A0A075BIA6_DROME Loading...

Pumilio

AlphaFold DB , UniProt , Accession A0A075BIA6, Species DROME (Drosophila melanogaster, Fruit fly), Gene pum, Length 596 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
1A29.4Very low30.2Very low157 Ų157117.2 Ų117.2100%1.29888%0.877SS**  0143.1000000108
2A27.3Very low30.1Very low90 Ų90125.2 Ų125.274%0.74488%0.881SS**  cis-156.3142.8-16.200000105.3
3A27.9Very low30Very low95 Ų95133.5 Ų133.579%0.78588%0.881SS**  56.6106.46000000113.8
4A30Very low31.1Very low110 Ų110133.2 Ų133.291%0.90988%0.878SS**  trans70.4103.5159.800000121.3
5A34.5Very low31Very low95 Ų95127.6 Ų127.679%0.78585%0.853SS**  -155.4120129.900000106.2
6A30.8Very low30.9Very low98 Ų98125.4 Ų125.481%0.8185%0.848SS**  cis70.3136.546.500000114.3
7A31.2Very low30.9Very low102 Ų102128.6 Ų128.684%0.84385%0.85SS**  cis-176.1128.6-27.300000109.2
8A28.9Very low31Very low108 Ų108127.4 Ų127.489%0.89385%0.845SS**  trans-159148.1164.300000109.7
9A31.1Very low30.9Very low106 Ų106124.8 Ų124.888%0.87684%0.842SS**  cis-129-179.43.800000112.4
10R32.3Very low30.9Very low257 Ų257123.4 Ų123.497%0.9784%0.839SS**  trans-117.3150.2-169.3-99.8-179.1160.7-159.8-2.5113.8
11G28.7Very low31Very low71 Ų71122 Ų12273%0.73284%0.837SS**  trans131.2135.6153.700000114
12K29Very low31.1Very low213 Ų213120.1 Ų120.193%0.92681%0.814SS**  cis-145.2160.5-2.6-69.8177.4179173.70110.1
13W28.8Very low31.1Very low234 Ų234119.8 Ų119.889%0.88682%0.819SS**  trans-128.1159.5164.6-134.515000107.5
14P45.4Very low31.3Very low129 Ų129118.8 Ų118.884%0.83881%0.812SS**  -137.7-179.964.933.5-13.3000113.9
15G29.4Very low31.3Very low49 Ų49124.9 Ų124.951%0.50581%0.813SS.*  cis167.2-161.4-4.100000112.3
16A29.8Very low31Very low93 Ų93123.7 Ų123.777%0.76981%0.81SS**  trans66.8123-173.100000114.6
17M30.2Very low30.9Very low180 Ų180123.5 Ų123.589%0.88781%0.808SS**  72.8132.158.2-66.117773.600112.6
18S32.7Very low30.8Very low107 Ų107127.3 Ų127.375%0.74881%0.813SS**  cis-164.7140.97.248.20000114.6
19G29.7Very low30.8Very low77 Ų77126 Ų12679%0.79481%0.811SS**  trans60.8-177.1153.900000119.5
20A31.5Very low30.7Very low96 Ų96126.4 Ų126.479%0.79381%0.814SS**  cis-179.9134.7-36.900000110.2
21A31.7Very low30.6Very low96 Ų96117.9 Ų117.979%0.79381%0.806SS**  trans61.2170.6163.500000118.1
22S31.5Very low30.6Very low116 Ų116122.8 Ų122.881%0.81182%0.815SS**  cis-168.1131.2-40.7-87.10000110.5
23G28.7Very low30.7Very low83 Ų83117.8 Ų117.886%0.85681%0.814SS**  trans67.3-174.8168.400000116.1
24A31.1Very low30.6Very low75 Ų75112.4 Ų112.462%0.6281%0.812SS**  cis-169162.2-24.600000109.2
25Y30.2Very low29.9Very low237 Ų237111.2 Ų111.293%0.92981%0.813SS**  trans65158.2177.8-44.2-83.5000115.4
26G27.8Very low30.1Very low70 Ų70114.4 Ų114.472%0.72283%0.827SS**  cis172.7144-14.500000115
27A29.8Very low30.1Very low94 Ų94116 Ų11678%0.77783%0.83SS**  trans70.1128.1143.600000123.9
28L29Very low30.1Very low183 Ų183115.9 Ų115.996%0.95883%0.832SS**  trans71.7136140.6-63.6165.5000121.8
29G28.9Very low29.8Very low81 Ų81114.5 Ų114.584%0.83584%0.835SS**  trans162126.1167.400000111.9
30A29.1Very low29.9Very low114 Ų114115.6 Ų115.694%0.94284%0.837SS**  trans-117157-171.600000113.7
31G29.3Very low29.8Very low78 Ų78116.7 Ų116.780%0.80484%0.835SS**  trans-173.7130.2172.400000113.6
32N29.1Very low29.7Very low173 Ų173119.9 Ų119.993%0.92584%0.837SS**  trans-86.2141.5179.8-79-12.4000112.8
33A30.4Very low29.6Very low109 Ų109120.6 Ų120.690%0.90184%0.837SS**  trans-166.4147.8137.500000110.7
34S27.6Very low29.8Very low121 Ų121122.3 Ų122.385%0.84683%0.833SS**  trans-118.4129.3179.658.10000112.3
35A30.9Very low29.8Very low104 Ų104124.2 Ų124.286%0.8684%0.839SS**  trans-146.1152.9166.500000110.7
36S32.6Very low29.8Very low115 Ų115119 Ų11980%0.80483%0.834SS**  trans-73.2158.5-168.7-60.50000114.4
37P31.1Very low30Very low127 Ų127121.9 Ų121.983%0.82584%0.843SS**  trans-83.5141.4-160.932.3-36.3000115.1
38L28.7Very low29.8Very low177 Ų177121.9 Ų121.993%0.92784%0.843SS**  trans-141.4142.9168-80.1170.2000109.9
39G27.8Very low29.6Very low78 Ų78122.4 Ų122.480%0.80484%0.841SS**  trans8690.7165.200000116.7
40A31.8Very low29.4Very low101 Ų101124 Ų12484%0.83584%0.839SS**  trans-93.8127.2159.700000109.8I42A40-I42 PolarHBondContact O-N 2.71Å
41P29.1Very low29.1Very low118 Ų118124 Ų12477%0.76683%0.831SS**  trans-84.7111-176.931.3-33.1000113.3
42I28.3Very low28.8Very low164 Ų164129 Ų12984%0.84184%0.838SS**  trans31.7106.3139.8-46175.1000117.5A40A40-I42 PolarHBondContact O-N 2.71Å
43T31.1Very low28.6Very low130 Ų130128.9 Ų128.980%0.79884%0.837SS**  trans-128.4142.9148.150.40000109.4
44P32.4Very low28.3Very low119 Ų119127.3 Ų127.377%0.77383%0.831SS**PPolyproline II helixtrans-74.6146.1-173.329.9-35.2000112.9
45P31.9Very low28.3Very low116 Ų116127.3 Ų127.375%0.75383%0.831SS**PPolyproline II helixtrans-91.5152-174.235.6-35.8000113.9
46P29.8Very low28.1Very low126 Ų126134 Ų13482%0.81883%0.834SS**PPolyproline II helixtrans-71.4145.7157.732.2-33.1000110.5
47S30.6Very low27.8Very low131 Ų131132.9 Ų132.992%0.91683%0.832SS**PPolyproline II helixtrans-80.4150.1-177.144.20000113.1
48A25.7Very low27.7Very low94 Ų94133.3 Ų133.378%0.77784%0.835SS**  trans-124141.9-171.100000113.7
49Q25.8Very low28.1Very low194 Ų194127.9 Ų127.991%0.90782%0.821SS**  trans-136.894.6154.2-72.2-174.8-12.100106.3
50S24.3Very low28.3Very low114 Ų114128.2 Ų128.280%0.79782%0.816SS**  82.4113.377.1-170.80000111.7
51C22.3Very low28.4Very low116 Ų116131.1 Ų131.178%0.78481%0.812SS**  trans-111.7134-171.9-48.20000110.2
52L23.2Very low28.9Very low181 Ų181129 Ų12995%0.94880%0.801SS**  trans-132.2134.6156.3-82.8178000110.4
53L26.1Very low29.4Very low172 Ų172130.8 Ų130.890%0.90180%0.797SS**  trans-91.8140.2-171.5-75.8149.1000111.5
54G23.7Very low29.6Very low76 Ų76131.9 Ų131.978%0.78479%0.793SS**  trans-129.790.9168.400000110.2
55S27.2Very low29.9Very low120 Ų120135.5 Ų135.584%0.83979%0.791SS**  trans-64.7136.3-170.3-54.70000113.7
56R27Very low30.4Very low246 Ų246136.1 Ų136.193%0.92878%0.784SS**  trans-143.9127.6165.1-144.8171-172.1172.12.3110.8
57A26.6Very low31Very low91 Ų91136.7 Ų136.775%0.75278%0.776SS**  trans-80.9148.1-169.600000113.4G59A57-G59 PolarHBondContact O-N 3.44Å
58P28.8Very low31.4Very low136 Ų136136.9 Ų136.988%0.88376%0.762SS**SBendtrans-76.3118.3175.630.8-33.3000111.1
59G35.9Very low32.1Very low62 Ų62139.7 Ų139.764%0.63976%0.759SS**  trans177.35.2178.400000118.3A57A57-G59 PolarHBondContact O-N 3.44Å
60A32.1Very low32.8Very low85 Ų85137.7 Ų137.770%0.70275%0.75SS**SBendtrans-98-29-171.800000115.3S62A60-S62 PolarHBondContact O-N 3.17Å
61E34.5Very low33.5Very low162 Ų162140.3 Ų140.376%0.75775%0.749SS**Hα-helixtrans-78.9-18.2-169-58.7-170.614100114.5
62S39.7Very low34.2Very low74 Ų74141.6 Ų141.652%0.51775%0.748SS.*Hα-helixtrans-67.6-41.7-175.349.60000113.2A60 Q64 Q66A60-S62 PolarHBondContact O-N 3.17Å; S62-Q64 PolarHBondContact O-N 3.21Å; S62-Q66 WeakPolarHBondContact O-CB 3.41Å; S62-Q66 PolarHBondContact O-N 3.29Å; S62-Q66 VanDerWaalsContact O-N 3.11Å
63R38.2Very low34.9Very low202 Ų202137.3 Ų137.376%0.76274%0.739SS**Hα-helixtrans-66.8-36.6-177.6-69-172.9179.5-1740.4113Q66 Q67R63-Q66 PolarHBondContact O-N 3.49Å; R63-Q67 PolarHBondContact O-N 2.68Å
64Q36.8Very low35.5Very low152 Ų152133.3 Ų133.371%0.7173%0.73SS**Hα-helixtrans-73.6-36.3-177.2-162166.10.900111.9S62 Q68S62-Q64 PolarHBondContact O-N 3.21Å; Q64-Q68 PolarHBondContact O-N 2.98Å
65R38.6Very low36.4Very low196 Ų196135.7 Ų135.774%0.7473%0.729SS**Hα-helixtrans-61.3-44166.8-76.4-169.6177.4-166.21.7111.8Q67 Q68 Q69R65-Q67 PolarHBondContact O-N 3.45Å; R65-Q68 PolarHBondContact O-N 3.1Å; R65-Q69 WeakPolarHBondContact O-CB 3.49Å; R65-Q69 PolarHBondContact O-N 2.79Å
66Q40.9Very low37.1Very low128 Ų128133.8 Ų133.860%0.59873%0.728SS**Hα-helixtrans-66.2-38.1-175.8-162.6170.514.900112.9S62 R63 Q70S62-Q66 WeakPolarHBondContact O-CB 3.41Å; S62-Q66 PolarHBondContact O-N 3.29Å; S62-Q66 VanDerWaalsContact O-N 3.11Å; R63-Q66 PolarHBondContact O-N 3.49Å; Q66-Q70 PolarHBondContact O-N 3.12Å
67Q42.7Very low37.4Very low138 Ų138129.3 Ų129.365%0.64572%0.722SS**Hα-helixtrans-66.6-42.5171.4-78.6-173.6-40.700112.5R63 R65 Q69 Q70R63-Q67 PolarHBondContact O-N 2.68Å; R65-Q67 PolarHBondContact O-N 3.45Å; Q67-Q69 PolarHBondContact O-N 3.34Å; Q67-Q70 PolarHBondContact O-N 3.13Å
68Q38.9Very low37.7Very low136 Ų136129.7 Ų129.764%0.63672%0.717SS**Hα-helixtrans-63.8-32.1178.7-166.3170.829.800112.2Q64 R65Q64-Q68 PolarHBondContact O-N 2.98Å; R65-Q68 PolarHBondContact O-N 3.1Å
69Q40.4Very low38.1Very low153 Ų153127.5 Ų127.572%0.71571%0.711SS**Hα-helixtrans-74.2-23.4177.4-160.3164.113.800113.4R65 Q67R65-Q69 WeakPolarHBondContact O-CB 3.49Å; R65-Q69 PolarHBondContact O-N 2.79Å; Q67-Q69 PolarHBondContact O-N 3.34Å
70Q41.9Very low38.2Very low152 Ų152130.5 Ų130.571%0.7172%0.716SS**Hα-helixtrans-78.6-22.2174.6-77.4-175.7-35.700113.9Q66 Q67Q66-Q70 PolarHBondContact O-N 3.12Å; Q67-Q70 PolarHBondContact O-N 3.13Å
71Q38.7Very low38.4Very low168 Ų168129.5 Ų129.579%0.78571%0.709SS**THydrogen-bonded Turntrans-84.7-6.7178-75.9-174.2-26.300114.8
72L37.1Very low38.3Very low143 Ų143125 Ų12575%0.74970%0.699SS**THydrogen-bonded Turntrans-96.7-2.6176.6-79163000114.1A74L72-A74 PolarHBondContact O-N 3.35Å; L72-A74 VanDerWaalsContact O-N 3.12Å
73A36.4Very low38.1Very low92 Ų92125 Ų12576%0.7670%0.704SS**THydrogen-bonded Turntrans-79.218.2179.400000114.4
74A40.3Very low37.9Very low87 Ų87118.5 Ų118.572%0.71969%0.693SS**THydrogen-bonded Turntrans-115.66.6-168.200000115.4L72L72-A74 PolarHBondContact O-N 3.35Å; L72-A74 VanDerWaalsContact O-N 3.12Å
