.1 Ų133.169%0.69277%0.767SS**  cis-151.7143.70.6-143.80000113.5
573C23.9Very low31.6Very low112 Ų112133.7 Ų133.776%0.75777%0.771SS**  trans27.3125.3148.8-48.80000121.7
574S32.3Very low31.6Very low121 Ų121135.4 Ų135.485%0.84677%0.772SS**  -151.3111.9129.7-84.30000113
575R30.4Very low31.4Very low237 Ų237135.1 Ų135.189%0.89477%0.77SS**  trans32.799.9136.1-160.2178.9-162.5170.42.8117.1
576A28.6Very low31.4Very low88 Ų88133.5 Ų133.573%0.72777%0.772SS**  73.2114.258.700000115.3
577E28Very low31.7Very low177 Ų177133.3 Ų133.383%0.82778%0.776SS**  trans-155.9157.6155.9-102.4-58.6122.600109.1
578H35.4Very low32.3Very low161 Ų161128.4 Ų128.475%0.74577%0.774SS**  trans-78.1141.3-154.5-69.6-111.5000118.4
579S30.6Very low32.9Very low126 Ų126127 Ų12788%0.88178%0.775SS**  162.1162118.8-71.50000114.5
580A32.9Very low33.3Very low95 Ų95127.6 Ų127.679%0.78578%0.779SS**  trans-129.1174.9-17900000109.8
581P51.5Low33.5Very low119 Ų119128.6 Ų128.677%0.77379%0.785SS**  cis-116.7-149.77.442.2-24.1000110.8
582P43.2Very low33.8Very low111 Ų111124.9 Ų124.972%0.72178%0.781SS**  cis-137.9-163.7-3.943.4-22.7000116.5
583S28.8Very low34.8Very low93 Ų93126.4 Ų126.465%0.6578%0.78SS**  trans57.3113.7155.3-820000123.1
584D33.1Very low35.4Very low138 Ų138128.4 Ų128.474%0.73878%0.778SS**  54.599.9123.5-49.5-54.8000121
585S29.2Very low35.8Very low110 Ų110124.4 Ų124.477%0.76976%0.757SS**  173.8133118.4-81.30000114.7
586S31.7Very low36.6Very low124 Ų124116.6 Ų116.687%0.86774%0.742SS**  trans65.3146.615780.50000118.6
587A32.5Very low37.5Very low88 Ų88116.5 Ų116.573%0.72774%0.737SS**  cis-148.3150.8-5.700000110.2
588P39.5Very low38.5Very low128 Ų128116.1 Ų116.183%0.83173%0.733SS**  trans-84.5123.7174.332.7-31.6000111.6
589G37.8Very low39.6Very low71 Ų71110.5 Ų110.573%0.73271%0.708SS**  trans-134.6116.717600000111.9
590S37.4Very low40.7Very low123 Ų123110.2 Ų110.286%0.8671%0.706SS**  trans60.357.1176.4-1740000115.4
591L35.2Very low42.5Very low153 Ų153107.2 Ų107.280%0.80168%0.681SS**  trans-64.5134.8148.7-70.9-178.3000109
592L39.1Very low44.3Very low149 Ų149105.7 Ų105.778%0.7867%0.669SS**  trans-61.4156.4163-174.5148.7000108.5E594L592-E594 VanDerWaalsContact C-N 3.31Å; L592-E594 PolarHBondContact O-N 3.32Å
593I48.9Very low46.7Very low130 Ų130101.7 Ų101.767%0.66764%0.644SS**  trans-64.386.6-174.4-58172.2000111.4G595 A596I593-G595 PolarHBondContact O-N 3.42Å; I593-A596 HydrophobicContact CG2-CB 4.21Å
594E36.9Very low49.8Very low154 Ų15499.2 Ų99.272%0.7263%0.628SS**THydrogen-bonded Turntrans-77.75.6167.9-156.480.5-135.800111.3L592 S597L592-E594 VanDerWaalsContact C-N 3.31Å; L592-E594 PolarHBondContact O-N 3.32Å; E594-S597 PolarHBondContact O-OG 3.28Å
595G40.9Very low52.8Low38 Ų3899 Ų9939%0.39262%0.623SS.*THydrogen-bonded Turntrans-93.8-14.117900000115I593 S597 F598I593-G595 PolarHBondContact O-N 3.42Å; G595-S597 PolarHBondContact O-N 3.01Å; G595-F598 PolarHBondContact O-N 3.26Å; G595-F598 VanDerWaalsContact O-N 3.13Å
596A46.9Very low56Low72 Ų7294.3 Ų94.360%0.59559%0.588SS**THydrogen-bonded Turntrans-67.1-16.4-178.100000113.4I593 F598I593-A596 HydrophobicContact CG2-CB 4.21Å; A596-F598 VanDerWaalsContact C-N 3.34Å
597S48.3Very low59.1Low87 Ų8790.6 Ų90.661%0.60856%0.562SS**THydrogen-bonded Turntrans-75.2-16.8174.449.30000114.2E594 G595E594-S597 PolarHBondContact O-OG 3.28Å; G595-S597 PolarHBondContact O-N 3.01Å
598F49.1Very low62.2Low169 Ų16987.8 Ų87.874%0.74154%0.536SS*.SBendtrans-85.2-18.7179.4-81.4-87.9000113.9G595 A596 S600G595-F598 PolarHBondContact O-N 3.26Å; G595-F598 VanDerWaalsContact O-N 3.13Å; A596-F598 VanDerWaalsContact C-N 3.34Å; F598-S600 PolarHBondContact O-N 2.82Å
599L57.7Low65Low43 Ų4386.9 Ų86.923%0.22552%0.521CS..  trans-10064.3179.8-60.8177.7000109.7A601 W606 E610L599-A601 PolarHBondContact O-N 3.21Å; L599-W606 HydrophobicContact CB-CZ2 3.94Å; L599-W606 HydrophobicContact CD1-CD2 4.47Å; L599-W606 HydrophobicContact CD1-CH2 3.73Å; L599-W606 HydrophobicContact CD1-CZ2 3.56Å; L599-W606 HydrophobicContact CD1-CZ3 4.27Å; L599-W606 HydrophobicContact CG-CZ2 4.28Å; L599-E610 HydrophobicContact CD2-CB 3.83Å; L599-E610 HydrophobicContact CD2-CG 3.89Å
600S54.8Low67.8Low120 Ų12085.4 Ų85.484%0.83950%0.495SS*.  trans-71.4-9.1-179.8-173.60000113.8F598F598-S600 PolarHBondContact O-N 2.82Å
601A70.8Confident70.6Confident31 Ų3179.6 Ų79.626%0.25645%0.454SS..SBendtrans-87.9148.6173.100000110.9L599 Q605 W606L599-A601 PolarHBondContact O-N 3.21Å; A601-Q605 HydrophobicContact CB-CB 4.13Å; A601-W606 PolarHBondContact O-NE1 2.98Å
602T89.2Confident73.6Confident87 Ų8773 Ų7353%0.53442%0.421SS..  trans-59.2144.6173-54.30000109.7A604 Q605T602-A604 PolarHBondContact O-N 2.66Å; T602-Q605 WeakPolarHBondContact O-CA 3.28Å; T602-Q605 WeakPolarHBondContact O-CB 3.42Å; T602-Q605 PolarHBondContact O-N 3.39Å
603P92.8Very high76.3Confident28 Ų2872.2 Ų72.218%0.18241%0.411CS..G310 helixtrans-52.6-30.6-177.8-3136.9000115.6Q605 W606 G635 L639 L667P603-Q605 PolarHBondContact O-N 2.99Å; P603-W606 HydrophobicContact CB-CD2 4.34Å; P603-W606 HydrophobicContact CB-CH2 4.34Å; P603-W606 HydrophobicContact CB-CZ2 4.1Å; P603-W606 HydrophobicContact CG-CH2 4.27Å; P603-W606 HydrophobicContact CG-CZ2 3.82Å; P603-W606 PolarHBondContact O-N 3.21Å; P603-G635 CarbonylContact O-C 3.48Å; P603-G635 WeakPolarHBondContact O-CA 3.3Å; P603-L639 HydrophobicContact CB-CD1 4.2Å; P603-L639 HydrophobicContact CB-CD2 4.26Å; P603-L667 HydrophobicContact CB-CB 4.22Å; P603-L667 HydrophobicContact CB-CD1 4.43Å; P603-L667 HydrophobicContact CG-CB 4.13Å; P603-L667 HydrophobicContact CG-CD2 4.21Å
604A94.6Very high78.6Confident40 Ų4067 Ų6733%0.33138%0.384SS..G310 helixtrans-73.22.3174.100000115.1T602 Q636 L639T602-A604 PolarHBondContact O-N 2.66Å; A604-Q636 WeakPolarHBondContact O-CG 3.07Å; A604-Q636 PolarHBondContact O-NE2 2.97Å; A604-L639 HydrophobicContact CB-CD1 3.75Å
605Q95.1Very high81.5Confident133 Ų13359.7 Ų59.762%0.62135%0.35SS*.G310 helixtrans-119-1.8179.3-63176.5-31.200112.5A601 T602 P603A601-Q605 HydrophobicContact CB-CB 4.13Å; T602-Q605 WeakPolarHBondContact O-CA 3.28Å; T602-Q605 WeakPolarHBondContact O-CB 3.42Å; T602-Q605 PolarHBondContact O-N 3.39Å; P603-Q605 PolarHBondContact O-N 2.99Å
606W96.4Very high84.2Confident12 Ų1260.2 Ų60.25%0.04535%0.347CS..  trans-65.4137.2-177-68.9-6.5000112L599 A601 P603 E610 V611 F614 G635 L638 L667L599-W606 HydrophobicContact CB-CZ2 3.94Å; L599-W606 HydrophobicContact CD1-CD2 4.47Å; L599-W606 HydrophobicContact CD1-CH2 3.73Å; L599-W606 HydrophobicContact CD1-CZ2 3.56Å; L599-W606 HydrophobicContact CD1-CZ3 4.27Å; L599-W606 HydrophobicContact CG-CZ2 4.28Å; A601-W606 PolarHBondContact O-NE1 2.98Å; P603-W606 HydrophobicContact CB-CD2 4.34Å; P603-W606 HydrophobicContact CB-CH2 4.34Å; P603-W606 HydrophobicContact CB-CZ2 4.1Å; P603-W606 HydrophobicContact CG-CH2 4.27Å; P603-W606 HydrophobicContact CG-CZ2 3.82Å; P603-W606 PolarHBondContact O-N 3.21Å; W606-E610 VanDerWaalsContact CA-OE2 3.31Å; W606-E610 WeakPolarHBondContact CA-OE2 3.48Å; W606-E610 HydrophobicContact CB-CB 3.87Å; W606-E610 HydrophobicContact CG-CB 4.2Å; W606-V611 HydrophobicContact CB-CG2 4.19Å; W606-V611 HydrophobicContact CE3-CG2 4.47Å; W606-F614 HydrophobicContact CE3-CB 4.44Å; W606-F614 HydrophobicContact CH2-CD2 4.08Å; W606-F614 HydrophobicContact CH2-CG 4.31Å; W606-F614 HydrophobicContact CZ3-CB 3.87Å; W606-F614 HydrophobicContact CZ3-CD1 4.11Å; W606-F614 AromaticContact CZ3-CD2 3.93Å; W606-F614 HydrophobicContact CZ3-CD2 3.93Å; W606-F614 AromaticContact CZ3-CG 3.69Å; W606-F614 HydrophobicContact CZ3-CG 3.69Å; W606-G635 PolarHBondContact O-N 2.89Å; W606-L638 HydrophobicContact CE3-CD2 4.15Å; W606-L638 HydrophobicContact CZ3-CD2 4.17Å; W606-L667 HydrophobicContact CH2-CD1 3.53Å; W606-L667 HydrophobicContact CH2-CD2 3.69Å; W606-L667 HydrophobicContact CH2-CG 4.26Å; W606-L667 HydrophobicContact CZ2-CD2 4.39Å; W606-L667 HydrophobicContact CZ3-CD1 3.48Å; W606-L667 VanDerWaalsContact CZ3-CD1 3.48Å; W606-L667 HydrophobicContact CZ3-CD2 4.5Å
607S97Very high86.5Confident46 Ų4660.7 Ų60.732%0.32235%0.346SS..  trans-70.6166.8170.285.90000111.7E609 E610 V611S607-E609 WeakPolarHBondContact CB-OE2 3.48Å; S607-E609 PolarHBondContact O-N 3.45Å; S607-E609 PolarHBondContact OG-N 2.93Å; S607-E609 PolarHBondContact OG-OE2 3.2Å; S607-E610 PolarHBondContact N-OE2 3.19Å; S607-E610 WeakPolarHBondContact O-CB 3.45Å; S607-E610 PolarHBondContact O-N 2.91Å; S607-E610 PolarHBondContact OG-N 3.01Å; S607-V611 PolarHBondContact O-N 3.25Å
608V97.8Very high88.7Confident30 Ų3057.7 Ų57.718%0.18232%0.323CS..Hα-helixtrans-58.2-37.5175.6-172.80000110.7E610 V611 C612 L629 D634V608-E610 VanDerWaalsContact C-N 3.34Å; V608-E610 PolarHBondContact O-N 3.48Å; V608-V611 PolarHBondContact O-N 3.42Å; V608-C612 WeakPolarHBondContact O-CB 3.42Å; V608-C612 PolarHBondContact O-N 3.18Å; V608-C612 PolarHBondContact O-SG 3.26Å; V608-L629 HydrophobicContact CG1-CD1 3.82Å; V608-D634 HydrophobicContact CG2-CB 4.24Å
609E97.4Very high90.9Very high108 Ų10858.2 Ų58.251%0.50533%0.328SS..Hα-helixtrans-67.4-32.1175.9-54.780.2-177.700112.9S607 K613S607-E609 WeakPolarHBondContact CB-OE2 3.48Å; S607-E609 PolarHBondContact O-N 3.45Å; S607-E609 PolarHBondContact OG-N 2.93Å; S607-E609 PolarHBondContact OG-OE2 3.2Å; E609-K613 WeakPolarHBondContact O-CD 3.33Å; E609-K613 WeakPolarHBondContact O-CG 3.09Å; E609-K613 PolarHBondContact O-N 3.45Å
610E96.8Very high92.5Very high41 Ų4159 Ų5919%0.19235%0.347CS..Hα-helixtrans-73.7-41.1175-70.5-179.7129.400111.6L599 W606 S607 V608 C612 K613 F614L599-E610 HydrophobicContact CD2-CB 3.83Å; L599-E610 HydrophobicContact CD2-CG 3.89Å; W606-E610 VanDerWaalsContact CA-OE2 3.31Å; W606-E610 WeakPolarHBondContact CA-OE2 3.48Å; W606-E610 HydrophobicContact CB-CB 3.87Å; W606-E610 HydrophobicContact CG-CB 4.2Å; S607-E610 PolarHBondContact N-OE2 3.19Å; S607-E610 WeakPolarHBondContact O-CB 3.45Å; S607-E610 PolarHBondContact O-N 2.91Å; S607-E610 PolarHBondContact OG-N 3.01Å; V608-E610 VanDerWaalsContact C-N 3.34Å; V608-E610 PolarHBondContact O-N 3.48Å; E610-C612 VanDerWaalsContact C-N 3.32Å; E610-C612 PolarHBondContact O-N 3.36Å; E610-K613 PolarHBondContact O-N 2.97Å; E610-F614 WeakPolarHBondContact O-CB 3.41Å; E610-F614 PolarHBondContact O-N 3.4Å
611V97.6Very high94.4Very high0 Ų053.4 Ų53.40%031%0.308CS..Hα-helixtrans-58.9-43.6168.9172.70000111W606 S607 V608 F614 I615 F628 I633 D634 L638W606-V611 HydrophobicContact CB-CG2 4.19Å; W606-V611 HydrophobicContact CE3-CG2 4.47Å; S607-V611 PolarHBondContact O-N 3.25Å; V608-V611 PolarHBondContact O-N 3.42Å; V611-F614 WeakPolarHBondContact O-CB 3.42Å; V611-F614 PolarHBondContact O-N 3.01Å; V611-I615 HydrophobicContact CG1-CG1 4.36Å; V611-I615 WeakPolarHBondContact O-CG1 3.46Å; V611-I615 PolarHBondContact O-N 3.25Å; V611-F628 HydrophobicContact CG1-CB 4.42Å; V611-F628 HydrophobicContact CG1-CD1 3.8Å; V611-F628 HydrophobicContact CG1-CG 4.48Å; V611-I633 WeakPolarHBondContact CB-O 3.22Å; V611-I633 HydrophobicContact CG1-CG2 4.32Å; V611-I633 WeakPolarHBondContact CG1-O 3.17Å; V611-D634 VanDerWaalsContact CG2-C 3.49Å; V611-L638 HydrophobicContact CG1-CB 4.41Å; V611-L638 HydrophobicContact CG1-CD1 4.07Å; V611-L638 HydrophobicContact CG1-CD2 4.11Å; V611-L638 HydrophobicContact CG1-CG 4.42Å; V611-L638 HydrophobicContact CG2-CB 4.23Å; V611-L638 HydrophobicContact CG2-CD2 3.98Å
612C97.3Very high95.6Very high16 Ų1658.8 Ų58.811%0.10833%0.328CS..Hα-helixtrans-63-45.4177.3-68.60000112V608 E610 F614 I615 S616 A625 L629V608-C612 WeakPolarHBondContact O-CB 3.42Å; V608-C612 PolarHBondContact O-N 3.18Å; V608-C612 PolarHBondContact O-SG 3.26Å; E610-C612 VanDerWaalsContact C-N 3.32Å; E610-C612 PolarHBondContact O-N 3.36Å; C612-F614 VanDerWaalsContact C-N 3.3Å; C612-F614 PolarHBondContact O-N 3.33Å; C612-I615 PolarHBondContact O-N 3.17Å; C612-S616 WeakPolarHBondContact O-CB 3.43Å; C612-S616 PolarHBondContact O-N 3.41Å; C612-S616 PolarHBondContact O-OG 3.09Å; C612-A625 HydrophobicContact CB-CB 4.34Å; C612-A625 WeakPolarHBondContact O-CB 3.42Å; C612-A625 PolarHBondContact SG-O 3.38Å; C612-A625 VanDerWaalsContact SG-O 3.35Å; C612-L629 VanDerWaalsContact SG-CB 3.59Å; C612-L629 PolarHBondContact SG-N 3.07Å