75V41.2Very low37.7Very low126 Ų126118.4 Ų118.476%0.76469%0.692SS**SBendtrans-138.2119.2166.6-174.70000108.7L77V75-L77 PolarHBondContact O-N 3.21Å
76G41.8Very low37.5Very low80 Ų80112.2 Ų112.283%0.82568%0.683SS**  trans-79.6113.8-173.700000113.8
77L34.3Very low37.1Very low153 Ų153109.1 Ų109.180%0.80168%0.679SS**  trans-138.8149166.6-80.4172000110.2V75V75-L77 PolarHBondContact O-N 3.21Å
78P32.8Very low36.8Very low98 Ų98107.5 Ų107.564%0.63668%0.678SS**  trans-73142.4-170.928.3-34.8000113.7T80P78-T80 VanDerWaalsContact C-N 3.25Å; P78-T80 PolarHBondContact O-N 3.1Å; P78-T80 VanDerWaalsContact O-N 3.07Å
79A37.5Very low36.4Very low91 Ų91103.6 Ų103.675%0.75267%0.67SS**THydrogen-bonded Turntrans-70.6-4.8-165.600000116.6
80T37.5Very low36Very low124 Ų12499.2 Ų99.276%0.76166%0.659SS**Hα-helixtrans-78.4-21.7-175.547.10000114.3P78P78-T80 VanDerWaalsContact C-N 3.25Å; P78-T80 PolarHBondContact O-N 3.1Å; P78-T80 VanDerWaalsContact O-N 3.07Å
81A35.2Very low35.5Very low65 Ų6595.4 Ų95.454%0.53765%0.654SS.*Hα-helixtrans-75.7-35-179.700000113.6A83 Q85A81-A83 PolarHBondContact O-N 3.35Å; A81-Q85 PolarHBondContact O-N 3.26Å
82A34Very low35Very low68 Ų6890.2 Ų90.256%0.56264%0.64SS**Hα-helixtrans-66.8-36.3-170.100000113.7Q85 A86A82-Q85 PolarHBondContact O-N 2.77Å; A82-A86 PolarHBondContact O-N 3.43Å
83A35Very low34.7Very low74 Ų7488.8 Ų88.861%0.61263%0.633SS**Hα-helixtrans-66.5-42.2-177.900000112.6A81 Q85 A86 A87A81-A83 PolarHBondContact O-N 3.35Å; A83-Q85 VanDerWaalsContact C-N 3.32Å; A83-Q85 PolarHBondContact O-N 2.58Å; A83-A86 PolarHBondContact O-N 3.39Å; A83-A87 PolarHBondContact O-N 3.02Å
84A33Very low34.4Very low64 Ų6492.1 Ų92.153%0.52964%0.638SS.*Hα-helixtrans-63.5-39.3177.400000111.8A87 V88A84-A87 PolarHBondContact O-N 3.4Å; A84-V88 PolarHBondContact O-N 3.03Å
85Q33.7Very low34Very low151 Ų15194.6 Ų94.671%0.70664%0.636SS**Hα-helixtrans-71.2-31.9-177.7-150.3162.47.500112.4A81 A82 A83 A89A81-Q85 PolarHBondContact O-N 3.26Å; A82-Q85 PolarHBondContact O-N 2.77Å; A83-Q85 VanDerWaalsContact C-N 3.32Å; A83-Q85 PolarHBondContact O-N 2.58Å; Q85-A89 PolarHBondContact O-N 3.01Å
86A34.1Very low33.5Very low65 Ų6596.4 Ų96.454%0.53763%0.634SS.*Hα-helixtrans-68.5-39172.100000113A82 A83 A89 A90A82-A86 PolarHBondContact O-N 3.43Å; A83-A86 PolarHBondContact O-N 3.39Å; A86-A89 PolarHBondContact O-N 3.39Å; A86-A90 PolarHBondContact O-N 3.22Å; A86-A90 VanDerWaalsContact O-N 3.09Å
87A32.8Very low32.7Very low63 Ų6396 Ų9652%0.52163%0.63SS.*Hα-helixtrans-64.3-39.9178.300000112.6A83 A84 A89 A90 A91A83-A87 PolarHBondContact O-N 3.02Å; A84-A87 PolarHBondContact O-N 3.4Å; A87-A89 VanDerWaalsContact C-N 3.34Å; A87-A89 PolarHBondContact O-N 2.75Å; A87-A90 PolarHBondContact O-N 2.95Å; A87-A91 PolarHBondContact O-N 3.5Å; A87-A91 VanDerWaalsContact O-N 3.11Å
88V35.3Very low32.3Very low104 Ų10494.3 Ų94.363%0.6363%0.631SS**Hα-helixtrans-63.3-39.4175.6174.30000111.6A84 A91 A92A84-V88 PolarHBondContact O-N 3.03Å; V88-A91 PolarHBondContact O-N 2.72Å; V88-A92 PolarHBondContact O-N 3.48Å
89A30.8Very low32Very low55 Ų5597.2 Ų97.246%0.45564%0.641SS.*Hα-helixtrans-66.9-36.4176.100000112.8Q85 A86 A87 N93Q85-A89 PolarHBondContact O-N 3.01Å; A86-A89 PolarHBondContact O-N 3.39Å; A87-A89 VanDerWaalsContact C-N 3.34Å; A87-A89 PolarHBondContact O-N 2.75Å; A89-N93 PolarHBondContact O-N 3.34Å
90A31.7Very low31.5Very low60 Ų6098 Ų9850%0.49664%0.642SS.*Hα-helixtrans-67-39.9176.100000112.5A86 A87 A92 N93A86-A90 PolarHBondContact O-N 3.22Å; A86-A90 VanDerWaalsContact O-N 3.09Å; A87-A90 PolarHBondContact O-N 2.95Å; A90-A92 PolarHBondContact O-N 2.95Å; A90-N93 PolarHBondContact O-N 3.11Å
91A31.3Very low31.1Very low72 Ų7297 Ų9760%0.59564%0.64SS**Hα-helixtrans-63.7-39.4177.400000112.7A87 V88A87-A91 PolarHBondContact O-N 3.5Å; A87-A91 VanDerWaalsContact O-N 3.11Å; V88-A91 PolarHBondContact O-N 2.72Å
92A29.7Very low30.7Very low59 Ų59100.9 Ų100.949%0.48865%0.65SS.*Hα-helixtrans-65.1-39.1177.900000113V88 A90 N94 M95V88-A92 PolarHBondContact O-N 3.48Å; A90-A92 PolarHBondContact O-N 2.95Å; A92-N94 VanDerWaalsContact C-N 3.33Å; A92-N94 PolarHBondContact O-N 3.41Å; A92-M95 PolarHBondContact O-N 2.74Å
93N29.9Very low30.4Very low114 Ų114107.4 Ų107.461%0.6167%0.666SS**Hα-helixtrans-70.5-23.8-176.6-77.7-7.2000114.1A89 A90 M95A89-N93 PolarHBondContact O-N 3.34Å; A90-N93 PolarHBondContact O-N 3.11Å; N93-M95 PolarHBondContact O-N 3.3Å
94N30.3Very low29.9Very low161 Ų161109.3 Ų109.386%0.86168%0.675SS**THydrogen-bonded Turntrans-79.31174.4-906000113.7A92A92-N94 VanDerWaalsContact C-N 3.33Å; A92-N94 PolarHBondContact O-N 3.41Å
95M31.9Very low29.7Very low140 Ų140113.8 Ų113.869%0.6969%0.69SS**THydrogen-bonded Turntrans-104.9-3.6-178.2-151.1173.9-17000114A92 N93A92-M95 PolarHBondContact O-N 2.74Å; N93-M95 PolarHBondContact O-N 3.3Å
96F31.6Very low29.8Very low163 Ų163111.9 Ų111.972%0.71569%0.69SS**  trans-131.4115.6177.3-84.1-89.3000111.5
97G23.2Very low29.5Very low71 Ų71117.4 Ų117.473%0.73271%0.71SS**  trans-74.3141.4163.900000111.2
98S27.5Very low29.2Very low119 Ų119119 Ų11983%0.83272%0.722SS**SBendtrans70.1100.4169.2-59.70000118.4
99N26.4Very low29Very low159 Ų159121.7 Ų121.785%0.8573%0.732SS**  trans23.9116.7145.9-62.6-26.1000118
100S27.5Very low29Very low108 Ų108125 Ų12576%0.75575%0.749SS**  -179.7155.972.242.10000115.1
101S27.2Very low29.1Very low103 Ų103125.7 Ų125.772%0.7276%0.761SS**  trans50.697.4160.145.70000119.9
102I27.6Very low29.3Very low146 Ų146128.3 Ų128.375%0.74977%0.77SS**  trans-77.6123.4159-60.3166.7000109.6
103F27.5Very low29.5Very low205 Ų205128.3 Ų128.390%0.89977%0.77SS**  trans-154.4127.5147.2-103.7-72.4000109.4
104S25.1Very low29.8Very low114 Ų114126.6 Ų126.680%0.79777%0.772SS**  trans-144.5123.6177.7-66.40000110
105N27.5Very low30.2Very low158 Ų158124.6 Ų124.685%0.84577%0.765SS**  trans-151133.5161.9-158.251.7000108.3
106P36.1Very low30.6Very low111 Ų111120.9 Ų120.972%0.72176%0.757SS**  trans-91.1149.5-166.934.7-35.2000113.8
107L27.5Very low30.9Very low181 Ų181115.9 Ų115.995%0.94875%0.745SS**  trans-135.6144.5153.6-92169.6000108
108A28.1Very low31.5Very low95 Ų95115.4 Ų115.479%0.78574%0.735SS**  trans-106.5148-162.200000113.9
109I30.2Very low32.1Very low161 Ų161112.9 Ų112.983%0.82672%0.721SS**  trans-133.5130.5160.6-58.8-178.7000106.6
110P30.3Very low32.8Very low126 Ų126108.2 Ų108.282%0.81870%0.704SS**  trans-82.5152.9-173.133.1-35.6000113.1
111G35.2Very low33.2Very low73 Ų73105.9 Ų105.975%0.75369%0.692SS**SBendtrans155.3-75.4174.700000112.7
112T35.4Very low33.7Very low127 Ų127103.9 Ų103.978%0.77968%0.681SS**SBendtrans-92.3-4.9-17552.30000114.5A114T112-A114 VanDerWaalsContact C-N 3.28Å; T112-A114 PolarHBondContact O-N 3.36Å; T112-A114 VanDerWaalsContact O-N 3.16Å
113A33.7Very low34.3Very low59 Ų5999.7 Ų99.749%0.48867%0.669SS.*Hα-helixtrans-59.4-30.6-170.200000114.5A117A113-A117 WeakPolarHBondContact O-CB 3.31Å; A113-A117 PolarHBondContact O-N 2.93Å
114A35Very low34.9Very low78 Ų7891.7 Ų91.765%0.64564%0.64SS**Hα-helixtrans-63.2-46.7-175.400000113.2T112 A118T112-A114 VanDerWaalsContact C-N 3.28Å; T112-A114 PolarHBondContact O-N 3.36Å; T112-A114 VanDerWaalsContact O-N 3.16Å; A114-A118 WeakPolarHBondContact O-CB 3.44Å; A114-A118 PolarHBondContact O-N 3Å
115V39.8Very low35.5Very low119 Ų11988.6 Ų88.672%0.72162%0.622SS**Hα-helixtrans-72.3-42.8-178.5-173.70000110.7A118 A119V115-A118 PolarHBondContact O-N 3.41Å; V115-A119 PolarHBondContact O-N 3.01Å
116A39.8Very low36.2Very low63 Ų6386.3 Ų86.352%0.52161%0.609SS.*Hα-helixtrans-64.3-40176.400000112.2A120A116-A120 WeakPolarHBondContact O-CB 3.45Å; A116-A120 PolarHBondContact O-N 3.26Å
117A37.8Very low36.6Very low57 Ų5784.8 Ų84.847%0.47160%0.601SS.*Hα-helixtrans-69.9-36.1175.300000112.1A113 A121A113-A117 WeakPolarHBondContact O-CB 3.31Å; A113-A117 PolarHBondContact O-N 2.93Å; A117-A121 WeakPolarHBondContact O-CA 3.44Å; A117-A121 WeakPolarHBondContact O-CB 3.21Å; A117-A121 PolarHBondContact O-N 2.93Å
118A36Very low37.4Very low62 Ų6285.1 Ų85.151%0.51259%0.59SS.*Hα-helixtrans-63.5-47.1173.900000111.7A114 V115 A121 A122A114-A118 WeakPolarHBondContact O-CB 3.44Å; A114-A118 PolarHBondContact O-N 3Å; V115-A118 PolarHBondContact O-N 3.41Å; A118-A121 PolarHBondContact O-N 3.45Å; A118-A122 WeakPolarHBondContact O-CB 3.5Å; A118-A122 PolarHBondContact O-N 3.45Å
119A40.8Very low37.9Very low65 Ų6586.8 Ų86.854%0.53758%0.582SS.*Hα-helixtrans-63.4-45.5175.900000112.1V115 A121 A122 A123V115-A119 PolarHBondContact O-N 3.01Å; A119-A121 PolarHBondContact O-N 3.45Å; A119-A122 PolarHBondContact O-N 3.07Å; A119-A123 WeakPolarHBondContact O-CB 3.49Å; A119-A123 PolarHBondContact O-N 2.91Å
120A40.8Very low38.8Very low61 Ų6183.8 Ų83.850%0.50457%0.571SS.*Hα-helixtrans-65.8-35.4176.600000112.6A116 A124A116-A120 WeakPolarHBondContact O-CB 3.45Å; A116-A120 PolarHBondContact O-N 3.26Å; A120-A124 WeakPolarHBondContact O-CB 3.48Å; A120-A124 PolarHBondContact O-N 3.23Å
121A36Very low39.6Very low60 Ų6080.4 Ų80.450%0.49655%0.553SS.*Hα-helixtrans-70.5-39.7175.400000111.8A117 A118 A119 A124 A125A117-A121 WeakPolarHBondContact O-CA 3.44Å; A117-A121 WeakPolarHBondContact O-CB 3.21Å; A117-A121 PolarHBondContact O-N 2.93Å; A118-A121 PolarHBondContact O-N 3.45Å; A119-A121 PolarHBondContact O-N 3.45Å; A121-A124 PolarHBondContact O-N 3.01Å; A121-A125 WeakPolarHBondContact O-CB 3.29Å; A121-A125 PolarHBondContact O-N 3.17Å