613K96.5Very high95.9Very high132 Ų13263.4 Ų63.457%0.57434%0.343SS*.Hα-helixtrans-58.7-41.4173.3-69.9160.6-162.6160.70111.8E609 E610 S616 S617E609-K613 WeakPolarHBondContact O-CD 3.33Å; E609-K613 WeakPolarHBondContact O-CG 3.09Å; E609-K613 PolarHBondContact O-N 3.45Å; E610-K613 PolarHBondContact O-N 2.97Å; K613-S616 PolarHBondContact O-N 2.99Å; K613-S617 PolarHBondContact O-N 3.32Å
614F96.7Very high96Very high21 Ų2163.5 Ų63.59%0.09234%0.342CS..Hα-helixtrans-61.1-51.9175.7167.7-105.3000111.4W606 E610 V611 C612 S616 S617 L618 L638 L667W606-F614 HydrophobicContact CE3-CB 4.44Å; W606-F614 HydrophobicContact CH2-CD2 4.08Å; W606-F614 HydrophobicContact CH2-CG 4.31Å; W606-F614 HydrophobicContact CZ3-CB 3.87Å; W606-F614 HydrophobicContact CZ3-CD1 4.11Å; W606-F614 AromaticContact CZ3-CD2 3.93Å; W606-F614 HydrophobicContact CZ3-CD2 3.93Å; W606-F614 AromaticContact CZ3-CG 3.69Å; W606-F614 HydrophobicContact CZ3-CG 3.69Å; E610-F614 WeakPolarHBondContact O-CB 3.41Å; E610-F614 PolarHBondContact O-N 3.4Å; V611-F614 WeakPolarHBondContact O-CB 3.42Å; V611-F614 PolarHBondContact O-N 3.01Å; C612-F614 VanDerWaalsContact C-N 3.3Å; C612-F614 PolarHBondContact O-N 3.33Å; F614-S616 VanDerWaalsContact C-N 3.33Å; F614-S616 PolarHBondContact O-N 3.33Å; F614-S617 WeakPolarHBondContact O-CB 3.44Å; F614-S617 PolarHBondContact O-N 3.41Å; F614-S617 PolarHBondContact O-OG 3.12Å; F614-L618 HydrophobicContact CE1-CD1 4.25Å; F614-L618 HydrophobicContact CE2-CD2 4.3Å; F614-L618 HydrophobicContact CZ-CD1 4.3Å; F614-L618 HydrophobicContact CZ-CD2 4.4Å; F614-L618 PolarHBondContact O-N 3.39Å; F614-L638 HydrophobicContact CD1-CD2 3.97Å; F614-L638 HydrophobicContact CE1-CD2 4.1Å; F614-L667 HydrophobicContact CD1-CD1 4.47Å; F614-L667 HydrophobicContact CD2-CD1 4.38Å; F614-L667 HydrophobicContact CE1-CD1 3.88Å; F614-L667 HydrophobicContact CE2-CD1 3.78Å; F614-L667 HydrophobicContact CE2-CD2 4.34Å; F614-L667 HydrophobicContact CE2-CG 4.28Å; F614-L667 HydrophobicContact CZ-CD1 3.49Å; F614-L667 VanDerWaalsContact CZ-CD1 3.49Å; F614-L667 HydrophobicContact CZ-CG 4.16Å
615I97.5Very high96.1Very high0 Ų061.9 Ų61.90%033%0.329CS..Hα-helixtrans-61-40.7177.4-63.2-64000111.3V611 C612 S617 L618 C621 L624 A625 F628 L638 I660V611-I615 HydrophobicContact CG1-CG1 4.36Å; V611-I615 WeakPolarHBondContact O-CG1 3.46Å; V611-I615 PolarHBondContact O-N 3.25Å; C612-I615 PolarHBondContact O-N 3.17Å; I615-S617 VanDerWaalsContact C-N 3.26Å; I615-S617 PolarHBondContact O-N 3.49Å; I615-L618 HydrophobicContact CD1-CD1 4.19Å; I615-L618 WeakPolarHBondContact O-CB 3.2Å; I615-L618 PolarHBondContact O-N 3.01Å; I615-L618 VanDerWaalsContact O-N 3.12Å; I615-C621 HydrophobicContact CG2-CB 4.39Å; I615-L624 HydrophobicContact CG2-CB 4.22Å; I615-A625 HydrophobicContact CB-CB 4.3Å; I615-A625 HydrophobicContact CG2-CB 4.16Å; I615-F628 HydrophobicContact CD1-CD1 4.28Å; I615-F628 HydrophobicContact CD1-CD2 4.47Å; I615-F628 HydrophobicContact CD1-CE1 3.86Å; I615-F628 HydrophobicContact CD1-CE2 4.08Å; I615-F628 HydrophobicContact CD1-CZ 3.77Å; I615-F628 HydrophobicContact CG1-CD1 3.9Å; I615-F628 HydrophobicContact CG1-CD2 4.01Å; I615-F628 HydrophobicContact CG1-CE1 4Å; I615-F628 HydrophobicContact CG1-CE2 4.13Å; I615-F628 HydrophobicContact CG1-CG 3.92Å; I615-F628 HydrophobicContact CG1-CZ 4.14Å; I615-F628 HydrophobicContact CG2-CD2 4.08Å; I615-F628 HydrophobicContact CG2-CE2 4.2Å; I615-L638 HydrophobicContact CD1-CD1 4.46Å; I615-I660 HydrophobicContact CD1-CD1 4.4Å; I615-I660 HydrophobicContact CD1-CG1 4.19Å; I615-I660 HydrophobicContact CD1-CG2 3.86Å
616S96.9Very high96.2Very high49 Ų4958.7 Ų58.734%0.34333%0.325SS..Hα-helixtrans-61.2-31.4173.9-69.60000113.6C612 K613 F614 L618 A625C612-S616 WeakPolarHBondContact O-CB 3.43Å; C612-S616 PolarHBondContact O-N 3.41Å; C612-S616 PolarHBondContact O-OG 3.09Å; K613-S616 PolarHBondContact O-N 2.99Å; F614-S616 VanDerWaalsContact C-N 3.33Å; F614-S616 PolarHBondContact O-N 3.33Å; S616-L618 VanDerWaalsContact C-N 3.26Å; S616-L618 PolarHBondContact O-N 2.97Å; S616-A625 WeakPolarHBondContact OG-CB 3.32Å
617S95.8Very high96.2Very high82 Ų8261 Ų6157%0.57334%0.336SS*.Hα-helixtrans-72.2-17176.880.80000113.9K613 F614 I615 Q619K613-S617 PolarHBondContact O-N 3.32Å; F614-S617 WeakPolarHBondContact O-CB 3.44Å; F614-S617 PolarHBondContact O-N 3.41Å; F614-S617 PolarHBondContact O-OG 3.12Å; I615-S617 VanDerWaalsContact C-N 3.26Å; I615-S617 PolarHBondContact O-N 3.49Å; S617-Q619 PolarHBondContact O-N 2.84Å
618L95.6Very high96.2Very high23 Ų2358.9 Ų58.912%0.1232%0.321CS..SBendtrans-79.8120.7-178.8-57.6-177.1000110.6F614 I615 S616 G620 C621 I660 S663F614-L618 HydrophobicContact CE1-CD1 4.25Å; F614-L618 HydrophobicContact CE2-CD2 4.3Å; F614-L618 HydrophobicContact CZ-CD1 4.3Å; F614-L618 HydrophobicContact CZ-CD2 4.4Å; F614-L618 PolarHBondContact O-N 3.39Å; I615-L618 HydrophobicContact CD1-CD1 4.19Å; I615-L618 WeakPolarHBondContact O-CB 3.2Å; I615-L618 PolarHBondContact O-N 3.01Å; I615-L618 VanDerWaalsContact O-N 3.12Å; S616-L618 VanDerWaalsContact C-N 3.26Å; S616-L618 PolarHBondContact O-N 2.97Å; L618-G620 PolarHBondContact O-N 3.36Å; L618-C621 HydrophobicContact CB-CB 3.95Å; L618-C621 WeakPolarHBondContact O-CB 3.42Å; L618-C621 PolarHBondContact O-N 3.38Å; L618-I660 HydrophobicContact CD1-CG1 4.09Å; L618-S663 WeakPolarHBondContact CD2-OG 3.48Å
619Q93.8Very high96.2Very high180 Ų18061.8 Ų61.884%0.84134%0.335SS*.THydrogen-bonded Turntrans-54.9112.7-171.3-169-177.221.800112.9S617 K659S617-Q619 PolarHBondContact O-N 2.84Å; Q619-K659 PolarHBondContact O-NZ 3.29Å
620G92.3Very high96.2Very high61 Ų6160.5 Ų60.563%0.62934%0.338SS*.THydrogen-bonded Turntrans73.533.9-178.100000114L618L618-G620 PolarHBondContact O-N 3.36Å
621C94.8Very high96.2Very high2 Ų263.5 Ų63.51%0.01435%0.352CS..  trans-1256.9168.9-48.70000112.2I615 L618 E623 L624I615-C621 HydrophobicContact CG2-CB 4.39Å; L618-C621 HydrophobicContact CB-CB 3.95Å; L618-C621 WeakPolarHBondContact O-CB 3.42Å; L618-C621 PolarHBondContact O-N 3.38Å; C621-E623 PolarHBondContact O-N 3.02Å; C621-L624 HydrophobicContact CB-CD1 4.15Å; C621-L624 WeakPolarHBondContact O-CA 3.41Å; C621-L624 VanDerWaalsContact O-CB 3.24Å; C621-L624 WeakPolarHBondContact O-CB 3.34Å; C621-L624 PolarHBondContact O-N 3.1Å