122A36.7Very low40Very low60 Ų6079.6 Ų79.650%0.49654%0.539SS..Hα-helixtrans-64.3-45.8173.700000111.6A118 A119 A125 N126A118-A122 WeakPolarHBondContact O-CB 3.5Å; A118-A122 PolarHBondContact O-N 3.45Å; A119-A122 PolarHBondContact O-N 3.07Å; A122-A125 PolarHBondContact O-N 2.86Å; A122-N126 PolarHBondContact O-N 3.18Å
123A40.4Very low40.5Very low58 Ų5877.9 Ų77.948%0.47953%0.529SS..Hα-helixtrans-63.2-41.2175.100000112.4A119 S127A119-A123 WeakPolarHBondContact O-CB 3.49Å; A119-A123 PolarHBondContact O-N 2.91Å; A123-S127 VanDerWaalsContact O-CB 3.26Å; A123-S127 WeakPolarHBondContact O-CB 3.29Å; A123-S127 PolarHBondContact O-N 3.12Å; A123-S127 PolarHBondContact O-OG 2.89Å
124A41Very low41Very low37 Ų3777.9 Ų77.931%0.30653%0.529SS..Hα-helixtrans-70.1-32.3175.100000112.5A120 A121 R128A120-A124 WeakPolarHBondContact O-CB 3.48Å; A120-A124 PolarHBondContact O-N 3.23Å; A121-A124 PolarHBondContact O-N 3.01Å; A124-R128 WeakPolarHBondContact O-CB 3.31Å; A124-R128 WeakPolarHBondContact O-CD 3.45Å; A124-R128 WeakPolarHBondContact O-CG 3.31Å; A124-R128 PolarHBondContact O-N 3.23Å
125A37.1Very low41.3Very low49 Ų4976.9 Ų76.941%0.40552%0.52SS..Hα-helixtrans-67.6-51.1174.500000110.7A121 A122 S127 R128 Q129A121-A125 WeakPolarHBondContact O-CB 3.29Å; A121-A125 PolarHBondContact O-N 3.17Å; A122-A125 PolarHBondContact O-N 2.86Å; A125-S127 PolarHBondContact O-N 3.44Å; A125-R128 CarbonylContact O-C 3.06Å; A125-R128 PolarHBondContact O-N 2.89Å; A125-Q129 VanDerWaalsContact O-CB 3.31Å; A125-Q129 WeakPolarHBondContact O-CB 3.48Å; A125-Q129 PolarHBondContact O-N 3.37Å
126N41.6Very low41.4Very low110 Ų11073.8 Ų73.859%0.58851%0.507SS*.Hα-helixtrans-58.4-47.4174.1-96.3-5.5000111.7A122 R128 Q129 V130A122-N126 PolarHBondContact O-N 3.18Å; N126-R128 VanDerWaalsContact C-N 3.32Å; N126-R128 PolarHBondContact O-N 2.97Å; N126-Q129 PolarHBondContact O-N 3.04Å; N126-Q129 VanDerWaalsContact O-N 3.13Å; N126-V130 WeakPolarHBondContact O-CG2 3.45Å; N126-V130 PolarHBondContact O-N 3.11Å
127S45.9Very low41.8Very low79 Ų7973.8 Ų73.855%0.55251%0.508SS*.Hα-helixtrans-60-40.2176.3-62.10000112.4A123 A125 A131A123-S127 VanDerWaalsContact O-CB 3.26Å; A123-S127 WeakPolarHBondContact O-CB 3.29Å; A123-S127 PolarHBondContact O-N 3.12Å; A123-S127 PolarHBondContact O-OG 2.89Å; A125-S127 PolarHBondContact O-N 3.44Å; S127-A131 WeakPolarHBondContact O-CB 3.17Å; S127-A131 PolarHBondContact O-N 3.03Å
128R43.7Very low42.1Very low189 Ų18974 Ų7471%0.71351%0.509SS*.Hα-helixtrans-69.2-34.9174.3-77.1170.2-171.1-175.74.5112.4A124 A125 N126 A132A124-R128 WeakPolarHBondContact O-CB 3.31Å; A124-R128 WeakPolarHBondContact O-CD 3.45Å; A124-R128 WeakPolarHBondContact O-CG 3.31Å; A124-R128 PolarHBondContact O-N 3.23Å; A125-R128 CarbonylContact O-C 3.06Å; A125-R128 PolarHBondContact O-N 2.89Å; N126-R128 VanDerWaalsContact C-N 3.32Å; N126-R128 PolarHBondContact O-N 2.97Å; R128-A132 WeakPolarHBondContact O-CA 3.23Å; R128-A132 WeakPolarHBondContact O-CB 3.5Å; R128-A132 PolarHBondContact O-N 2.88Å
129Q39.3Very low42.4Very low130 Ų13073.9 Ų73.961%0.60751%0.508SS*.Hα-helixtrans-72.8-41.5-179.1-167.8165.3-8.100111A125 N126 A132 T133A125-Q129 VanDerWaalsContact O-CB 3.31Å; A125-Q129 WeakPolarHBondContact O-CB 3.48Å; A125-Q129 PolarHBondContact O-N 3.37Å; N126-Q129 PolarHBondContact O-N 3.04Å; N126-Q129 VanDerWaalsContact O-N 3.13Å; Q129-A132 PolarHBondContact O-N 3.02Å; Q129-T133 WeakPolarHBondContact O-CG2 3.37Å; Q129-T133 PolarHBondContact O-N 3Å; Q129-T133 PolarHBondContact O-OG1 2.88Å
130V49Very low42.8Very low98 Ų9876.1 Ų76.159%0.59452%0.515SS*.Hα-helixtrans-66.9-41.8170.7175.70000111.4N126 A132 T133 A134N126-V130 WeakPolarHBondContact O-CG2 3.45Å; N126-V130 PolarHBondContact O-N 3.11Å; V130-A132 VanDerWaalsContact C-N 3.31Å; V130-A132 PolarHBondContact O-N 3.14Å; V130-T133 PolarHBondContact O-OG1 3.17Å; V130-T133 VanDerWaalsContact O-OG1 3.1Å; V130-A134 VanDerWaalsContact O-CB 3.25Å; V130-A134 WeakPolarHBondContact O-CB 3.43Å; V130-A134 PolarHBondContact O-N 3.38Å
131A47.5Very low43.2Very low54 Ų5476.1 Ų76.145%0.44652%0.515SS..Hα-helixtrans-65.9-33.417400000112.3S127 A135S127-A131 WeakPolarHBondContact O-CB 3.17Å; S127-A131 PolarHBondContact O-N 3.03Å; A131-A135 WeakPolarHBondContact O-CB 3.42Å; A131-A135 PolarHBondContact O-N 3.25Å
132A42.5Very low43.4Very low56 Ų5676.8 Ų76.846%0.46352%0.52SS..Hα-helixtrans-74.9-38177.800000112.4R128 Q129 V130 A136R128-A132 WeakPolarHBondContact O-CA 3.23Å; R128-A132 WeakPolarHBondContact O-CB 3.5Å; R128-A132 PolarHBondContact O-N 2.88Å; Q129-A132 PolarHBondContact O-N 3.02Å; V130-A132 VanDerWaalsContact C-N 3.31Å; V130-A132 PolarHBondContact O-N 3.14Å; A132-A136 WeakPolarHBondContact O-CB 3.46Å; A132-A136 PolarHBondContact O-N 3.39Å
133T46.2Very low43.7Very low91 Ų9177.8 Ų77.856%0.55853%0.529SS*.Hα-helixtrans-69-40.9172.452.90000111.3Q129 V130 A136 A137Q129-T133 WeakPolarHBondContact O-CG2 3.37Å; Q129-T133 PolarHBondContact O-N 3Å; Q129-T133 PolarHBondContact O-OG1 2.88Å; V130-T133 PolarHBondContact O-OG1 3.17Å; V130-T133 VanDerWaalsContact O-OG1 3.1Å; T133-A136 PolarHBondContact O-N 3.06Å; T133-A137 WeakPolarHBondContact O-CB 3.28Å; T133-A137 PolarHBondContact O-N 2.88Å
134A43.5Very low44Very low60 Ų6078.5 Ų78.550%0.49654%0.535SS..Hα-helixtrans-63.4-42.217300000112.4V130 A138V130-A134 VanDerWaalsContact O-CB 3.25Å; V130-A134 WeakPolarHBondContact O-CB 3.43Å; V130-A134 PolarHBondContact O-N 3.38Å; A134-A138 VanDerWaalsContact O-CB 3.3Å; A134-A138 WeakPolarHBondContact O-CB 3.46Å; A134-A138 PolarHBondContact O-N 2.67Å
135A42.1Very low44.2Very low56 Ų5680.2 Ų80.246%0.46356%0.556SS.*Hα-helixtrans-71.3-34.3176.800000112.6A131 A138 A139A131-A135 WeakPolarHBondContact O-CB 3.42Å; A131-A135 PolarHBondContact O-N 3.25Å; A135-A138 PolarHBondContact O-N 2.99Å; A135-A139 WeakPolarHBondContact O-CB 3.5Å; A135-A139 PolarHBondContact O-N 3.34Å
136A42.1Very low44.4Very low54 Ų5480.3 Ų80.345%0.44656%0.562SS.*Hα-helixtrans-66.5-45.117300000111A132 T133 A138 A139 V140A132-A136 WeakPolarHBondContact O-CB 3.46Å; A132-A136 PolarHBondContact O-N 3.39Å; T133-A136 PolarHBondContact O-N 3.06Å; A136-A138 VanDerWaalsContact C-N 3.34Å; A136-A138 PolarHBondContact O-N 3.43Å; A136-A139 PolarHBondContact O-N 3.38Å; A136-V140 WeakPolarHBondContact O-CB 3.18Å; A136-V140 WeakPolarHBondContact O-CG2 3.46Å; A136-V140 PolarHBondContact O-N 3.17Å
137A47.6Very low44.3Very low64 Ų6482.3 Ų82.353%0.52958%0.578SS.*Hα-helixtrans-59.8-43.617300000111.7T133 A141T133-A137 WeakPolarHBondContact O-CB 3.28Å; T133-A137 PolarHBondContact O-N 2.88Å; A137-A141 WeakPolarHBondContact O-CB 3.46Å; A137-A141 PolarHBondContact O-N 3.46Å
138A44.3Very low44.7Very low60 Ų6082.5 Ų82.550%0.49659%0.592SS.*Hα-helixtrans-67.1-35.4175.800000113.2A134 A135 A136 A141 A142A134-A138 VanDerWaalsContact O-CB 3.3Å; A134-A138 WeakPolarHBondContact O-CB 3.46Å; A134-A138 PolarHBondContact O-N 2.67Å; A135-A138 PolarHBondContact O-N 2.99Å; A136-A138 VanDerWaalsContact C-N 3.34Å; A136-A138 PolarHBondContact O-N 3.43Å; A138-A141 PolarHBondContact O-N 2.69Å; A138-A142 VanDerWaalsContact O-CB 3.29Å; A138-A142 WeakPolarHBondContact O-CB 3.27Å; A138-A142 PolarHBondContact O-N 3.36Å
139A41.7Very low44.3Very low60 Ų6076.9 Ų76.950%0.49659%0.593SS.*Hα-helixtrans-71.9-40.4177.500000112A135 A136 A141 A142 A143A135-A139 WeakPolarHBondContact O-CB 3.5Å; A135-A139 PolarHBondContact O-N 3.34Å; A136-A139 PolarHBondContact O-N 3.38Å; A139-A141 VanDerWaalsContact C-N 3.33Å; A139-A142 PolarHBondContact O-N 3.37Å; A139-A143 WeakPolarHBondContact O-CB 3.32Å; A139-A143 PolarHBondContact O-N 3.4Å
140V49.8Very low44.8Very low112 Ų11275 Ų7568%0.67960%0.6SS**Hα-helixtrans-63.2-40.9171.4171.50000110.6A136 A144A136-V140 WeakPolarHBondContact O-CB 3.18Å; A136-V140 WeakPolarHBondContact O-CG2 3.46Å; A136-V140 PolarHBondContact O-N 3.17Å; V140-A144 PolarHBondContact O-N 3.32Å
141A48.5Very low44.5Very low62 Ų6275.5 Ų75.551%0.51261%0.605SS.*Hα-helixtrans-65.3-3917400000113A137 A138 A139 A144A137-A141 WeakPolarHBondContact O-CB 3.46Å; A137-A141 PolarHBondContact O-N 3.46Å; A138-A141 PolarHBondContact O-N 2.69Å; A139-A141 VanDerWaalsContact C-N 3.33Å; A141-A144 PolarHBondContact O-N 3.39Å
142A41.8Very low44.6Very low73 Ų7378.3 Ų78.360%0.60361%0.609SS**Hα-helixtrans-71.1-37.8177.800000112.7A138 A139 A144 G145A138-A142 VanDerWaalsContact O-CB 3.29Å; A138-A142 WeakPolarHBondContact O-CB 3.27Å; A138-A142 PolarHBondContact O-N 3.36Å; A139-A142 PolarHBondContact O-N 3.37Å; A142-A144 PolarHBondContact O-N 3.2Å; A142-G145 PolarHBondContact O-N 2.99Å
143A41.8Very low45.3Very low82 Ų8281.8 Ų81.868%0.67863%0.627SS**Hα-helixtrans-63.1-27.2176.300000112.7A139 G145A139-A143 WeakPolarHBondContact O-CB 3.32Å; A139-A143 PolarHBondContact O-N 3.4Å; A143-G145 PolarHBondContact O-N 3.14Å
144A48Very low46.9Very low72 Ų7281.2 Ų81.260%0.59564%0.639SS**THydrogen-bonded Turntrans-77.1-2.317400000114.4V140 A141 A142V140-A144 PolarHBondContact O-N 3.32Å; A141-A144 PolarHBondContact O-N 3.39Å; A142-A144 PolarHBondContact O-N 3.2Å
145G44.6Very low49.2Very low74 Ų7482.8 Ų82.876%0.76363%0.632SS**THydrogen-bonded Turntrans-95.25.4-177.400000115.8A142 A143A142-G145 PolarHBondContact O-N 2.99Å; A143-G145 PolarHBondContact O-N 3.14Å
146G40.7Very low51.7Low51 Ų5181.3 Ų81.353%0.52662%0.618SS.*SBendtrans-128.3121.4-172.200000114.2
147V40.3Very low54.3Low151 Ų15188.3 Ų88.392%0.91563%0.633SS**SBendtrans69.6140.7178.9-167.70000113.7G149V147-G149 PolarHBondContact O-N 3.42Å; V147-G149 VanDerWaalsContact O-N 3.09Å
148G53Low56.6Low83 Ų8386.8 Ų86.886%0.85662%0.616SS**  trans-67.3105.9-172.400000113.4
149G36.1Very low59.1Low72 Ų7284.1 Ų84.174%0.74259%0.593SS**PPolyproline II helixtrans-94.6162170.600000113.1V147V147-G149 PolarHBondContact O-N 3.42Å; V147-G149 VanDerWaalsContact O-N 3.09Å
150A48.8Very low61.7Low89 Ų8983.3 Ų83.374%0.73658%0.579SS**PPolyproline II helixtrans-60.1156168.500000111.3Q152A150-Q152 PolarHBondContact O-N 3.36Å
151P44.3Very low63.9Low110 Ų11079.6 Ų79.671%0.71456%0.555SS**PPolyproline II helixtrans-54.9131.4-178.321.5-34.2000112.1
152Q50Low66.1Low112 Ų11278.1 Ų78.152%0.52354%0.538SS..PPolyproline II helixtrans-62.5126.7174.2-73.4-72.2-10.100109.4A150 G154A150-Q152 PolarHBondContact O-N 3.36Å; Q152-G154 PolarHBondContact O-N 3.19Å
153P55.9Low68.7Low130 Ų13078.1 Ų78.184%0.84452%0.522SS*.THydrogen-bonded Turntrans-68103-174.627.1-34000110.5
154G79.4Confident71.2Confident78 Ų7878.6 Ų78.680%0.80451%0.513SS*.THydrogen-bonded Turntrans145.3-21.717600000115.7Q152Q152-G154 PolarHBondContact O-N 3.19Å
155R91.7Very high73.3Confident94 Ų9483.2 Ų83.236%0.35552%0.522SS..  trans-88.3147175-63.5-165.4-164.395.916112.3L159 E160 D185R155-L159 HydrophobicContact CB-CD2 4.4Å; R155-L159 HydrophobicContact CG-CD2 4.07Å; R155-E160 WeakPolarHBondContact CD-OE2 3.24Å; R155-E160 IonicContact CZ-OE2 2.93Å; R155-E160 IonicContact NE-OE2 2.97Å; R155-E160 IonicContact NH1-OE2 2.68Å; R155-E160 PolarHBondContact NH1-OE2 2.57Å; R155-D185 IonicContact NE-OD2 3.21Å
156S96Very high75.5Confident24 Ų2488.2 Ų88.217%0.16852%0.518CS..  trans-68.3156.5166.8740000111.4L158 L159 E160 H178 E181S156-L158 VanDerWaalsContact C-N 3.25Å; S156-L158 PolarHBondContact O-N 3.34Å; S156-L159 PolarHBondContact O-N 2.98Å; S156-L159 PolarHBondContact OG-N 2.96Å; S156-E160 PolarHBondContact O-N 3.07Å; S156-E160 VanDerWaalsContact O-N 3.1Å; S156-H178 VanDerWaalsContact CB-CE1 3.42Å; S156-H178 WeakPolarHBondContact CB-CE1 3.27Å; S156-H178 PolarHBondContact OG-ND1 3.29Å; S156-E181 WeakPolarHBondContact CB-OE1 3.35Å; S156-E181 WeakPolarHBondContact CB-OE2 3.31Å; S156-E181 PolarHBondContact N-OE1 3.33Å; S156-E181 VanDerWaalsContact OG-CD 3.25Å; S156-E181 PolarHBondContact OG-OE1 2.95Å; S156-E181 VanDerWaalsContact OG-OE1 3.06Å; S156-E181 PolarHBondContact OG-OE2 3.38Å
157R95.3Very high78Confident201 Ų20190.7 Ų90.776%0.75851%0.513SS*.Hα-helixtrans-58.9-38.2173-179.4174.4178.2173.22.2112E160 D161R157-E160 PolarHBondContact O-N 3.37Å; R157-D161 VanDerWaalsContact CG-OD2 3.23Å; R157-D161 WeakPolarHBondContact CG-OD2 3.32Å; R157-D161 IonicContact CZ-OD2 3.78Å; R157-D161 IonicContact NE-OD2 2.67Å; R157-D161 PolarHBondContact NE-OD2 3.48Å; R157-D161 IonicContact NH2-OD2 3.96Å; R157-D161 VanDerWaalsContact O-CB 3.29Å; R157-D161 WeakPolarHBondContact O-CB 3.05Å; R157-D161 PolarHBondContact O-N 2.8Å
158L96.6Very high80.2Confident33 Ų3388.7 Ų88.717%0.17350%0.503CS..Hα-helixtrans-62.6-44.9-179.7179.461.7000111.5S156 F162 Y167 L175 H178 F182S156-L158 VanDerWaalsContact C-N 3.25Å; S156-L158 PolarHBondContact O-N 3.34Å; L158-F162 VanDerWaalsContact O-CB 3.26Å; L158-F162 WeakPolarHBondContact O-CB 3.32Å; L158-F162 PolarHBondContact O-N 3.15Å; L158-Y167 HydrophobicContact CD1-CD2 4.25Å; L158-Y167 HydrophobicContact CD1-CE2 3.92Å; L158-L175 HydrophobicContact CD2-CD2 4.24Å; L158-H178 HydrophobicContact CD2-CB 4.14Å; L158-F182 HydrophobicContact CD2-CE2 4.24Å; L158-F182 HydrophobicContact CD2-CZ 4.5Å; L158-F182 HydrophobicContact CG-CE2 4.03Å; L158-F182 HydrophobicContact CG-CZ 4.01Å
159L96.1Very high82.1Confident4 Ų491.2 Ų91.22%0.02150%0.496CS..Hα-helixtrans-66.8-42.5177.7-179.858000111.9R155 S156 F162 R163 E181 F182 D185R155-L159 HydrophobicContact CB-CD2 4.4Å; R155-L159 HydrophobicContact CG-CD2 4.07Å; S156-L159 PolarHBondContact O-N 2.98Å; S156-L159 PolarHBondContact OG-N 2.96Å; L159-F162 HydrophobicContact CD1-CD1 4.32Å; L159-F162 PolarHBondContact O-N 2.89Å; L159-R163 HydrophobicContact CD1-CG 4.27Å; L159-R163 WeakPolarHBondContact O-CB 3.2Å; L159-R163 VanDerWaalsContact O-CG 3.23Å; L159-R163 WeakPolarHBondContact O-CG 3.16Å; L159-R163 PolarHBondContact O-N 3.37Å; L159-E181 WeakPolarHBondContact CB-OE1 3.39Å; L159-E181 HydrophobicContact CD2-CG 3.95Å; L159-E181 WeakPolarHBondContact CD2-OE1 3.32Å; L159-F182 HydrophobicContact CB-CD2 4.18Å; L159-F182 HydrophobicContact CB-CE2 3.61Å; L159-F182 HydrophobicContact CB-CZ 4.05Å; L159-F182 HydrophobicContact CD1-CD1 4.06Å; L159-F182 HydrophobicContact CD1-CD2 3.95Å; L159-F182 HydrophobicContact CD1-CE1 3.94Å; L159-F182 HydrophobicContact CD1-CE2 3.85Å; L159-F182 HydrophobicContact CD1-CG 4.05Å; L159-F182 HydrophobicContact CD1-CZ 3.84Å; L159-F182 HydrophobicContact CG-CE2 4.28Å; L159-D185 HydrophobicContact CD1-CB 3.91Å; L159-D185 HydrophobicContact CD2-CB 3.79Å; L159-D185 HydrophobicContact CG-CB 4.46Å
160E96.3Very high85Confident42 Ų4288.2 Ų88.220%0.19646%0.463CS..Hα-helixtrans-71.9-41-179.7-161.158.8-119.200112R155 S156 R157 F162 R163 N164R155-E160 WeakPolarHBondContact CD-OE2 3.24Å; R155-E160 IonicContact CZ-OE2 2.93Å; R155-E160 IonicContact NE-OE2 2.97Å; R155-E160 IonicContact NH1-OE2 2.68Å; R155-E160 PolarHBondContact NH1-OE2 2.57Å; S156-E160 PolarHBondContact O-N 3.07Å; S156-E160 VanDerWaalsContact O-N 3.1Å; R157-E160 PolarHBondContact O-N 3.37Å; E160-F162 VanDerWaalsContact C-N 3.33Å; E160-F162 PolarHBondContact O-N 3.16Å; E160-R163 PolarHBondContact O-N 2.96Å; E160-R163 IonicContact OE1-NE 2.66Å; E160-R163 IonicContact OE2-NE 3.05Å; E160-N164 WeakPolarHBondContact O-CB 3.04Å; E160-N164 PolarHBondContact O-N 3.22Å; E160-N164 PolarHBondContact O-ND2 2.63Å; E160-N164 PolarHBondContact OE1-ND2 2.82Å
161D95.8Very high87.2Confident34 Ų3486.8 Ų86.818%0.18244%0.442CS..Hα-helixtrans-64.6-35.3173-84-38.9000111.4R157 N164 Q165 R166 Y167R157-D161 VanDerWaalsContact CG-OD2 3.23Å; R157-D161 WeakPolarHBondContact CG-OD2 3.32Å; R157-D161 IonicContact CZ-OD2 3.78Å; R157-D161 IonicContact NE-OD2 2.67Å; R157-D161 PolarHBondContact NE-OD2 3.48Å; R157-D161 IonicContact NH2-OD2 3.96Å; R157-D161 VanDerWaalsContact O-CB 3.29Å; R157-D161 WeakPolarHBondContact O-CB 3.05Å; R157-D161 PolarHBondContact O-N 2.8Å; D161-N164 CarbonylContact O-C 3.27Å; D161-N164 PolarHBondContact O-N 3.16Å; D161-Q165 PolarHBondContact O-N 3.42Å; D161-R166 HydrophobicContact CB-CB 4.09Å; D161-R166 HydrophobicContact CB-CG 4.12Å; D161-R166 VanDerWaalsContact O-CB 3.23Å; D161-R166 WeakPolarHBondContact O-CB 3.32Å; D161-R166 WeakPolarHBondContact O-CG 3.36Å; D161-R166 PolarHBondContact O-N 2.74Å; D161-Y167 HydrophobicContact CB-CD2 4.11Å; D161-Y167 HydrophobicContact CB-CE2 3.6Å
162F96.6Very high89.7Confident32 Ų3281.6 Ų81.614%0.1441%0.408CS..Hα-helixtrans-63.6-49.7170.7167-108.4000112.5L158 L159 E160 N164 Q165 L170 F182 H187 F191L158-F162 VanDerWaalsContact O-CB 3.26Å; L158-F162 WeakPolarHBondContact O-CB 3.32Å; L158-F162 PolarHBondContact O-N 3.15Å; L159-F162 HydrophobicContact CD1-CD1 4.32Å; L159-F162 PolarHBondContact O-N 2.89Å; E160-F162 VanDerWaalsContact C-N 3.33Å; E160-F162 PolarHBondContact O-N 3.16Å; F162-N164 PolarHBondContact O-N 3.16Å; F162-Q165 WeakPolarHBondContact O-CA 3.29Å; F162-Q165 PolarHBondContact O-N 2.91Å; F162-L170 HydrophobicContact CB-CD2 4.18Å; F162-L170 HydrophobicContact CD2-CD2 3.52Å; F162-L170 HydrophobicContact CE2-CD2 4.19Å; F162-L170 HydrophobicContact CG-CD2 3.99Å; F162-F182 HydrophobicContact CB-CE1 4.12Å; F162-F182 HydrophobicContact CB-CZ 4.04Å; F162-F182 HydrophobicContact CD1-CD1 4.36Å; F162-F182 AromaticContact CD1-CE1 3.54Å; F162-F182 HydrophobicContact CD1-CE1 3.54Å; F162-F182 HydrophobicContact CD1-CZ 4.21Å; F162-F182 HydrophobicContact CE1-CE1 4.13Å; F162-F182 AromaticContact CG-CE1 3.84Å; F162-F182 HydrophobicContact CG-CE1 3.84Å; F162-F182 HydrophobicContact CG-CZ 4.28Å; F162-H187 HydrophobicContact CE1-CB 4Å; F162-F191 HydrophobicContact CE1-CB 4.33Å; F162-F191 HydrophobicContact CE2-CB 4.5Å; F162-F191 AromaticContact CE2-CD2 3.82Å; F162-F191 HydrophobicContact CE2-CD2 3.82Å; F162-F191 HydrophobicContact CE2-CE2 4.28Å; F162-F191 HydrophobicContact CE2-CG 4.24Å; F162-F191 HydrophobicContact CZ-CB 3.74Å; F162-F191 AromaticContact CZ-CD2 3.91Å; F162-F191 HydrophobicContact CZ-CD2 3.91Å; F162-F191 AromaticContact CZ-CG 3.95Å; F162-F191 HydrophobicContact CZ-CG 3.95Å
163R94.7Very high91.9Very high73 Ų7384.4 Ų84.428%0.27541%0.414SS..Hα-helixtrans-58-36.5177-73.9166.657.187.719.6111.8L159 E160 Q165 D185L159-R163 HydrophobicContact CD1-CG 4.27Å; L159-R163 WeakPolarHBondContact O-CB 3.2Å; L159-R163 VanDerWaalsContact O-CG 3.23Å; L159-R163 WeakPolarHBondContact O-CG 3.16Å; L159-R163 PolarHBondContact O-N 3.37Å; E160-R163 PolarHBondContact O-N 2.96Å; E160-R163 IonicContact OE1-NE 2.66Å; E160-R163 IonicContact OE2-NE 3.05Å; R163-Q165 PolarHBondContact O-N 3.38Å; R163-D185 IonicContact CZ-OD2 3.74Å; R163-D185 IonicContact NH1-OD1 3.81Å; R163-D185 IonicContact NH1-OD2 2.82Å; R163-D185 PolarHBondContact NH1-OD2 3.09Å
164N94.5Very high93.8Very high92 Ų9281.2 Ų81.249%0.49239%0.389SS..THydrogen-bonded Turntrans-84.221.4174.5-68.7-76.1000114E160 D161 F162 R166E160-N164 WeakPolarHBondContact O-CB 3.04Å; E160-N164 PolarHBondContact O-N 3.22Å; E160-N164 PolarHBondContact O-ND2 2.63Å; E160-N164 PolarHBondContact OE1-ND2 2.82Å; D161-N164 CarbonylContact O-C 3.27Å; D161-N164 PolarHBondContact O-N 3.16Å; F162-N164 PolarHBondContact O-N 3.16Å; N164-R166 PolarHBondContact O-N 3.26Å; N164-R166 VanDerWaalsContact O-N 3.09Å