622E95.6Very high96.2Very high144 Ų14471.4 Ų71.467%0.67339%0.389SS*.G310 helixtrans-57.6-45.4-172.4-171174.6-177.700113.5L624 A625E622-L624 PolarHBondContact O-N 3.1Å; E622-L624 VanDerWaalsContact O-N 3.15Å; E622-A625 WeakPolarHBondContact O-CB 3.29Å; E622-A625 PolarHBondContact O-N 2.95Å
623E95.4Very high96.2Very high184 Ų18471.2 Ų71.286%0.8639%0.387SS*.G310 helixtrans-59.5-23.6174.9-61.3175171.300113.2C621C621-E623 PolarHBondContact O-N 3.02Å
624L96.1Very high96.2Very high30 Ų3067.7 Ų67.716%0.15737%0.374CS..G310 helixtrans-80.6-19.9-177.8-52178.8000112.4I615 C621 E622 A626 Q627 F628 I652 P656 I660I615-L624 HydrophobicContact CG2-CB 4.22Å; C621-L624 HydrophobicContact CB-CD1 4.15Å; C621-L624 WeakPolarHBondContact O-CA 3.41Å; C621-L624 VanDerWaalsContact O-CB 3.24Å; C621-L624 WeakPolarHBondContact O-CB 3.34Å; C621-L624 PolarHBondContact O-N 3.1Å; E622-L624 PolarHBondContact O-N 3.1Å; E622-L624 VanDerWaalsContact O-N 3.15Å; L624-A626 VanDerWaalsContact C-N 3.28Å; L624-A626 PolarHBondContact O-N 2.96Å; L624-Q627 WeakPolarHBondContact O-CA 3.08Å; L624-Q627 WeakPolarHBondContact O-CB 3.43Å; L624-Q627 PolarHBondContact O-N 3.5Å; L624-F628 WeakPolarHBondContact O-CD2 3.48Å; L624-F628 PolarHBondContact O-N 3.19Å; L624-I652 HydrophobicContact CD1-CD1 4.44Å; L624-I652 HydrophobicContact CD1-CG2 3.79Å; L624-I652 HydrophobicContact CD2-CG1 4.35Å; L624-P656 HydrophobicContact CD1-CB 3.73Å; L624-I660 HydrophobicContact CD1-CD1 3.85Å
625A96.7Very high96.3Very high6 Ų666.7 Ų66.75%0.0537%0.37CS..Hα-helixtrans-60.7-36.5-178.200000112.6C612 I615 S616 E622 Q627 F628 L629C612-A625 HydrophobicContact CB-CB 4.34Å; C612-A625 WeakPolarHBondContact O-CB 3.42Å; C612-A625 PolarHBondContact SG-O 3.38Å; C612-A625 VanDerWaalsContact SG-O 3.35Å; I615-A625 HydrophobicContact CB-CB 4.3Å; I615-A625 HydrophobicContact CG2-CB 4.16Å; S616-A625 WeakPolarHBondContact OG-CB 3.32Å; E622-A625 WeakPolarHBondContact O-CB 3.29Å; E622-A625 PolarHBondContact O-N 2.95Å; A625-Q627 PolarHBondContact O-N 2.95Å; A625-F628 PolarHBondContact O-N 2.61Å; A625-F628 VanDerWaalsContact O-N 3.13Å; A625-L629 PolarHBondContact O-N 3.18Å
626A96Very high96.2Very high66 Ų6672.4 Ų72.455%0.54540%0.397SS..Hα-helixtrans-61.7-24.917300000112.9L624 S630L624-A626 VanDerWaalsContact C-N 3.28Å; L624-A626 PolarHBondContact O-N 2.96Å; A626-S630 WeakPolarHBondContact O-CB 3.49Å; A626-S630 PolarHBondContact O-N 3.43Å; A626-S630 PolarHBondContact O-OG 2.88Å
627Q96.1Very high96.3Very high61 Ų6171.7 Ų71.729%0.28539%0.394SS..Hα-helixtrans-81.7-30.7176.6-153.8173.423.400112.5L624 A625 S630 Q631 M650L624-Q627 WeakPolarHBondContact O-CA 3.08Å; L624-Q627 WeakPolarHBondContact O-CB 3.43Å; L624-Q627 PolarHBondContact O-N 3.5Å; A625-Q627 PolarHBondContact O-N 2.95Å; Q627-S630 WeakPolarHBondContact CA-OG 3.48Å; Q627-Q631 WeakPolarHBondContact O-CB 3.28Å; Q627-Q631 VanDerWaalsContact O-CG 3.24Å; Q627-Q631 WeakPolarHBondContact O-CG 3.45Å; Q627-Q631 PolarHBondContact O-N 3Å; Q627-M650 HydrophobicContact CB-CE 4.22Å; Q627-M650 VanDerWaalsContact CD-O 3.25Å; Q627-M650 HydrophobicContact CG-CE 4.07Å; Q627-M650 PolarHBondContact NE2-O 3.48Å; Q627-M650 WeakPolarHBondContact O-CE 3.41Å; Q627-M650 PolarHBondContact OE1-O 2.71Å
628F97.6Very high96.3Very high0 Ų067.8 Ų67.80%037%0.366CS..Hα-helixtrans-69.2-39.5168.1-78.3-108.4000111V611 I615 L624 A625 Q631 E632 I633 L638 L641 L646 M650 I652 I660V611-F628 HydrophobicContact CG1-CB 4.42Å; V611-F628 HydrophobicContact CG1-CD1 3.8Å; V611-F628 HydrophobicContact CG1-CG 4.48Å; I615-F628 HydrophobicContact CD1-CD1 4.28Å; I615-F628 HydrophobicContact CD1-CD2 4.47Å; I615-F628 HydrophobicContact CD1-CE1 3.86Å; I615-F628 HydrophobicContact CD1-CE2 4.08Å; I615-F628 HydrophobicContact CD1-CZ 3.77Å; I615-F628 HydrophobicContact CG1-CD1 3.9Å; I615-F628 HydrophobicContact CG1-CD2 4.01Å; I615-F628 HydrophobicContact CG1-CE1 4Å; I615-F628 HydrophobicContact CG1-CE2 4.13Å; I615-F628 HydrophobicContact CG1-CG 3.92Å; I615-F628 HydrophobicContact CG1-CZ 4.14Å; I615-F628 HydrophobicContact CG2-CD2 4.08Å; I615-F628 HydrophobicContact CG2-CE2 4.2Å; L624-F628 WeakPolarHBondContact O-CD2 3.48Å; L624-F628 PolarHBondContact O-N 3.19Å; A625-F628 PolarHBondContact O-N 2.61Å; A625-F628 VanDerWaalsContact O-N 3.13Å; F628-Q631 PolarHBondContact O-N 3.36Å; F628-E632 PolarHBondContact O-N 2.89Å; F628-I633 HydrophobicContact CB-CB 4.48Å; F628-I633 HydrophobicContact CD1-CB 4.04Å; F628-I633 HydrophobicContact CD1-CD1 3.77Å; F628-I633 HydrophobicContact CD1-CG1 4.46Å; F628-I633 HydrophobicContact CD1-CG2 3.91Å; F628-I633 HydrophobicContact CE1-CD1 4.15Å; F628-I633 HydrophobicContact CE1-CG2 4.39Å; F628-I633 HydrophobicContact CG-CD1 4.24Å; F628-I633 PolarHBondContact O-N 2.73Å; F628-I633 VanDerWaalsContact O-N 3.11Å; F628-L638 HydrophobicContact CD1-CD1 4.36Å; F628-L638 HydrophobicContact CE1-CD1 3.83Å; F628-L641 HydrophobicContact CD1-CD1 4.45Å; F628-L641 HydrophobicContact CE1-CD1 3.56Å; F628-L641 HydrophobicContact CZ-CD1 4.16Å; F628-L646 HydrophobicContact CZ-CD2 3.81Å; F628-M650 HydrophobicContact CD1-CE 4.44Å; F628-M650 HydrophobicContact CD2-CE 3.61Å; F628-M650 HydrophobicContact CE2-CE 3.71Å; F628-M650 HydrophobicContact CE2-SD 4.29Å; F628-M650 HydrophobicContact CG-CE 3.99Å; F628-M650 HydrophobicContact CZ-CE 4.17Å; F628-M650 HydrophobicContact CZ-SD 4.25Å; F628-I652 HydrophobicContact CE2-CD1 3.94Å; F628-I660 HydrophobicContact CE2-CD1 4.16Å; F628-I660 HydrophobicContact CZ-CD1 4.27Å; F628-I660 HydrophobicContact CZ-CG2 4.06Å
629L97.4Very high96.4Very high91 Ų9168.4 Ų68.448%0.47637%0.37SS..Hα-helixtrans-60.7-49.1175.2-170.461.4000112.4V608 C612 A625 Q631 E632V608-L629 HydrophobicContact CG1-CD1 3.82Å; C612-L629 VanDerWaalsContact SG-CB 3.59Å; C612-L629 PolarHBondContact SG-N 3.07Å; A625-L629 PolarHBondContact O-N 3.18Å; L629-Q631 PolarHBondContact O-N 3.49Å; L629-E632 PolarHBondContact O-N 2.66Å
630S97Very high96.5Very high82 Ų8266.1 Ų66.157%0.57336%0.362SS*.THydrogen-bonded Turntrans-78.51.5-179.451.70000114.6A626 Q627A626-S630 WeakPolarHBondContact O-CB 3.49Å; A626-S630 PolarHBondContact O-N 3.43Å; A626-S630 PolarHBondContact O-OG 2.88Å; Q627-S630 WeakPolarHBondContact CA-OG 3.48Å
631Q97Very high96.7Very high104 Ų10464.5 Ų64.549%0.48634%0.339SS..THydrogen-bonded Turntrans-110.58.3165.6-65.8-65.1-9000111.9Q627 F628 L629 I633 M650Q627-Q631 WeakPolarHBondContact O-CB 3.28Å; Q627-Q631 VanDerWaalsContact O-CG 3.24Å; Q627-Q631 WeakPolarHBondContact O-CG 3.45Å; Q627-Q631 PolarHBondContact O-N 3Å; F628-Q631 PolarHBondContact O-N 3.36Å; L629-Q631 PolarHBondContact O-N 3.49Å; Q631-I633 HydrophobicContact CB-CD1 3.8Å; Q631-I633 HydrophobicContact CB-CG1 3.7Å; Q631-I633 PolarHBondContact O-N 3.14Å; Q631-I633 VanDerWaalsContact O-N 3.15Å; Q631-M650 HydrophobicContact CG-CE 4.22Å
632E97.5Very high96.8Very high166 Ų16670.7 Ų70.778%0.77636%0.363SS*.THydrogen-bonded Turntrans51.136179-58-173.3150.100113.6F628 L629 D634F628-E632 PolarHBondContact O-N 2.89Å; L629-E632 PolarHBondContact O-N 2.66Å; E632-D634 PolarHBondContact O-N 2.84Å; E632-D634 VanDerWaalsContact O-N 3.11Å
633I97.9Very high96.9Very high12 Ų1267.5 Ų67.56%0.06235%0.347CS..  trans-76.5103-173.4-58.7180000110.1V611 F628 Q631 A637 L638 L641 M650V611-I633 WeakPolarHBondContact CB-O 3.22Å; V611-I633 HydrophobicContact CG1-CG2 4.32Å; V611-I633 WeakPolarHBondContact CG1-O 3.17Å; F628-I633 HydrophobicContact CB-CB 4.48Å; F628-I633 HydrophobicContact CD1-CB 4.04Å; F628-I633 HydrophobicContact CD1-CD1 3.77Å; F628-I633 HydrophobicContact CD1-CG1 4.46Å; F628-I633 HydrophobicContact CD1-CG2 3.91Å; F628-I633 HydrophobicContact CE1-CD1 4.15Å; F628-I633 HydrophobicContact CE1-CG2 4.39Å; F628-I633 HydrophobicContact CG-CD1 4.24Å; F628-I633 PolarHBondContact O-N 2.73Å; F628-I633 VanDerWaalsContact O-N 3.11Å; Q631-I633 HydrophobicContact CB-CD1 3.8Å; Q631-I633 HydrophobicContact CB-CG1 3.7Å; Q631-I633 PolarHBondContact O-N 3.14Å; Q631-I633 VanDerWaalsContact O-N 3.15Å; I633-A637 HydrophobicContact CG2-CB 3.89Å; I633-L638 HydrophobicContact CG2-CB 4.19Å; I633-L641 HydrophobicContact CD1-CD1 4.13Å; I633-L641 HydrophobicContact CG2-CD1 4.16Å; I633-M650 HydrophobicContact CD1-CE 3.65Å; I633-M650 HydrophobicContact CD1-SD 3.7Å
634D97.6Very high97Very high57 Ų5763 Ų6331%0.30533%0.329SS..  trans-80.7178.7171.284.1-16.6000112.5V608 V611 E632 Q636 A637 L638V608-D634 HydrophobicContact CG2-CB 4.24Å; V611-D634 VanDerWaalsContact CG2-C 3.49Å; E632-D634 PolarHBondContact O-N 2.84Å; E632-D634 VanDerWaalsContact O-N 3.11Å; D634-Q636 PolarHBondContact O-N 3.47Å; D634-Q636 PolarHBondContact OD1-N 3.43Å; D634-A637 PolarHBondContact O-N 2.71Å; D634-A637 WeakPolarHBondContact OD1-CB 3.39Å; D634-A637 PolarHBondContact OD1-N 3.08Å; D634-L638 VanDerWaalsContact O-CB 3.3Å; D634-L638 WeakPolarHBondContact O-CB 3.28Å; D634-L638 PolarHBondContact O-N 3.06Å
635G97.1Very high97Very high0 Ų064.5 Ų64.50%034%0.336CS..Hα-helixtrans-61.9-27.2179.500000114.6P603 W606 L639P603-G635 CarbonylContact O-C 3.48Å; P603-G635 WeakPolarHBondContact O-CA 3.3Å; W606-G635 PolarHBondContact O-N 2.89Å; G635-L639 VanDerWaalsContact O-CG 3.29Å; G635-L639 WeakPolarHBondContact O-CG 3.23Å; G635-L639 PolarHBondContact O-N 3.03Å
636Q96.7Very high97.1Very high120 Ų12064.2 Ų64.256%0.56133%0.333SS*.Hα-helixtrans-76.9-46.7177.4-60-1732500110.7A604 D634 L639 L640A604-Q636 WeakPolarHBondContact O-CG 3.07Å; A604-Q636 PolarHBondContact O-NE2 2.97Å; D634-Q636 PolarHBondContact O-N 3.47Å; D634-Q636 PolarHBondContact OD1-N 3.43Å; Q636-L639 PolarHBondContact O-N 2.93Å; Q636-L640 WeakPolarHBondContact O-CG 3.29Å; Q636-L640 PolarHBondContact O-N 3.36Å
637A97.6Very high97.1Very high34 Ų3464.1 Ų64.128%0.28132%0.323SS..Hα-helixtrans-59.7-45.1173.900000111.3I633 D634 L639 L640 L641I633-A637 HydrophobicContact CG2-CB 3.89Å; D634-A637 PolarHBondContact O-N 2.71Å; D634-A637 WeakPolarHBondContact OD1-CB 3.39Å; D634-A637 PolarHBondContact OD1-N 3.08Å; A637-L639 VanDerWaalsContact C-N 3.33Å; A637-L639 PolarHBondContact O-N 3.34Å; A637-L640 PolarHBondContact O-N 3.17Å; A637-L641 WeakPolarHBondContact O-CG 3.33Å; A637-L641 PolarHBondContact O-N 3.21Å
638L97.6Very high97.1Very high0 Ų065.5 Ų65.50%034%0.339CS..Hα-helixtrans-53.1-47178.1179.768.3000112.3W606 V611 F614 I615 F628 I633 D634 L640 L641 I664 L667W606-L638 HydrophobicContact CE3-CD2 4.15Å; W606-L638 HydrophobicContact CZ3-CD2 4.17Å; V611-L638 HydrophobicContact CG1-CB 4.41Å; V611-L638 HydrophobicContact CG1-CD1 4.07Å; V611-L638 HydrophobicContact CG1-CD2 4.11Å; V611-L638 HydrophobicContact CG1-CG 4.42Å; V611-L638 HydrophobicContact CG2-CB 4.23Å; V611-L638 HydrophobicContact CG2-CD2 3.98Å; F614-L638 HydrophobicContact CD1-CD2 3.97Å; F614-L638 HydrophobicContact CE1-CD2 4.1Å; I615-L638 HydrophobicContact CD1-CD1 4.46Å; F628-L638 HydrophobicContact CD1-CD1 4.36Å; F628-L638 HydrophobicContact CE1-CD1 3.83Å; I633-L638 HydrophobicContact CG2-CB 4.19Å; D634-L638 VanDerWaalsContact O-CB 3.3Å; D634-L638 WeakPolarHBondContact O-CB 3.28Å; D634-L638 PolarHBondContact O-N 3.06Å; L638-L640 PolarHBondContact O-N 3.17Å; L638-L641 HydrophobicContact CD1-CD1 4.24Å; L638-L641 WeakPolarHBondContact O-CB 3.47Å; L638-L641 PolarHBondContact O-N 3.35Å; L638-I664 HydrophobicContact CD1-CD1 3.66Å; L638-I664 HydrophobicContact CD1-CG1 3.82Å; L638-I664 HydrophobicContact CG-CD1 4.29Å; L638-I664 HydrophobicContact CG-CG1 4.1Å; L638-L667 HydrophobicContact CD2-CD1 4.34Å
639L96.4Very high97Very high36 Ų3669.8 Ų69.819%0.18837%0.366CS..Hα-helixtrans-71.7-13.5-178.9-65.5172.7000113.8P603 A604 G635 Q636 A637 I664 L667 R668P603-L639 HydrophobicContact CB-CD1 4.2Å; P603-L639 HydrophobicContact CB-CD2 4.26Å; A604-L639 HydrophobicContact CB-CD1 3.75Å; G635-L639 VanDerWaalsContact O-CG 3.29Å; G635-L639 WeakPolarHBondContact O-CG 3.23Å; G635-L639 PolarHBondContact O-N 3.03Å; Q636-L639 PolarHBondContact O-N 2.93Å; A637-L639 VanDerWaalsContact C-N 3.33Å; A637-L639 PolarHBondContact O-N 3.34Å; L639-I664 HydrophobicContact CD2-CG2 4.46Å; L639-L667 HydrophobicContact CD2-CB 4.16Å; L639-R668 HydrophobicContact CD2-CG 3.76Å