165Q92.4Very high94.6Very high168 Ų16877.5 Ų77.579%0.78535%0.351SS*.THydrogen-bonded Turntrans59.120.3172.2-53-179.117.900115.1D161 F162 R163 Y167D161-Q165 PolarHBondContact O-N 3.42Å; F162-Q165 WeakPolarHBondContact O-CA 3.29Å; F162-Q165 PolarHBondContact O-N 2.91Å; R163-Q165 PolarHBondContact O-N 3.38Å; Q165-Y167 VanDerWaalsContact C-N 3.26Å; Q165-Y167 PolarHBondContact O-N 3.24Å
166R92.1Very high94.8Very high179 Ų17975 Ų7568%0.67535%0.35SS*.SBendtrans-71.1-20.8179.4-56.1-56.7-169.5166.1-0.5113.3D161 N164 P168D161-R166 HydrophobicContact CB-CB 4.09Å; D161-R166 HydrophobicContact CB-CG 4.12Å; D161-R166 VanDerWaalsContact O-CB 3.23Å; D161-R166 WeakPolarHBondContact O-CB 3.32Å; D161-R166 WeakPolarHBondContact O-CG 3.36Å; D161-R166 PolarHBondContact O-N 2.74Å; N164-R166 PolarHBondContact O-N 3.26Å; N164-R166 VanDerWaalsContact O-N 3.09Å; R166-P168 VanDerWaalsContact C-CD 3.48Å; R166-P168 VanDerWaalsContact O-CD 3.31Å; R166-P168 WeakPolarHBondContact O-CD 3.46Å
167Y91.8Very high94.9Very high104 Ų10480.8 Ų80.841%0.40838%0.38SS..  trans-118.972.4-179.2-61.7-63.5000112.3L158 D161 Q165 N169 L170L158-Y167 HydrophobicContact CD1-CD2 4.25Å; L158-Y167 HydrophobicContact CD1-CE2 3.92Å; D161-Y167 HydrophobicContact CB-CD2 4.11Å; D161-Y167 HydrophobicContact CB-CE2 3.6Å; Q165-Y167 VanDerWaalsContact C-N 3.26Å; Q165-Y167 PolarHBondContact O-N 3.24Å; Y167-N169 PolarHBondContact O-N 2.77Å; Y167-L170 HydrophobicContact CG-CD1 4.31Å; Y167-L170 PolarHBondContact O-N 3.13Å
168P87.7Confident95Very high109 Ų10974 Ų7471%0.70836%0.356SS*.THydrogen-bonded Turntrans-65.6-23.7-177.826.9-35.7000113.9R166R166-P168 VanDerWaalsContact C-CD 3.48Å; R166-P168 VanDerWaalsContact O-CD 3.31Å; R166-P168 WeakPolarHBondContact O-CD 3.46Å
169N93.1Very high95Very high135 Ų13572.4 Ų72.472%0.72235%0.348SS*.THydrogen-bonded Turntrans-107.918.9-175.4-67.3-32.8000113.7Y167 Q171Y167-N169 PolarHBondContact O-N 2.77Å; N169-Q171 PolarHBondContact O-NE2 3.19Å
170L95.3Very high95.1Very high9 Ų974 Ų745%0.04736%0.358CS..  trans-58.1144.6-176.2-161.465000112.3F162 Y167 D174 L175 F182 F191 K195F162-L170 HydrophobicContact CB-CD2 4.18Å; F162-L170 HydrophobicContact CD2-CD2 3.52Å; F162-L170 HydrophobicContact CE2-CD2 4.19Å; F162-L170 HydrophobicContact CG-CD2 3.99Å; Y167-L170 HydrophobicContact CG-CD1 4.31Å; Y167-L170 PolarHBondContact O-N 3.13Å; L170-D174 HydrophobicContact CD1-CB 3.56Å; L170-D174 HydrophobicContact CG-CB 4.37Å; L170-L175 HydrophobicContact CD2-CD2 3.72Å; L170-L175 HydrophobicContact CG-CD2 4.23Å; L170-F182 HydrophobicContact CD2-CE1 4.34Å; L170-F191 HydrophobicContact CB-CE2 3.95Å; L170-F191 HydrophobicContact CB-CZ 3.81Å; L170-F191 HydrophobicContact CD2-CE1 4.46Å; L170-F191 HydrophobicContact CD2-CE2 4.48Å; L170-F191 HydrophobicContact CD2-CZ 4.11Å; L170-F191 HydrophobicContact CG-CE2 4.44Å; L170-F191 HydrophobicContact CG-CZ 3.89Å; L170-F191 WeakPolarHBondContact O-CE2 3.4Å; L170-F191 VanDerWaalsContact O-CZ 3.31Å; L170-F191 WeakPolarHBondContact O-CZ 3.43Å; L170-K195 WeakPolarHBondContact O-CE 3.45Å; L170-K195 PolarHBondContact O-NZ 3.26Å
171Q96.5Very high95.2Very high60 Ų6074.1 Ų74.128%0.2836%0.358SS..  trans-125.3167.6177.9-49.4-57.4-31.700111.2N169 R173 D174N169-Q171 PolarHBondContact O-NE2 3.19Å; Q171-R173 VanDerWaalsContact C-N 3.34Å; Q171-R173 HydrophobicContact CB-CG 4.4Å; Q171-R173 PolarHBondContact O-N 3.26Å; Q171-D174 WeakPolarHBondContact CA-OD2 3.46Å; Q171-D174 WeakPolarHBondContact CB-OD2 3.27Å; Q171-D174 PolarHBondContact N-OD2 3.04Å; Q171-D174 WeakPolarHBondContact O-CB 3.33Å; Q171-D174 PolarHBondContact O-N 3.1Å; Q171-D174 VanDerWaalsContact O-N 3.13Å
172L96.4Very high95.4Very high1 Ų172.5 Ų72.51%0.00535%0.35CS..G310 helixtrans-61.2-40.7-177.9-71.4172.6000112.8D174 L175 F191 I192 K195 L196 A199 E203 M206 V207L172-D174 PolarHBondContact O-N 3.17Å; L172-D174 VanDerWaalsContact O-N 3.17Å; L172-L175 WeakPolarHBondContact O-CB 3.4Å; L172-L175 PolarHBondContact O-N 3.47Å; L172-F191 HydrophobicContact CD2-CE1 4.47Å; L172-I192 HydrophobicContact CD2-CG1 4.22Å; L172-I192 HydrophobicContact CD2-CG2 4.48Å; L172-K195 HydrophobicContact CD1-CB 3.74Å; L172-K195 HydrophobicContact CD2-CB 3.73Å; L172-K195 HydrophobicContact CD2-CG 4.25Å; L172-K195 HydrophobicContact CG-CB 3.59Å; L172-K195 HydrophobicContact CG-CG 4.17Å; L172-L196 HydrophobicContact CD1-CD2 4.35Å; L172-A199 HydrophobicContact CD1-CB 3.62Å; L172-E203 HydrophobicContact CD1-CB 4.24Å; L172-M206 HydrophobicContact CB-CE 4.04Å; L172-V207 HydrophobicContact CB-CG2 4.06Å; L172-V207 HydrophobicContact CD1-CG2 4.05Å; L172-V207 HydrophobicContact CD2-CG2 3.99Å; L172-V207 HydrophobicContact CG-CG2 4.25Å
173R95.4Very high95.4Very high171 Ų17171 Ų7165%0.64534%0.343SS*.G310 helixtrans-61.9-21.4178.175.6-166.6177.2-162.7-1.9113.7Q171 M206Q171-R173 VanDerWaalsContact C-N 3.34Å; Q171-R173 HydrophobicContact CB-CG 4.4Å; Q171-R173 PolarHBondContact O-N 3.26Å; R173-M206 HydrophobicContact CB-CE 4.18Å
174D96.8Very high95.6Very high63 Ų6371.6 Ų71.634%0.33735%0.349SS..G310 helixtrans-83.3-6.8-179.4-44.1-29.1000110.9L170 Q171 L172L170-D174 HydrophobicContact CD1-CB 3.56Å; L170-D174 HydrophobicContact CG-CB 4.37Å; Q171-D174 WeakPolarHBondContact CA-OD2 3.46Å; Q171-D174 WeakPolarHBondContact CB-OD2 3.27Å; Q171-D174 PolarHBondContact N-OD2 3.04Å; Q171-D174 WeakPolarHBondContact O-CB 3.33Å; Q171-D174 PolarHBondContact O-N 3.1Å; Q171-D174 VanDerWaalsContact O-N 3.13Å; L172-D174 PolarHBondContact O-N 3.17Å; L172-D174 VanDerWaalsContact O-N 3.17Å
175L96.9Very high95.8Very high0 Ų067.7 Ų67.70%033%0.328CS..G310 helixtrans-9811.4176.1-57.8-170.9000113.8L158 L170 L172 N177 H178 I179 F182 F191 I192L158-L175 HydrophobicContact CD2-CD2 4.24Å; L170-L175 HydrophobicContact CD2-CD2 3.72Å; L170-L175 HydrophobicContact CG-CD2 4.23Å; L172-L175 WeakPolarHBondContact O-CB 3.4Å; L172-L175 PolarHBondContact O-N 3.47Å; L175-N177 PolarHBondContact O-N 2.76Å; L175-H178 CarbonylContact O-C 3.08Å; L175-H178 WeakPolarHBondContact O-CA 3.42Å; L175-H178 WeakPolarHBondContact O-CB 3.08Å; L175-H178 PolarHBondContact O-N 3.16Å; L175-I179 HydrophobicContact CB-CD1 3.55Å; L175-I179 HydrophobicContact CB-CG1 4.38Å; L175-I179 HydrophobicContact CD1-CD1 4.01Å; L175-I179 HydrophobicContact CG-CD1 4.41Å; L175-I179 PolarHBondContact O-N 3.28Å; L175-F182 HydrophobicContact CD1-CB 4.3Å; L175-F182 HydrophobicContact CD1-CD1 3.66Å; L175-F182 HydrophobicContact CD1-CE1 4.14Å; L175-F182 HydrophobicContact CD1-CG 3.99Å; L175-F182 HydrophobicContact CD2-CD1 3.73Å; L175-F182 HydrophobicContact CD2-CD2 4.24Å; L175-F182 HydrophobicContact CD2-CE1 3.36Å; L175-F182 HydrophobicContact CD2-CE2 3.9Å; L175-F182 HydrophobicContact CD2-CG 4.17Å; L175-F182 HydrophobicContact CD2-CZ 3.45Å; L175-F182 VanDerWaalsContact CD2-CZ 3.45Å; L175-F182 HydrophobicContact CG-CD1 4.35Å; L175-F182 HydrophobicContact CG-CE1 4.41Å; L175-F191 HydrophobicContact CD1-CD1 3.87Å; L175-F191 HydrophobicContact CD1-CE1 3.64Å; L175-F191 HydrophobicContact CG-CE1 4.17Å; L175-I192 HydrophobicContact CD1-CD1 4.22Å; L175-I192 HydrophobicContact CD1-CG1 3.91Å
176A95.9Very high96Very high41 Ų4163.7 Ų63.734%0.33931%0.31SS..THydrogen-bonded Turntrans-57.7132.9-174.300000112.2H178 E210A176-H178 PolarHBondContact O-N 3.46Å; A176-E210 WeakPolarHBondContact CA-OE1 3.38Å
177N96.2Very high96.3Very high146 Ų14659.4 Ų59.478%0.78130%0.297SS*.THydrogen-bonded Turntrans69.32.4-169.7-40.7-91.2000115.5L175 E210L175-N177 PolarHBondContact O-N 2.76Å; N177-E210 WeakPolarHBondContact CA-OE2 3.44Å; N177-E210 PolarHBondContact N-OE1 3.1Å; N177-E210 PolarHBondContact N-OE2 3.15Å
178H97.6Very high96.6Very high57 Ų5754.4 Ų54.426%0.26428%0.277SS..  trans-119.84.9178.9-71.5-84.7000113S156 L158 L175 A176 V180 E181 F182 E210S156-H178 VanDerWaalsContact CB-CE1 3.42Å; S156-H178 WeakPolarHBondContact CB-CE1 3.27Å; S156-H178 PolarHBondContact OG-ND1 3.29Å; L158-H178 HydrophobicContact CD2-CB 4.14Å; L175-H178 CarbonylContact O-C 3.08Å; L175-H178 WeakPolarHBondContact O-CA 3.42Å; L175-H178 WeakPolarHBondContact O-CB 3.08Å; L175-H178 PolarHBondContact O-N 3.16Å; A176-H178 PolarHBondContact O-N 3.46Å; H178-V180 VanDerWaalsContact C-N 3.34Å; H178-V180 PolarHBondContact O-N 2.89Å; H178-E181 IonicContact CE1-OE2 2.7Å; H178-E181 IonicContact CG-OE2 3.96Å; H178-E181 IonicContact ND1-OE2 3.88Å; H178-E181 PolarHBondContact ND1-OE2 3Å; H178-E181 PolarHBondContact O-N 3.06Å; H178-F182 HydrophobicContact CB-CD2 4Å; H178-F182 HydrophobicContact CB-CE2 4.19Å; H178-F182 WeakPolarHBondContact O-CD2 3.33Å; H178-F182 PolarHBondContact O-N 2.91Å; H178-E210 PolarHBondContact N-OE2 3.32Å
179I98.1Very high97.1Very high0 Ų049.3 Ų49.30%024%0.244CC..Hα-helixtrans-61.7-40.3-175.2-67.5-65.3000112.2L175 S183 I192 V207 E210 I211L175-I179 HydrophobicContact CB-CD1 3.55Å; L175-I179 HydrophobicContact CB-CG1 4.38Å; L175-I179 HydrophobicContact CD1-CD1 4.01Å; L175-I179 HydrophobicContact CG-CD1 4.41Å; L175-I179 PolarHBondContact O-N 3.28Å; I179-S183 VanDerWaalsContact O-CB 3.27Å; I179-S183 WeakPolarHBondContact O-CB 3.38Å; I179-S183 PolarHBondContact O-N 3.35Å; I179-S183 PolarHBondContact O-OG 3.16Å; I179-I192 HydrophobicContact CD1-CD1 4.33Å; I179-I192 HydrophobicContact CG2-CD1 4.35Å; I179-V207 HydrophobicContact CD1-CB 4.48Å; I179-V207 HydrophobicContact CD1-CG1 4.35Å; I179-V207 HydrophobicContact CD1-CG2 3.84Å; I179-V207 HydrophobicContact CG1-CG2 4.49Å; I179-V207 HydrophobicContact CG2-CG1 3.76Å; I179-E210 HydrophobicContact CB-CB 3.8Å; I179-E210 HydrophobicContact CB-CG 4.39Å; I179-E210 VanDerWaalsContact CB-OE2 3.23Å; I179-E210 WeakPolarHBondContact CB-OE2 3.19Å; I179-E210 HydrophobicContact CG1-CB 4.24Å; I179-E210 HydrophobicContact CG1-CG 4.39Å; I179-E210 WeakPolarHBondContact CG1-OE2 3.32Å; I179-E210 HydrophobicContact CG2-CB 4.17Å; I179-E210 PolarHBondContact N-OE2 2.94Å; I179-I211 HydrophobicContact CG2-CG2 3.49Å; I179-I211 VanDerWaalsContact CG2-CG2 3.49Å