640L96.6Very high96.9Very high132 Ų13265.8 Ų65.869%0.69134%0.344SS*.Hα-helixtrans-97-8.1174.8-64.1172.4000113.1Q636 A637 L638Q636-L640 WeakPolarHBondContact O-CG 3.29Å; Q636-L640 PolarHBondContact O-N 3.36Å; A637-L640 PolarHBondContact O-N 3.17Å; L638-L640 PolarHBondContact O-N 3.17Å
641L96.8Very high96.9Very high28 Ų2868.1 Ų68.115%0.14735%0.35CS..  trans-67.4134.7178.5-65.9-179.9000111.9F628 I633 A637 L638 H645 L646 I664F628-L641 HydrophobicContact CD1-CD1 4.45Å; F628-L641 HydrophobicContact CE1-CD1 3.56Å; F628-L641 HydrophobicContact CZ-CD1 4.16Å; I633-L641 HydrophobicContact CD1-CD1 4.13Å; I633-L641 HydrophobicContact CG2-CD1 4.16Å; A637-L641 WeakPolarHBondContact O-CG 3.33Å; A637-L641 PolarHBondContact O-N 3.21Å; L638-L641 HydrophobicContact CD1-CD1 4.24Å; L638-L641 WeakPolarHBondContact O-CB 3.47Å; L638-L641 PolarHBondContact O-N 3.35Å; L641-H645 HydrophobicContact CD2-CB 4.1Å; L641-L646 HydrophobicContact CB-CD2 4.49Å; L641-L646 HydrophobicContact CD1-CD2 3.83Å; L641-I664 HydrophobicContact CB-CD1 4.24Å
642R96.1Very high96.9Very high132 Ų13263.5 Ų63.550%0.49833%0.329SS..  trans-116.3163172.5-58.1-177.6-57.2103.717.8109.1D644 H645 L646R642-D644 IonicContact CZ-OD2 3.21Å; R642-D644 IonicContact NH1-OD2 2.73Å; R642-D644 PolarHBondContact NH1-OD2 3.4Å; R642-D644 IonicContact NH2-OD2 3.81Å; R642-D644 PolarHBondContact NH2-OD2 3.43Å; R642-D644 PolarHBondContact O-N 2.98Å; R642-H645 PolarHBondContact N-ND1 2.79Å; R642-H645 PolarHBondContact NH2-NE2 2.83Å; R642-H645 WeakPolarHBondContact O-CB 3.49Å; R642-H645 PolarHBondContact O-N 3.37Å; R642-L646 PolarHBondContact O-N 2.88Å
643E97.4Very high96.9Very high76 Ų7663.9 Ų63.936%0.35533%0.328SS..Hα-helixtrans-49.8-44.3179.1-174.1178155.800112.1H645 L646 I647 L654 L658E643-H645 VanDerWaalsContact C-N 3.28Å; E643-H645 PolarHBondContact O-N 3.08Å; E643-L646 PolarHBondContact O-N 3.05Å; E643-I647 HydrophobicContact CG-CD1 3.65Å; E643-I647 HydrophobicContact CG-CG1 4.41Å; E643-I647 WeakPolarHBondContact O-CG1 3.34Å; E643-I647 PolarHBondContact O-N 2.98Å; E643-L654 WeakPolarHBondContact OE1-CD1 3.29Å; E643-L658 HydrophobicContact CG-CD2 4.47Å; E643-L658 VanDerWaalsContact OE2-CD2 3.32Å; E643-L658 WeakPolarHBondContact OE2-CD2 3.18Å
644D97Very high96.8Very high89 Ų8967.7 Ų67.748%0.47635%0.348SS..Hα-helixtrans-50.9-42.6174.5-53.6-24.9000113.3R642 S648R642-D644 IonicContact CZ-OD2 3.21Å; R642-D644 IonicContact NH1-OD2 2.73Å; R642-D644 PolarHBondContact NH1-OD2 3.4Å; R642-D644 IonicContact NH2-OD2 3.81Å; R642-D644 PolarHBondContact NH2-OD2 3.43Å; R642-D644 PolarHBondContact O-N 2.98Å; D644-S648 WeakPolarHBondContact O-CA 3.43Å; D644-S648 WeakPolarHBondContact O-CB 3.49Å; D644-S648 PolarHBondContact O-N 2.88Å
645H97.5Very high96.8Very high63 Ų6367 Ų6729%0.29236%0.355SS..Iπ-helixtrans-71.4-41.8-175.7-54167.3000110.5L641 R642 E643 T649 M650L641-H645 HydrophobicContact CD2-CB 4.1Å; R642-H645 PolarHBondContact N-ND1 2.79Å; R642-H645 PolarHBondContact NH2-NE2 2.83Å; R642-H645 WeakPolarHBondContact O-CB 3.49Å; R642-H645 PolarHBondContact O-N 3.37Å; E643-H645 VanDerWaalsContact C-N 3.28Å; E643-H645 PolarHBondContact O-N 3.08Å; H645-T649 WeakPolarHBondContact O-CA 3.41Å; H645-T649 VanDerWaalsContact O-CB 3.25Å; H645-T649 WeakPolarHBondContact O-CB 3.39Å; H645-T649 PolarHBondContact O-N 3.01Å; H645-M650 PolarHBondContact O-N 2.81Å; H645-M650 VanDerWaalsContact O-N 3.09Å
646L97.5Very high96.8Very high0 Ų068.7 Ų68.70%037%0.365CS..Iπ-helixtrans-64-44.8177-58.1-176.5000110.9F628 L641 R642 E643 M650 N651 I652 A657 I660 C661F628-L646 HydrophobicContact CZ-CD2 3.81Å; L641-L646 HydrophobicContact CB-CD2 4.49Å; L641-L646 HydrophobicContact CD1-CD2 3.83Å; R642-L646 PolarHBondContact O-N 2.88Å; E643-L646 PolarHBondContact O-N 3.05Å; L646-M650 HydrophobicContact CD2-SD 3.82Å; L646-M650 CarbonylContact O-C 3.38Å; L646-M650 WeakPolarHBondContact O-CB 3.16Å; L646-N651 PolarHBondContact O-N 3.31Å; L646-I652 HydrophobicContact CB-CB 4.38Å; L646-I652 HydrophobicContact CB-CD1 4.32Å; L646-I652 HydrophobicContact CD2-CD1 4.19Å; L646-I652 WeakPolarHBondContact O-CB 3.3Å; L646-I652 PolarHBondContact O-N 3.35Å; L646-A657 HydrophobicContact CB-CB 3.83Å; L646-A657 HydrophobicContact CD1-CB 4.03Å; L646-A657 WeakPolarHBondContact CD1-O 3.47Å; L646-I660 HydrophobicContact CD1-CB 3.89Å; L646-I660 HydrophobicContact CD1-CG2 3.77Å; L646-C661 VanDerWaalsContact CD1-SG 3.56Å
647I97.5Very high96.8Very high63 Ų6363 Ų6332%0.32334%0.339SS..Iπ-helixtrans-78.9-44.1-175.5-59.8175.5000112.1E643 N651 I652 L654 A657E643-I647 HydrophobicContact CG-CD1 3.65Å; E643-I647 HydrophobicContact CG-CG1 4.41Å; E643-I647 WeakPolarHBondContact O-CG1 3.34Å; E643-I647 PolarHBondContact O-N 2.98Å; I647-N651 VanDerWaalsContact O-CA 3.26Å; I647-N651 WeakPolarHBondContact O-CA 3.28Å; I647-N651 PolarHBondContact O-N 3.04Å; I647-I652 WeakPolarHBondContact CA-O 3.37Å; I647-L654 HydrophobicContact CD1-CB 4.22Å; I647-L654 HydrophobicContact CD1-CD1 3.57Å; I647-A657 HydrophobicContact CD1-CB 4.27Å; I647-A657 HydrophobicContact CG1-CB 3.74Å
648S96.3Very high96.8Very high91 Ų9165.2 Ų65.264%0.63635%0.346SS*.Iπ-helixtrans-84.3-52.6-174.8-171.20000112.3D644 N651D644-S648 WeakPolarHBondContact O-CA 3.43Å; D644-S648 WeakPolarHBondContact O-CB 3.49Å; D644-S648 PolarHBondContact O-N 2.88Å; S648-N651 PolarHBondContact O-ND2 3.5Å; S648-N651 VanDerWaalsContact O-ND2 3.11Å
649T94.3Very high96.8Very high90 Ų9069.8 Ų69.855%0.55237%0.365SS*.Iπ-helixtrans-82.1-42.8-173.5-45.20000111.9H645H645-T649 WeakPolarHBondContact O-CA 3.41Å; H645-T649 VanDerWaalsContact O-CB 3.25Å; H645-T649 WeakPolarHBondContact O-CB 3.39Å; H645-T649 PolarHBondContact O-N 3.01Å
650M96.1Very high96.8Very high6 Ų668 Ų683%0.0336%0.356CS..SBendtrans-94.8-0.1179.4-52.9179.876.500113.4Q627 F628 Q631 I633 H645 L646 I652Q627-M650 HydrophobicContact CB-CE 4.22Å; Q627-M650 VanDerWaalsContact CD-O 3.25Å; Q627-M650 HydrophobicContact CG-CE 4.07Å; Q627-M650 PolarHBondContact NE2-O 3.48Å; Q627-M650 WeakPolarHBondContact O-CE 3.41Å; Q627-M650 PolarHBondContact OE1-O 2.71Å; F628-M650 HydrophobicContact CD1-CE 4.44Å; F628-M650 HydrophobicContact CD2-CE 3.61Å; F628-M650 HydrophobicContact CE2-CE 3.71Å; F628-M650 HydrophobicContact CE2-SD 4.29Å; F628-M650 HydrophobicContact CG-CE 3.99Å; F628-M650 HydrophobicContact CZ-CE 4.17Å; F628-M650 HydrophobicContact CZ-SD 4.25Å; Q631-M650 HydrophobicContact CG-CE 4.22Å; I633-M650 HydrophobicContact CD1-CE 3.65Å; I633-M650 HydrophobicContact CD1-SD 3.7Å; H645-M650 PolarHBondContact O-N 2.81Å; H645-M650 VanDerWaalsContact O-N 3.09Å; L646-M650 HydrophobicContact CD2-SD 3.82Å; L646-M650 CarbonylContact O-C 3.38Å; L646-M650 WeakPolarHBondContact O-CB 3.16Å; M650-I652 HydrophobicContact CB-CD1 3.78Å; M650-I652 HydrophobicContact CB-CG1 3.81Å; M650-I652 HydrophobicContact CE-CD1 4.21Å; M650-I652 PolarHBondContact O-N 3.34Å; M650-I652 HydrophobicContact SD-CD1 4.1Å
651N96.3Very high96.8Very high131 Ų13162.5 Ų62.570%0.70133%0.329SS*.  trans5421-179-48.7133.4000115L646 I647 S648L646-N651 PolarHBondContact O-N 3.31Å; I647-N651 VanDerWaalsContact O-CA 3.26Å; I647-N651 WeakPolarHBondContact O-CA 3.28Å; I647-N651 PolarHBondContact O-N 3.04Å; S648-N651 PolarHBondContact O-ND2 3.5Å; S648-N651 VanDerWaalsContact O-ND2 3.11Å
652I96.4Very high96.8Very high7 Ų763.9 Ų63.94%0.03634%0.344CS..  trans-71.6131.7-179.6-61.3172.4000108.5L624 F628 L646 I647 M650 P656 A657 I660L624-I652 HydrophobicContact CD1-CD1 4.44Å; L624-I652 HydrophobicContact CD1-CG2 3.79Å; L624-I652 HydrophobicContact CD2-CG1 4.35Å; F628-I652 HydrophobicContact CE2-CD1 3.94Å; L646-I652 HydrophobicContact CB-CB 4.38Å; L646-I652 HydrophobicContact CB-CD1 4.32Å; L646-I652 HydrophobicContact CD2-CD1 4.19Å; L646-I652 WeakPolarHBondContact O-CB 3.3Å; L646-I652 PolarHBondContact O-N 3.35Å; I647-I652 WeakPolarHBondContact CA-O 3.37Å; M650-I652 HydrophobicContact CB-CD1 3.78Å; M650-I652 HydrophobicContact CB-CG1 3.81Å; M650-I652 HydrophobicContact CE-CD1 4.21Å; M650-I652 PolarHBondContact O-N 3.34Å; M650-I652 HydrophobicContact SD-CD1 4.1Å; I652-P656 HydrophobicContact CG2-CB 3.88Å; I652-A657 HydrophobicContact CG2-CB 4.14Å; I652-I660 HydrophobicContact CD1-CD1 4.49Å
653K97.7Very high96.8Very high174 Ų17459.2 Ų59.276%0.75733%0.331SS*.  trans-60.2143.2178.6-67.6168.1-176.1164.40110.4G655 P656 A657K653-G655 PolarHBondContact O-N 2.98Å; K653-P656 WeakPolarHBondContact O-CD 3.4Å; K653-A657 PolarHBondContact O-N 3.04Å
654L96.9Very high96.8Very high93 Ų9355.7 Ų55.749%0.48732%0.315SS..Hα-helixtrans-44.8-43.3-178.9177.462.4000113.9E643 I647 A657 L658E643-L654 WeakPolarHBondContact OE1-CD1 3.29Å; I647-L654 HydrophobicContact CD1-CB 4.22Å; I647-L654 HydrophobicContact CD1-CD1 3.57Å; L654-A657 PolarHBondContact O-N 3.03Å; L654-L658 HydrophobicContact CD1-CD1 3.75Å; L654-L658 HydrophobicContact CD1-CD2 4.47Å; L654-L658 HydrophobicContact CD1-CG 3.87Å; L654-L658 HydrophobicContact CG-CD1 3.91Å; L654-L658 HydrophobicContact CG-CG 4.42Å; L654-L658 WeakPolarHBondContact O-CB 3.37Å; L654-L658 VanDerWaalsContact O-CG 3.29Å; L654-L658 WeakPolarHBondContact O-CG 3.39Å; L654-L658 PolarHBondContact O-N 3.31Å
655G96.6Very high96.7Very high43 Ų4355.6 Ų55.644%0.44331%0.314SS..Hα-helixtrans-58.4-61.5179.300000113.7K653 A657 L658 K659K653-G655 PolarHBondContact O-N 2.98Å; G655-A657 VanDerWaalsContact C-N 3.34Å; G655-A657 PolarHBondContact O-N 2.98Å; G655-L658 PolarHBondContact O-N 2.85Å; G655-K659 PolarHBondContact O-N 3.17Å
656P97.1Very high96.5Very high34 Ų3456.6 Ų56.622%0.22133%0.329CS..Hα-helixtrans-58-38.1171-28.334.8000114.7L624 I652 K653 L658 K659 I660L624-P656 HydrophobicContact CD1-CB 3.73Å; I652-P656 HydrophobicContact CG2-CB 3.88Å; K653-P656 WeakPolarHBondContact O-CD 3.4Å; P656-L658 PolarHBondContact O-N 3.01Å; P656-K659 WeakPolarHBondContact O-CB 3.29Å; P656-K659 PolarHBondContact O-N 2.95Å; P656-I660 WeakPolarHBondContact O-CG1 3.48Å; P656-I660 PolarHBondContact O-N 3.39Å
657A97.9Very high96.2Very high0 Ų058.8 Ų58.80%034%0.34CS..Hα-helixtrans-59.4-46.4177.900000111.9L646 I647 I652 K653 L654 G655 K659 I660 C661L646-A657 HydrophobicContact CB-CB 3.83Å; L646-A657 HydrophobicContact CD1-CB 4.03Å; L646-A657 WeakPolarHBondContact CD1-O 3.47Å; I647-A657 HydrophobicContact CD1-CB 4.27Å; I647-A657 HydrophobicContact CG1-CB 3.74Å; I652-A657 HydrophobicContact CG2-CB 4.14Å; K653-A657 PolarHBondContact O-N 3.04Å; L654-A657 PolarHBondContact O-N 3.03Å; G655-A657 VanDerWaalsContact C-N 3.34Å; G655-A657 PolarHBondContact O-N 2.98Å; A657-K659 VanDerWaalsContact C-N 3.34Å; A657-K659 PolarHBondContact O-N 2.86Å; A657-I660 PolarHBondContact O-N 2.77Å; A657-C661 PolarHBondContact O-N 3.11Å
658L97.3Very high95.8Very high82 Ų8263.7 Ų63.743%0.42936%0.355SS..Hα-helixtrans-62.5-36.1175.6-73.1170.3000113E643 L654 G655 P656 A662E643-L658 HydrophobicContact CG-CD2 4.47Å; E643-L658 VanDerWaalsContact OE2-CD2 3.32Å; E643-L658 WeakPolarHBondContact OE2-CD2 3.18Å; L654-L658 HydrophobicContact CD1-CD1 3.75Å; L654-L658 HydrophobicContact CD1-CD2 4.47Å; L654-L658 HydrophobicContact CD1-CG 3.87Å; L654-L658 HydrophobicContact CG-CD1 3.91Å; L654-L658 HydrophobicContact CG-CG 4.42Å; L654-L658 WeakPolarHBondContact O-CB 3.37Å; L654-L658 VanDerWaalsContact O-CG 3.29Å; L654-L658 WeakPolarHBondContact O-CG 3.39Å; L654-L658 PolarHBondContact O-N 3.31Å; G655-L658 PolarHBondContact O-N 2.85Å; P656-L658 PolarHBondContact O-N 3.01Å; L658-A662 WeakPolarHBondContact O-CB 3.3Å; L658-A662 PolarHBondContact O-N 2.82Å
659K96.9Very high94.8Very high95 Ų9568.2 Ų68.241%0.41337%0.366SS..Hα-helixtrans-61-50.3172.2-66.1178.2-175.8173.80110.9Q619 G655 P656 A657 A662 S663Q619-K659 PolarHBondContact O-NZ 3.29Å; G655-K659 PolarHBondContact O-N 3.17Å; P656-K659 WeakPolarHBondContact O-CB 3.29Å; P656-K659 PolarHBondContact O-N 2.95Å; A657-K659 VanDerWaalsContact C-N 3.34Å; A657-K659 PolarHBondContact O-N 2.86Å; K659-A662 WeakPolarHBondContact O-CB 3.46Å; K659-A662 PolarHBondContact O-N 3.2Å; K659-S663 PolarHBondContact O-N 3.27Å; K659-S663 PolarHBondContact O-OG 3.05Å