180V98.2Very high97.4Very high39 Ų3949.8 Ų49.824%0.23624%0.236CC..Hα-helixtrans-66.8-44.3178.7-178.50000110.9H178 S183 Q184 E210 A214 L218H178-V180 VanDerWaalsContact C-N 3.34Å; H178-V180 PolarHBondContact O-N 2.89Å; V180-S183 WeakPolarHBondContact O-CB 3.25Å; V180-S183 PolarHBondContact O-N 3.04Å; V180-Q184 PolarHBondContact O-N 3.46Å; V180-Q184 VanDerWaalsContact O-N 3.09Å; V180-E210 WeakPolarHBondContact CG2-O 3.33Å; V180-A214 HydrophobicContact CG1-CB 3.74Å; V180-A214 HydrophobicContact CG2-CB 3.91Å; V180-L218 HydrophobicContact CG1-CD2 4.35Å
181E98.1Very high97.5Very high44 Ų4450.4 Ų50.421%0.20624%0.238CC..Hα-helixtrans-60.2-49.2176.7-170.3-158.1173.300111.3S156 L159 H178 S183 Q184 D185S156-E181 WeakPolarHBondContact CB-OE1 3.35Å; S156-E181 WeakPolarHBondContact CB-OE2 3.31Å; S156-E181 PolarHBondContact N-OE1 3.33Å; S156-E181 VanDerWaalsContact OG-CD 3.25Å; S156-E181 PolarHBondContact OG-OE1 2.95Å; S156-E181 VanDerWaalsContact OG-OE1 3.06Å; S156-E181 PolarHBondContact OG-OE2 3.38Å; L159-E181 WeakPolarHBondContact CB-OE1 3.39Å; L159-E181 HydrophobicContact CD2-CG 3.95Å; L159-E181 WeakPolarHBondContact CD2-OE1 3.32Å; H178-E181 IonicContact CE1-OE2 2.7Å; H178-E181 IonicContact CG-OE2 3.96Å; H178-E181 IonicContact ND1-OE2 3.88Å; H178-E181 PolarHBondContact ND1-OE2 3Å; H178-E181 PolarHBondContact O-N 3.06Å; E181-S183 VanDerWaalsContact C-N 3.3Å; E181-S183 PolarHBondContact O-N 3.29Å; E181-Q184 PolarHBondContact O-N 2.83Å; E181-Q184 VanDerWaalsContact O-N 3.16Å; E181-D185 PolarHBondContact O-N 3.42Å
182F98.4Very high97.6Very high0 Ų047.6 Ų47.60%023%0.225CC..Hα-helixtrans-62.4-38.1176.2-89.1-116.8000111.4L158 L159 F162 L170 L175 H178 Q184 D185 G188 S189 I192L158-F182 HydrophobicContact CD2-CE2 4.24Å; L158-F182 HydrophobicContact CD2-CZ 4.5Å; L158-F182 HydrophobicContact CG-CE2 4.03Å; L158-F182 HydrophobicContact CG-CZ 4.01Å; L159-F182 HydrophobicContact CB-CD2 4.18Å; L159-F182 HydrophobicContact CB-CE2 3.61Å; L159-F182 HydrophobicContact CB-CZ 4.05Å; L159-F182 HydrophobicContact CD1-CD1 4.06Å; L159-F182 HydrophobicContact CD1-CD2 3.95Å; L159-F182 HydrophobicContact CD1-CE1 3.94Å; L159-F182 HydrophobicContact CD1-CE2 3.85Å; L159-F182 HydrophobicContact CD1-CG 4.05Å; L159-F182 HydrophobicContact CD1-CZ 3.84Å; L159-F182 HydrophobicContact CG-CE2 4.28Å; F162-F182 HydrophobicContact CB-CE1 4.12Å; F162-F182 HydrophobicContact CB-CZ 4.04Å; F162-F182 HydrophobicContact CD1-CD1 4.36Å; F162-F182 AromaticContact CD1-CE1 3.54Å; F162-F182 HydrophobicContact CD1-CE1 3.54Å; F162-F182 HydrophobicContact CD1-CZ 4.21Å; F162-F182 HydrophobicContact CE1-CE1 4.13Å; F162-F182 AromaticContact CG-CE1 3.84Å; F162-F182 HydrophobicContact CG-CE1 3.84Å; F162-F182 HydrophobicContact CG-CZ 4.28Å; L170-F182 HydrophobicContact CD2-CE1 4.34Å; L175-F182 HydrophobicContact CD1-CB 4.3Å; L175-F182 HydrophobicContact CD1-CD1 3.66Å; L175-F182 HydrophobicContact CD1-CE1 4.14Å; L175-F182 HydrophobicContact CD1-CG 3.99Å; L175-F182 HydrophobicContact CD2-CD1 3.73Å; L175-F182 HydrophobicContact CD2-CD2 4.24Å; L175-F182 HydrophobicContact CD2-CE1 3.36Å; L175-F182 HydrophobicContact CD2-CE2 3.9Å; L175-F182 HydrophobicContact CD2-CG 4.17Å; L175-F182 HydrophobicContact CD2-CZ 3.45Å; L175-F182 VanDerWaalsContact CD2-CZ 3.45Å; L175-F182 HydrophobicContact CG-CD1 4.35Å; L175-F182 HydrophobicContact CG-CE1 4.41Å; H178-F182 HydrophobicContact CB-CD2 4Å; H178-F182 HydrophobicContact CB-CE2 4.19Å; H178-F182 WeakPolarHBondContact O-CD2 3.33Å; H178-F182 PolarHBondContact O-N 2.91Å; F182-Q184 PolarHBondContact O-N 3.29Å; F182-D185 PolarHBondContact O-N 3.05Å; F182-G188 CarbonylContact O-C 3.57Å; F182-G188 VanDerWaalsContact O-CA 3.29Å; F182-G188 WeakPolarHBondContact O-CA 3.45Å; F182-S189 PolarHBondContact O-N 3.11Å; F182-I192 HydrophobicContact CB-CD1 3.64Å
183S98.6Very high97.7Very high0 Ų049 Ų490%023%0.232CC..Hα-helixtrans-64.5-26.3177.3-60.90000113I179 V180 E181 S189 F223 G224I179-S183 VanDerWaalsContact O-CB 3.27Å; I179-S183 WeakPolarHBondContact O-CB 3.38Å; I179-S183 PolarHBondContact O-N 3.35Å; I179-S183 PolarHBondContact O-OG 3.16Å; V180-S183 WeakPolarHBondContact O-CB 3.25Å; V180-S183 PolarHBondContact O-N 3.04Å; E181-S183 VanDerWaalsContact C-N 3.3Å; E181-S183 PolarHBondContact O-N 3.29Å; S183-S189 WeakPolarHBondContact O-CB 3.49Å; S183-F223 CarbonylContact O-C 3.51Å; S183-F223 VanDerWaalsContact O-C 3.22Å; S183-G224 VanDerWaalsContact O-CA 3.25Å; S183-G224 WeakPolarHBondContact O-CA 3.28Å; S183-G224 PolarHBondContact O-N 3.1Å
184Q98.2Very high97.8Very high85 Ų8547.5 Ų47.540%0.39723%0.232SC..THydrogen-bonded Turntrans-913.8174.7-67.7174.5-19.800113.2V180 E181 F182 L218 F223V180-Q184 PolarHBondContact O-N 3.46Å; V180-Q184 VanDerWaalsContact O-N 3.09Å; E181-Q184 PolarHBondContact O-N 2.83Å; E181-Q184 VanDerWaalsContact O-N 3.16Å; F182-Q184 PolarHBondContact O-N 3.29Å; Q184-L218 HydrophobicContact CG-CD2 3.72Å; Q184-F223 WeakPolarHBondContact O-CD2 3.36Å
185D98.1Very high97.7Very high11 Ų1147.1 Ų47.16%0.05923%0.227CC..SBendtrans-106.5143.7172.9-178-89.6000112.3R155 L159 R163 E181 F182 H187 G188 S189R155-D185 IonicContact NE-OD2 3.21Å; L159-D185 HydrophobicContact CD1-CB 3.91Å; L159-D185 HydrophobicContact CD2-CB 3.79Å; L159-D185 HydrophobicContact CG-CB 4.46Å; R163-D185 IonicContact CZ-OD2 3.74Å; R163-D185 IonicContact NH1-OD1 3.81Å; R163-D185 IonicContact NH1-OD2 2.82Å; R163-D185 PolarHBondContact NH1-OD2 3.09Å; E181-D185 PolarHBondContact O-N 3.42Å; F182-D185 PolarHBondContact O-N 3.05Å; D185-H187 VanDerWaalsContact C-N 3.32Å; D185-H187 PolarHBondContact O-N 3.32Å; D185-H187 WeakPolarHBondContact OD1-CA 3.44Å; D185-H187 WeakPolarHBondContact OD1-CB 3.36Å; D185-H187 IonicContact OD1-CD2 3.88Å; D185-H187 PolarHBondContact OD1-N 2.97Å; D185-G188 PolarHBondContact O-N 3.16Å; D185-G188 PolarHBondContact OD1-N 2.83Å; D185-S189 WeakPolarHBondContact O-CB 3.49Å; D185-S189 PolarHBondContact O-N 3.36Å
186Q97.7Very high97.7Very high84 Ų8447.2 Ų47.239%0.39323%0.228SC..Hα-helixtrans-61.2-35.5-178-169.8-1804300113.9R190 F223Q186-R190 WeakPolarHBondContact O-CD 3.43Å; Q186-R190 VanDerWaalsContact O-CG 3.26Å; Q186-R190 WeakPolarHBondContact O-CG 3.38Å; Q186-F223 HydrophobicContact CB-CD1 4.25Å; Q186-F223 HydrophobicContact CB-CD2 4.3Å; Q186-F223 HydrophobicContact CB-CE1 3.85Å; Q186-F223 HydrophobicContact CB-CE2 3.89Å; Q186-F223 HydrophobicContact CB-CG 4.48Å; Q186-F223 HydrophobicContact CB-CZ 3.65Å; Q186-F223 HydrophobicContact CG-CD1 4.27Å; Q186-F223 HydrophobicContact CG-CE1 3.71Å; Q186-F223 HydrophobicContact CG-CZ 3.91Å
187H97.4Very high97.6Very high88 Ų8849.6 Ų49.641%0.40723%0.232SC..Hα-helixtrans-90.5-41.2177.8-57.4-84.5000110.8F162 D185 S189 R190 F191F162-H187 HydrophobicContact CE1-CB 4Å; D185-H187 VanDerWaalsContact C-N 3.32Å; D185-H187 PolarHBondContact O-N 3.32Å; D185-H187 WeakPolarHBondContact OD1-CA 3.44Å; D185-H187 WeakPolarHBondContact OD1-CB 3.36Å; D185-H187 IonicContact OD1-CD2 3.88Å; D185-H187 PolarHBondContact OD1-N 2.97Å; H187-S189 PolarHBondContact O-N 3.18Å; H187-R190 PolarHBondContact O-N 3.34Å; H187-F191 WeakPolarHBondContact O-CB 3.43Å; H187-F191 PolarHBondContact O-N 2.95Å
188G98.2Very high97.4Very high0 Ų053.4 Ų53.40%024%0.235CC..Hα-helixtrans-58.3-46.5177.500000112.7F182 D185 R190 F191 I192F182-G188 CarbonylContact O-C 3.57Å; F182-G188 VanDerWaalsContact O-CA 3.29Å; F182-G188 WeakPolarHBondContact O-CA 3.45Å; D185-G188 PolarHBondContact O-N 3.16Å; D185-G188 PolarHBondContact OD1-N 2.83Å; G188-R190 PolarHBondContact O-N 3.41Å; G188-F191 WeakPolarHBondContact O-CB 3.25Å; G188-F191 PolarHBondContact O-N 3Å; G188-I192 WeakPolarHBondContact O-CG1 3.5Å; G188-I192 PolarHBondContact O-N 3.09Å
189S98.4Very high97.3Very high1 Ų151.3 Ų51.31%0.00723%0.228CC..Hα-helixtrans-64.2-42.8178.7177.40000111.2F182 S183 D185 H187 F191 I192 Q193 F223F182-S189 PolarHBondContact O-N 3.11Å; S183-S189 WeakPolarHBondContact O-CB 3.49Å; D185-S189 WeakPolarHBondContact O-CB 3.49Å; D185-S189 PolarHBondContact O-N 3.36Å; H187-S189 PolarHBondContact O-N 3.18Å; S189-F191 VanDerWaalsContact C-N 3.32Å; S189-F191 PolarHBondContact O-N 3.46Å; S189-I192 PolarHBondContact O-N 3.27Å; S189-Q193 WeakPolarHBondContact O-CB 3.14Å; S189-Q193 WeakPolarHBondContact O-CG 3.37Å; S189-Q193 PolarHBondContact O-N 3.03Å; S189-Q193 PolarHBondContact O-NE2 2.88Å; S189-Q193 PolarHBondContact OG-NE2 3.44Å; S189-F223 PolarHBondContact OG-O 3.47Å
190R98.1Very high97.2Very high145 Ų14555.1 Ų55.155%0.54725%0.252SS..Hα-helixtrans-62.4-39.1176.1-74.3179.9179.6-75.82.6112.2Q186 H187 G188 Q194Q186-R190 WeakPolarHBondContact O-CD 3.43Å; Q186-R190 VanDerWaalsContact O-CG 3.26Å; Q186-R190 WeakPolarHBondContact O-CG 3.38Å; H187-R190 PolarHBondContact O-N 3.34Å; G188-R190 PolarHBondContact O-N 3.41Å; R190-Q194 WeakPolarHBondContact O-CB 3.31Å; R190-Q194 VanDerWaalsContact O-CG 3.24Å; R190-Q194 WeakPolarHBondContact O-CG 3.4Å; R190-Q194 PolarHBondContact O-N 2.91Å
191F98.2Very high97.1Very high23 Ų2356.8 Ų56.810%0.10127%0.269CS..Hα-helixtrans-64.1-47.9174.4171-87.6000111.5F162 L170 L172 L175 H187 G188 S189 Q193 Q194 K195F162-F191 HydrophobicContact CE1-CB 4.33Å; F162-F191 HydrophobicContact CE2-CB 4.5Å; F162-F191 AromaticContact CE2-CD2 3.82Å; F162-F191 HydrophobicContact CE2-CD2 3.82Å; F162-F191 HydrophobicContact CE2-CE2 4.28Å; F162-F191 HydrophobicContact CE2-CG 4.24Å; F162-F191 HydrophobicContact CZ-CB 3.74Å; F162-F191 AromaticContact CZ-CD2 3.91Å; F162-F191 HydrophobicContact CZ-CD2 3.91Å; F162-F191 AromaticContact CZ-CG 3.95Å; F162-F191 HydrophobicContact CZ-CG 3.95Å; L170-F191 HydrophobicContact CB-CE2 3.95Å; L170-F191 HydrophobicContact CB-CZ 3.81Å; L170-F191 HydrophobicContact CD2-CE1 4.46Å; L170-F191 HydrophobicContact CD2-CE2 4.48Å; L170-F191 HydrophobicContact CD2-CZ 4.11Å; L170-F191 HydrophobicContact CG-CE2 4.44Å; L170-F191 HydrophobicContact CG-CZ 3.89Å; L170-F191 WeakPolarHBondContact O-CE2 3.4Å; L170-F191 VanDerWaalsContact O-CZ 3.31Å; L170-F191 WeakPolarHBondContact O-CZ 3.43Å; L172-F191 HydrophobicContact CD2-CE1 4.47Å; L175-F191 HydrophobicContact CD1-CD1 3.87Å; L175-F191 HydrophobicContact CD1-CE1 3.64Å; L175-F191 HydrophobicContact CG-CE1 4.17Å; H187-F191 WeakPolarHBondContact O-CB 3.43Å; H187-F191 PolarHBondContact O-N 2.95Å; G188-F191 WeakPolarHBondContact O-CB 3.25Å; G188-F191 PolarHBondContact O-N 3Å; S189-F191 VanDerWaalsContact C-N 3.32Å; S189-F191 PolarHBondContact O-N 3.46Å; F191-Q193 PolarHBondContact O-N 2.97Å; F191-Q194 PolarHBondContact O-N 3.24Å; F191-K195 HydrophobicContact CD1-CG 4.33Å; F191-K195 HydrophobicContact CE1-CG 4.03Å; F191-K195 HydrophobicContact CE2-CD 4.47Å; F191-K195 HydrophobicContact CE2-CG 4.24Å; F191-K195 HydrophobicContact CZ-CD 4.35Å; F191-K195 VanDerWaalsContact CZ-CE 3.42Å; F191-K195 HydrophobicContact CZ-CG 4Å; F191-K195 VanDerWaalsContact O-CG 3.3Å; F191-K195 WeakPolarHBondContact O-CG 3.34Å; F191-K195 PolarHBondContact O-N 3.41Å
192I98.4Very high97.1Very high0 Ų058.3 Ų58.30%029%0.29CS..Hα-helixtrans-58.7-48.8176.8-70170.6000110.4L172 L175 I179 F182 G188 S189 Q194 K195 L196 V207 V227L172-I192 HydrophobicContact CD2-CG1 4.22Å; L172-I192 HydrophobicContact CD2-CG2 4.48Å; L175-I192 HydrophobicContact CD1-CD1 4.22Å; L175-I192 HydrophobicContact CD1-CG1 3.91Å; I179-I192 HydrophobicContact CD1-CD1 4.33Å; I179-I192 HydrophobicContact CG2-CD1 4.35Å; F182-I192 HydrophobicContact CB-CD1 3.64Å; G188-I192 WeakPolarHBondContact O-CG1 3.5Å; G188-I192 PolarHBondContact O-N 3.09Å; S189-I192 PolarHBondContact O-N 3.27Å; I192-Q194 PolarHBondContact O-N 2.91Å; I192-K195 PolarHBondContact O-N 3.13Å; I192-L196 HydrophobicContact CG2-CD1 3.66Å; I192-L196 HydrophobicContact CG2-CG 4.09Å; I192-L196 WeakPolarHBondContact O-CB 3.46Å; I192-L196 VanDerWaalsContact O-CG 3.3Å; I192-L196 WeakPolarHBondContact O-CG 3.46Å; I192-L196 PolarHBondContact O-N 2.87Å; I192-V207 HydrophobicContact CG2-CG1 4.28Å; I192-V227 HydrophobicContact CB-CG2 4.4Å; I192-V227 HydrophobicContact CG2-CG1 3.82Å; I192-V227 HydrophobicContact CG2-CG2 4.03Å
193Q98.3Very high97Very high32 Ų3260.5 Ų60.515%0.1530%0.3CS..Hα-helixtrans-53.9-50.9176.4-70.6164.352.900112S189 F191 K195 L196 E197 Y226 K230S189-Q193 WeakPolarHBondContact O-CB 3.14Å; S189-Q193 WeakPolarHBondContact O-CG 3.37Å; S189-Q193 PolarHBondContact O-N 3.03Å; S189-Q193 PolarHBondContact O-NE2 2.88Å; S189-Q193 PolarHBondContact OG-NE2 3.44Å; F191-Q193 PolarHBondContact O-N 2.97Å; Q193-K195 VanDerWaalsContact C-N 3.33Å; Q193-K195 PolarHBondContact O-N 3.19Å; Q193-L196 PolarHBondContact O-N 2.62Å; Q193-E197 WeakPolarHBondContact O-CG 3.32Å; Q193-Y226 VanDerWaalsContact CD-CB 3.48Å; Q193-Y226 VanDerWaalsContact NE2-CB 3.3Å; Q193-K230 HydrophobicContact CB-CG 4.32Å; Q193-K230 HydrophobicContact CG-CG 4.14Å
194Q97Very high96.9Very high138 Ų13862.1 Ų62.165%0.64531%0.307SS*.Hα-helixtrans-64.4-34.4-178.9-74.7172.2-1.800113.2R190 F191 I192R190-Q194 WeakPolarHBondContact O-CB 3.31Å; R190-Q194 VanDerWaalsContact O-CG 3.24Å; R190-Q194 WeakPolarHBondContact O-CG 3.4Å; R190-Q194 PolarHBondContact O-N 2.91Å; F191-Q194 PolarHBondContact O-N 3.24Å; I192-Q194 PolarHBondContact O-N 2.91Å
195K96.7Very high96.9Very high55 Ų5561.8 Ų61.824%0.23931%0.305CS..Hα-helixtrans-75.1-42.3177.2-68.2-72.8-170.5172.30111.8L170 L172 F191 I192 Q193 E197 R198 A199L170-K195 WeakPolarHBondContact O-CE 3.45Å; L170-K195 PolarHBondContact O-NZ 3.26Å; L172-K195 HydrophobicContact CD1-CB 3.74Å; L172-K195 HydrophobicContact CD2-CB 3.73Å; L172-K195 HydrophobicContact CD2-CG 4.25Å; L172-K195 HydrophobicContact CG-CB 3.59Å; L172-K195 HydrophobicContact CG-CG 4.17Å; F191-K195 HydrophobicContact CD1-CG 4.33Å; F191-K195 HydrophobicContact CE1-CG 4.03Å; F191-K195 HydrophobicContact CE2-CD 4.47Å; F191-K195 HydrophobicContact CE2-CG 4.24Å; F191-K195 HydrophobicContact CZ-CD 4.35Å; F191-K195 VanDerWaalsContact CZ-CE 3.42Å; F191-K195 HydrophobicContact CZ-CG 4Å; F191-K195 VanDerWaalsContact O-CG 3.3Å; F191-K195 WeakPolarHBondContact O-CG 3.34Å; F191-K195 PolarHBondContact O-N 3.41Å; I192-K195 PolarHBondContact O-N 3.13Å; Q193-K195 VanDerWaalsContact C-N 3.33Å; Q193-K195 PolarHBondContact O-N 3.19Å; K195-E197 PolarHBondContact O-N 2.96Å; K195-E197 VanDerWaalsContact O-N 3.13Å; K195-R198 CarbonylContact O-C 3.51Å; K195-R198 PolarHBondContact O-N 2.87Å; K195-A199 WeakPolarHBondContact O-CB 3.18Å; K195-A199 PolarHBondContact O-N 3.48Å
196L96.4Very high96.9Very high3 Ų363.6 Ų63.62%0.01631%0.314CS..Hα-helixtrans-56.6-30.5-176-80.1172.7000113.8L172 I192 Q193 R198 K204 V207 V227 K230 F231L172-L196 HydrophobicContact CD1-CD2 4.35Å; I192-L196 HydrophobicContact CG2-CD1 3.66Å; I192-L196 HydrophobicContact CG2-CG 4.09Å; I192-L196 WeakPolarHBondContact O-CB 3.46Å; I192-L196 VanDerWaalsContact O-CG 3.3Å; I192-L196 WeakPolarHBondContact O-CG 3.46Å; I192-L196 PolarHBondContact O-N 2.87Å; Q193-L196 PolarHBondContact O-N 2.62Å; L196-R198 PolarHBondContact O-N 3.19Å; L196-K204 HydrophobicContact CD2-CG 4.03Å; L196-K204 WeakPolarHBondContact O-CE 3.12Å; L196-V207 HydrophobicContact CD2-CB 4.46Å; L196-V207 HydrophobicContact CD2-CG1 4.26Å; L196-V227 HydrophobicContact CD1-CG1 4.25Å; L196-K230 HydrophobicContact CD1-CB 4.11Å; L196-F231 HydrophobicContact CD1-CD2 4.1Å; L196-F231 HydrophobicContact CD1-CE2 3.62Å; L196-F231 HydrophobicContact CD1-CZ 4.22Å; L196-F231 HydrophobicContact CD2-CE1 4.32Å; L196-F231 HydrophobicContact CD2-CE2 3.89Å; L196-F231 HydrophobicContact CD2-CZ 3.6Å; L196-F231 HydrophobicContact CG-CE2 4.44Å
197E92.8Very high96.9Very high90 Ų9059.6 Ų59.642%0.42130%0.295SS..THydrogen-bonded Turntrans-64.8-27.6177.6-48.5-165.614700113Q193 K195 K230 F234Q193-E197 WeakPolarHBondContact O-CG 3.32Å; K195-E197 PolarHBondContact O-N 2.96Å; K195-E197 VanDerWaalsContact O-N 3.13Å; E197-K230 WeakPolarHBondContact OE1-CE 3.48Å; E197-K230 IonicContact OE1-NZ 3.88Å; E197-K230 PolarHBondContact OE1-NZ 2.87Å; E197-F234 HydrophobicContact CB-CE2 4.25Å; E197-F234 HydrophobicContact CG-CD2 4.21Å; E197-F234 HydrophobicContact CG-CE2 3.68Å; E197-F234 HydrophobicContact CG-CZ 4.34Å
198R93.1Very high96.9Very high226 Ų22655.7 Ų55.785%0.85328%0.277SS*.THydrogen-bonded Turntrans-117.8-2.6-176.1-54.8-176.4-171.2-170.71.1113.5K195 L196K195-R198 CarbonylContact O-C 3.51Å; K195-R198 PolarHBondContact O-N 2.87Å; L196-R198 PolarHBondContact O-N 3.19Å
199A95Very high96.9Very high14 Ų1459 Ų5912%0.11630%0.3CS..  trans-67142.8-179.100000112L172 K195 E203 K204L172-A199 HydrophobicContact CD1-CB 3.62Å; K195-A199 WeakPolarHBondContact O-CB 3.18Å; K195-A199 PolarHBondContact O-N 3.48Å; A199-E203 HydrophobicContact CB-CB 4.06Å; A199-K204 HydrophobicContact CB-CG 3.97Å; A199-K204 WeakPolarHBondContact O-CE 3.44Å
200T96.6Very high96.9Very high80 Ų8060.9 Ų60.949%0.49131%0.309SS..  trans-63.3159.7170.761.20000111.3A202 E203 K204T200-A202 PolarHBondContact O-N 3.07Å; T200-E203 WeakPolarHBondContact CB-OE2 3.26Å; T200-E203 WeakPolarHBondContact CG2-OE2 3.37Å; T200-E203 PolarHBondContact N-OE2 3.02Å; T200-E203 PolarHBondContact O-N 2.8Å; T200-E203 WeakPolarHBondContact OG1-CG 3.28Å; T200-E203 PolarHBondContact OG1-N 3.35Å; T200-E203 PolarHBondContact OG1-OE2 3.39Å; T200-K204 WeakPolarHBondContact O-CG 3.36Å; T200-K204 PolarHBondContact O-N 3Å
201A95.8Very high96.8Very high74 Ų7454 Ų5461%0.61228%0.283SS*.Hα-helixtrans-57.7-35.1176.500000112.7K204 Q205A201-K204 PolarHBondContact O-N 3.36Å; A201-Q205 WeakPolarHBondContact O-CB 3.44Å; A201-Q205 PolarHBondContact O-N 3.33Å
202A96.6Very high96.8Very high76 Ų7655.3 Ų55.363%0.62829%0.291SS*.Hα-helixtrans-67-44.3176.200000112.5T200 Q205 M206T200-A202 PolarHBondContact O-N 3.07Å; A202-Q205 PolarHBondContact O-N 2.82Å; A202-M206 PolarHBondContact O-N 2.8Å
203E96.6Very high96.6Very high45 Ų4560.3 Ų60.321%0.2133%0.332CS..Hα-helixtrans-63.2-44.2174.3-72.5166.1113.600111.4L172 A199 T200 Q205 M206 V207L172-E203 HydrophobicContact CD1-CB 4.24Å; A199-E203 HydrophobicContact CB-CB 4.06Å; T200-E203 WeakPolarHBondContact CB-OE2 3.26Å; T200-E203 WeakPolarHBondContact CG2-OE2 3.37Å; T200-E203 PolarHBondContact N-OE2 3.02Å; T200-E203 PolarHBondContact O-N 2.8Å; T200-E203 WeakPolarHBondContact OG1-CG 3.28Å; T200-E203 PolarHBondContact OG1-N 3.35Å; T200-E203 PolarHBondContact OG1-OE2 3.39Å; E203-Q205 VanDerWaalsContact C-N 3.31Å; E203-Q205 PolarHBondContact O-N 2.6Å; E203-M206 HydrophobicContact CB-CE 4.47Å; E203-M206 PolarHBondContact O-N 2.89Å; E203-V207 WeakPolarHBondContact O-CG2 3.48Å; E203-V207 PolarHBondContact O-N 3.4Å