660I97.2Very high94.9Very high0 Ų067.2 Ų67.20%036%0.357CS..Hα-helixtrans-62.7-46.9-177.1-68165.8000109.9I615 L618 L624 F628 L646 I652 P656 A657 A662 S663 I664I615-I660 HydrophobicContact CD1-CD1 4.4Å; I615-I660 HydrophobicContact CD1-CG1 4.19Å; I615-I660 HydrophobicContact CD1-CG2 3.86Å; L618-I660 HydrophobicContact CD1-CG1 4.09Å; L624-I660 HydrophobicContact CD1-CD1 3.85Å; F628-I660 HydrophobicContact CE2-CD1 4.16Å; F628-I660 HydrophobicContact CZ-CD1 4.27Å; F628-I660 HydrophobicContact CZ-CG2 4.06Å; L646-I660 HydrophobicContact CD1-CB 3.89Å; L646-I660 HydrophobicContact CD1-CG2 3.77Å; I652-I660 HydrophobicContact CD1-CD1 4.49Å; P656-I660 WeakPolarHBondContact O-CG1 3.48Å; P656-I660 PolarHBondContact O-N 3.39Å; A657-I660 PolarHBondContact O-N 2.77Å; I660-A662 VanDerWaalsContact C-N 3.33Å; I660-A662 PolarHBondContact O-N 3.46Å; I660-S663 PolarHBondContact O-N 2.85Å; I660-I664 HydrophobicContact CG2-CD1 3.61Å; I660-I664 HydrophobicContact CG2-CG1 4.26Å; I660-I664 VanDerWaalsContact O-CG1 3.28Å; I660-I664 WeakPolarHBondContact O-CG1 3.22Å; I660-I664 PolarHBondContact O-N 3.49Å
661C96.7Very high94.8Very high16 Ų1670.4 Ų70.411%0.10837%0.374CS..Hα-helixtrans-61.4-37.4174.9-72.70000113.1L646 A657 N665L646-C661 VanDerWaalsContact CD1-SG 3.56Å; A657-C661 PolarHBondContact O-N 3.11Å; C661-N665 PolarHBondContact O-N 3.01Å; C661-N665 PolarHBondContact O-ND2 3.07Å
662A96.5Very high94.7Very high57 Ų5767 Ų6747%0.47136%0.356SS..Hα-helixtrans-63.1-45.6173.400000111.5L658 K659 I660 N665 S666L658-A662 WeakPolarHBondContact O-CB 3.3Å; L658-A662 PolarHBondContact O-N 2.82Å; K659-A662 WeakPolarHBondContact O-CB 3.46Å; K659-A662 PolarHBondContact O-N 3.2Å; I660-A662 VanDerWaalsContact C-N 3.33Å; I660-A662 PolarHBondContact O-N 3.46Å; A662-N665 PolarHBondContact O-N 3.17Å; A662-S666 PolarHBondContact O-N 3.15Å; A662-S666 VanDerWaalsContact O-N 3.09Å; A662-S666 PolarHBondContact O-OG 3.36Å
663S96.1Very high94.6Very high33 Ų3370.5 Ų70.523%0.23137%0.374CS..Hα-helixtrans-66.1-38.4177.1-620000113.2L618 K659 I660 S666 L667L618-S663 WeakPolarHBondContact CD2-OG 3.48Å; K659-S663 PolarHBondContact O-N 3.27Å; K659-S663 PolarHBondContact O-OG 3.05Å; I660-S663 PolarHBondContact O-N 2.85Å; S663-S666 CarbonylContact O-C 3.57Å; S663-S666 PolarHBondContact O-N 3.28Å; S663-L667 PolarHBondContact O-N 3.03Å
664I96.1Very high94.4Very high3 Ų364.1 Ų64.12%0.01535%0.35CS..Hα-helixtrans-62.7-41.7173.5-69.5165.3000110.8L638 L639 L641 I660 S666 L667 R668L638-I664 HydrophobicContact CD1-CD1 3.66Å; L638-I664 HydrophobicContact CD1-CG1 3.82Å; L638-I664 HydrophobicContact CG-CD1 4.29Å; L638-I664 HydrophobicContact CG-CG1 4.1Å; L639-I664 HydrophobicContact CD2-CG2 4.46Å; L641-I664 HydrophobicContact CB-CD1 4.24Å; I660-I664 HydrophobicContact CG2-CD1 3.61Å; I660-I664 HydrophobicContact CG2-CG1 4.26Å; I660-I664 VanDerWaalsContact O-CG1 3.28Å; I660-I664 WeakPolarHBondContact O-CG1 3.22Å; I660-I664 PolarHBondContact O-N 3.49Å; I664-S666 VanDerWaalsContact C-N 3.29Å; I664-S666 PolarHBondContact O-N 3.18Å; I664-L667 WeakPolarHBondContact O-CB 3.29Å; I664-L667 PolarHBondContact O-N 3.29Å; I664-R668 WeakPolarHBondContact O-CG 3.49Å
665N94.9Very high94.2Very high86 Ų8662.1 Ų62.146%0.4634%0.341SS..Hα-helixtrans-64.8-34175.5-73.3-41.6000112C661 A662 L667 R668 E669C661-N665 PolarHBondContact O-N 3.01Å; C661-N665 PolarHBondContact O-ND2 3.07Å; A662-N665 PolarHBondContact O-N 3.17Å; N665-L667 PolarHBondContact O-N 3.49Å; N665-R668 PolarHBondContact O-N 2.99Å; N665-R668 PolarHBondContact OD1-NH1 2.91Å; N665-E669 PolarHBondContact O-N 3.13Å
666S93.8Very high94.1Very high85 Ų8563.5 Ų63.559%0.59433%0.334SS*.THydrogen-bonded Turntrans-72.4-0.1170.4-58.70000115.2A662 S663 I664A662-S666 PolarHBondContact O-N 3.15Å; A662-S666 VanDerWaalsContact O-N 3.09Å; A662-S666 PolarHBondContact O-OG 3.36Å; S663-S666 CarbonylContact O-C 3.57Å; S663-S666 PolarHBondContact O-N 3.28Å; I664-S666 VanDerWaalsContact C-N 3.29Å; I664-S666 PolarHBondContact O-N 3.18Å
667L92.4Very high93.8Very high45 Ų4565.8 Ų65.824%0.23634%0.343CS..THydrogen-bonded Turntrans-101.41.7166.6-62.8176.8000112.6P603 W606 F614 L638 L639 S663 I664 N665P603-L667 HydrophobicContact CB-CB 4.22Å; P603-L667 HydrophobicContact CB-CD1 4.43Å; P603-L667 HydrophobicContact CG-CB 4.13Å; P603-L667 HydrophobicContact CG-CD2 4.21Å; W606-L667 HydrophobicContact CH2-CD1 3.53Å; W606-L667 HydrophobicContact CH2-CD2 3.69Å; W606-L667 HydrophobicContact CH2-CG 4.26Å; W606-L667 HydrophobicContact CZ2-CD2 4.39Å; W606-L667 HydrophobicContact CZ3-CD1 3.48Å; W606-L667 VanDerWaalsContact CZ3-CD1 3.48Å; W606-L667 HydrophobicContact CZ3-CD2 4.5Å; F614-L667 HydrophobicContact CD1-CD1 4.47Å; F614-L667 HydrophobicContact CD2-CD1 4.38Å; F614-L667 HydrophobicContact CE1-CD1 3.88Å; F614-L667 HydrophobicContact CE2-CD1 3.78Å; F614-L667 HydrophobicContact CE2-CD2 4.34Å; F614-L667 HydrophobicContact CE2-CG 4.28Å; F614-L667 HydrophobicContact CZ-CD1 3.49Å; F614-L667 VanDerWaalsContact CZ-CD1 3.49Å; F614-L667 HydrophobicContact CZ-CG 4.16Å; L638-L667 HydrophobicContact CD2-CD1 4.34Å; L639-L667 HydrophobicContact CD2-CB 4.16Å; S663-L667 PolarHBondContact O-N 3.03Å; I664-L667 WeakPolarHBondContact O-CB 3.29Å; I664-L667 PolarHBondContact O-N 3.29Å; N665-L667 PolarHBondContact O-N 3.49Å
668R88.7Confident93.5Very high167 Ų16771.3 Ų71.363%0.6337%0.371SS*.THydrogen-bonded Turntrans-116-10.7-177.8-63.6172.368.6-1493.7113.4L639 I664 N665L639-R668 HydrophobicContact CD2-CG 3.76Å; I664-R668 WeakPolarHBondContact O-CG 3.49Å; N665-R668 PolarHBondContact O-N 2.99Å; N665-R668 PolarHBondContact OD1-NH1 2.91Å
669E75.4Confident93.2Very high186 Ų18670.3 Ų70.387%0.86937%0.366SS*.  trans-97.20169.4-173.6-175.516600109.8K456 N665K456-E669 IonicContact NZ-OE1 3.94Å; K456-E669 PolarHBondContact NZ-OE1 3.41Å; N665-E669 PolarHBondContact O-N 3.13Å

Retrieved 669 of 669 residues in 276.4 ms (Link to these results)