204K97.5Very high96.5Very high34 Ų3459.9 Ų59.915%0.14833%0.334CS..Hα-helixtrans-56.9-44.6174.1-72.5-180176.1-177.90111.6L196 A199 T200 A201 V207 F208 F231 F234L196-K204 HydrophobicContact CD2-CG 4.03Å; L196-K204 WeakPolarHBondContact O-CE 3.12Å; A199-K204 HydrophobicContact CB-CG 3.97Å; A199-K204 WeakPolarHBondContact O-CE 3.44Å; T200-K204 WeakPolarHBondContact O-CG 3.36Å; T200-K204 PolarHBondContact O-N 3Å; A201-K204 PolarHBondContact O-N 3.36Å; K204-V207 PolarHBondContact O-N 3.35Å; K204-F208 WeakPolarHBondContact O-CB 3.27Å; K204-F208 PolarHBondContact O-N 2.78Å; K204-F231 HydrophobicContact CB-CE1 4.27Å; K204-F231 WeakPolarHBondContact O-CE1 3.35Å; K204-F231 WeakPolarHBondContact O-CZ 3.34Å; K204-F234 PolarHBondContact NZ-O 3.23Å
205Q98.1Very high96.6Very high78 Ų7853.3 Ų53.336%0.36430%0.304SS..Hα-helixtrans-67.4-37.5-178.9-173.359.22700113A201 A202 E203 F208 S209A201-Q205 WeakPolarHBondContact O-CB 3.44Å; A201-Q205 PolarHBondContact O-N 3.33Å; A202-Q205 PolarHBondContact O-N 2.82Å; E203-Q205 VanDerWaalsContact C-N 3.31Å; E203-Q205 PolarHBondContact O-N 2.6Å; Q205-F208 PolarHBondContact O-N 3.46Å; Q205-S209 WeakPolarHBondContact O-CB 3.48Å; Q205-S209 PolarHBondContact O-N 3.47Å; Q205-S209 PolarHBondContact O-OG 3.45Å
206M97.3Very high96.6Very high50 Ų5053.7 Ų53.725%0.24630%0.304CS..Hα-helixtrans-64.4-48.5174.3163.9-86.1-58.500111.2L172 R173 A202 E203 F208 S209 E210L172-M206 HydrophobicContact CB-CE 4.04Å; R173-M206 HydrophobicContact CB-CE 4.18Å; A202-M206 PolarHBondContact O-N 2.8Å; E203-M206 HydrophobicContact CB-CE 4.47Å; E203-M206 PolarHBondContact O-N 2.89Å; M206-F208 VanDerWaalsContact C-N 3.31Å; M206-F208 PolarHBondContact O-N 2.89Å; M206-S209 PolarHBondContact O-N 2.95Å; M206-E210 PolarHBondContact O-N 3.39Å
207V98.1Very high96.7Very high0 Ų056.3 Ų56.30%032%0.322CS..Hα-helixtrans-59.3-42.6174.1176.30000111.2L172 I179 I192 L196 E203 K204 S209 E210 I211 F231L172-V207 HydrophobicContact CB-CG2 4.06Å; L172-V207 HydrophobicContact CD1-CG2 4.05Å; L172-V207 HydrophobicContact CD2-CG2 3.99Å; L172-V207 HydrophobicContact CG-CG2 4.25Å; I179-V207 HydrophobicContact CD1-CB 4.48Å; I179-V207 HydrophobicContact CD1-CG1 4.35Å; I179-V207 HydrophobicContact CD1-CG2 3.84Å; I179-V207 HydrophobicContact CG1-CG2 4.49Å; I179-V207 HydrophobicContact CG2-CG1 3.76Å; I192-V207 HydrophobicContact CG2-CG1 4.28Å; L196-V207 HydrophobicContact CD2-CB 4.46Å; L196-V207 HydrophobicContact CD2-CG1 4.26Å; E203-V207 WeakPolarHBondContact O-CG2 3.48Å; E203-V207 PolarHBondContact O-N 3.4Å; K204-V207 PolarHBondContact O-N 3.35Å; V207-S209 VanDerWaalsContact C-N 3.33Å; V207-S209 PolarHBondContact O-N 3.21Å; V207-E210 PolarHBondContact O-N 2.86Å; V207-I211 WeakPolarHBondContact O-CG1 3.13Å; V207-I211 PolarHBondContact O-N 3.05Å; V207-I211 VanDerWaalsContact O-N 3.17Å; V207-F231 HydrophobicContact CB-CZ 4.04Å; V207-F231 HydrophobicContact CG1-CE2 3.78Å; V207-F231 HydrophobicContact CG1-CZ 3.8Å
208F98.3Very high97Very high6 Ų652 Ų523%0.02630%0.302CS..Hα-helixtrans-60.1-41.9178.4-170.1-101.9000112.6K204 Q205 M206 E210 I211 L212 F231 Q239 T242 L243K204-F208 WeakPolarHBondContact O-CB 3.27Å; K204-F208 PolarHBondContact O-N 2.78Å; Q205-F208 PolarHBondContact O-N 3.46Å; M206-F208 VanDerWaalsContact C-N 3.31Å; M206-F208 PolarHBondContact O-N 2.89Å; F208-E210 VanDerWaalsContact C-N 3.32Å; F208-E210 PolarHBondContact O-N 2.87Å; F208-I211 HydrophobicContact CD2-CD1 4.31Å; F208-I211 VanDerWaalsContact O-CG1 3.3Å; F208-I211 WeakPolarHBondContact O-CG1 2.95Å; F208-I211 PolarHBondContact O-N 3.04Å; F208-L212 HydrophobicContact CE1-CD2 4.14Å; F208-L212 HydrophobicContact CZ-CD1 4.42Å; F208-L212 WeakPolarHBondContact O-CB 3.25Å; F208-L212 PolarHBondContact O-N 3.22Å; F208-F231 HydrophobicContact CB-CD1 4.46Å; F208-F231 HydrophobicContact CB-CE1 3.76Å; F208-F231 HydrophobicContact CB-CZ 4.01Å; F208-F231 AromaticContact CD2-CD1 3.56Å; F208-F231 HydrophobicContact CD2-CD1 3.56Å; F208-F231 AromaticContact CD2-CE1 3.73Å; F208-F231 HydrophobicContact CD2-CE1 3.73Å; F208-F231 HydrophobicContact CD2-CG 4Å; F208-F231 HydrophobicContact CD2-CZ 4.31Å; F208-F231 HydrophobicContact CE2-CD1 4.29Å; F208-F231 HydrophobicContact CG-CD1 4.44Å; F208-F231 HydrophobicContact CG-CE1 4.21Å; F208-Q239 HydrophobicContact CD1-CG 3.9Å; F208-Q239 HydrophobicContact CD2-CB 3.97Å; F208-Q239 HydrophobicContact CD2-CG 3.85Å; F208-Q239 HydrophobicContact CE1-CB 4.33Å; F208-Q239 HydrophobicContact CE1-CG 4.02Å; F208-Q239 HydrophobicContact CE2-CB 3.66Å; F208-Q239 HydrophobicContact CE2-CG 3.96Å; F208-Q239 HydrophobicContact CG-CB 4.42Å; F208-Q239 HydrophobicContact CG-CG 3.81Å; F208-Q239 HydrophobicContact CZ-CB 3.87Å; F208-Q239 HydrophobicContact CZ-CG 4.06Å; F208-Q239 WeakPolarHBondContact CZ-O 3.49Å; F208-T242 HydrophobicContact CE1-CG2 4.08Å; F208-T242 HydrophobicContact CZ-CG2 4.06Å; F208-L243 HydrophobicContact CE2-CD1 3.9Å; F208-L243 HydrophobicContact CE2-CD2 4.22Å; F208-L243 HydrophobicContact CE2-CG 3.75Å; F208-L243 HydrophobicContact CZ-CG 4.1Å
209S97.6Very high97.3Very high70 Ų7041.2 Ų41.249%0.4926%0.262SS..Hα-helixtrans-66-35-176.4-57.30000112Q205 M206 V207Q205-S209 WeakPolarHBondContact O-CB 3.48Å; Q205-S209 PolarHBondContact O-N 3.47Å; Q205-S209 PolarHBondContact O-OG 3.45Å; M206-S209 PolarHBondContact O-N 2.95Å; V207-S209 VanDerWaalsContact C-N 3.33Å; V207-S209 PolarHBondContact O-N 3.21Å
210E97.5Very high97.4Very high40 Ų4042.3 Ų42.319%0.18727%0.267CS..Hα-helixtrans-74.8-44.7174.6-72.4-174.5-137.100112.9A176 N177 H178 I179 V180 M206 V207 F208 L212A176-E210 WeakPolarHBondContact CA-OE1 3.38Å; N177-E210 WeakPolarHBondContact CA-OE2 3.44Å; N177-E210 PolarHBondContact N-OE1 3.1Å; N177-E210 PolarHBondContact N-OE2 3.15Å; H178-E210 PolarHBondContact N-OE2 3.32Å; I179-E210 HydrophobicContact CB-CB 3.8Å; I179-E210 HydrophobicContact CB-CG 4.39Å; I179-E210 VanDerWaalsContact CB-OE2 3.23Å; I179-E210 WeakPolarHBondContact CB-OE2 3.19Å; I179-E210 HydrophobicContact CG1-CB 4.24Å; I179-E210 HydrophobicContact CG1-CG 4.39Å; I179-E210 WeakPolarHBondContact CG1-OE2 3.32Å; I179-E210 HydrophobicContact CG2-CB 4.17Å; I179-E210 PolarHBondContact N-OE2 2.94Å; V180-E210 WeakPolarHBondContact CG2-O 3.33Å; M206-E210 PolarHBondContact O-N 3.39Å; V207-E210 PolarHBondContact O-N 2.86Å; F208-E210 VanDerWaalsContact C-N 3.32Å; F208-E210 PolarHBondContact O-N 2.87Å; E210-L212 VanDerWaalsContact C-N 3.29Å; E210-L212 PolarHBondContact O-N 3.11Å
211I97.6Very high97.5Very high0 Ų040.2 Ų40.20%025%0.253CS..Hα-helixtrans-68.8-26.5179.963.5178.3000113.1I179 V207 F208 A213 A214 A215 L218 V227 I228 F231I179-I211 HydrophobicContact CG2-CG2 3.49Å; I179-I211 VanDerWaalsContact CG2-CG2 3.49Å; V207-I211 WeakPolarHBondContact O-CG1 3.13Å; V207-I211 PolarHBondContact O-N 3.05Å; V207-I211 VanDerWaalsContact O-N 3.17Å; F208-I211 HydrophobicContact CD2-CD1 4.31Å; F208-I211 VanDerWaalsContact O-CG1 3.3Å; F208-I211 WeakPolarHBondContact O-CG1 2.95Å; F208-I211 PolarHBondContact O-N 3.04Å; I211-A213 VanDerWaalsContact C-N 3.35Å; I211-A213 PolarHBondContact O-N 2.83Å; I211-A214 CarbonylContact O-C 3.08Å; I211-A214 VanDerWaalsContact O-C 3.29Å; I211-A214 WeakPolarHBondContact O-CA 3.42Å; I211-A214 PolarHBondContact O-N 2.93Å; I211-A215 VanDerWaalsContact O-CA 3.3Å; I211-A215 WeakPolarHBondContact O-CA 3.41Å; I211-A215 PolarHBondContact O-N 2.95Å; I211-L218 HydrophobicContact CB-CD1 3.69Å; I211-L218 HydrophobicContact CG2-CD1 3.71Å; I211-V227 HydrophobicContact CD1-CG1 4.36Å; I211-V227 HydrophobicContact CG2-CG1 4.41Å; I211-I228 HydrophobicContact CD1-CD1 4.13Å; I211-F231 HydrophobicContact CD1-CD2 3.37Å; I211-F231 HydrophobicContact CD1-CE2 3.38Å; I211-F231 HydrophobicContact CD1-CG 4.19Å; I211-F231 HydrophobicContact CD1-CZ 4.2Å
212L97.3Very high97.6Very high50 Ų5039.1 Ų39.126%0.26224%0.238SC..Hα-helixtrans-59.8-43.4-172.2-179.358.7000112.3F208 E210 A214 A215 T242 Q246F208-L212 HydrophobicContact CE1-CD2 4.14Å; F208-L212 HydrophobicContact CZ-CD1 4.42Å; F208-L212 WeakPolarHBondContact O-CB 3.25Å; F208-L212 PolarHBondContact O-N 3.22Å; E210-L212 VanDerWaalsContact C-N 3.29Å; E210-L212 PolarHBondContact O-N 3.11Å; L212-A214 PolarHBondContact O-N 3.32Å; L212-A215 WeakPolarHBondContact O-CB 3.17Å; L212-A215 PolarHBondContact O-N 3.16Å; L212-T242 HydrophobicContact CD1-CG2 3.78Å; L212-T242 HydrophobicContact CD2-CG2 3.89Å; L212-Q246 HydrophobicContact CD1-CG 3.8Å
213A94.3Very high97.7Very high105 Ų10538.3 Ų38.387%0.86822%0.22SC*.THydrogen-bonded Turntrans-66.1-19.8177.500000113.7I211I211-A213 VanDerWaalsContact C-N 3.35Å; I211-A213 PolarHBondContact O-N 2.83Å
214A97.1Very high97.8Very high23 Ų2336.1 Ų36.119%0.1921%0.21CC..THydrogen-bonded Turntrans-11210.417800000112.9V180 I211 L212 Y216 S217 L218V180-A214 HydrophobicContact CG1-CB 3.74Å; V180-A214 HydrophobicContact CG2-CB 3.91Å; I211-A214 CarbonylContact O-C 3.08Å; I211-A214 VanDerWaalsContact O-C 3.29Å; I211-A214 WeakPolarHBondContact O-CA 3.42Å; I211-A214 PolarHBondContact O-N 2.93Å; L212-A214 PolarHBondContact O-N 3.32Å; A214-Y216 PolarHBondContact O-N 3.43Å; A214-S217 WeakPolarHBondContact O-CB 3.19Å; A214-S217 PolarHBondContact O-N 3.2Å; A214-L218 HydrophobicContact CB-CD1 4.21Å; A214-L218 HydrophobicContact CB-CG 4.36Å; A214-L218 PolarHBondContact O-N 3.16Å
215A97.9Very high97.9Very high1 Ų134.5 Ų34.51%0.00820%0.203CC..Hα-helixtrans-57.1-49.9-162.200000112.2I211 L212 S217 L218 M219 L243 Q246I211-A215 VanDerWaalsContact O-CA 3.3Å; I211-A215 WeakPolarHBondContact O-CA 3.41Å; I211-A215 PolarHBondContact O-N 2.95Å; L212-A215 WeakPolarHBondContact O-CB 3.17Å; L212-A215 PolarHBondContact O-N 3.16Å; A215-S217 PolarHBondContact O-N 2.85Å; A215-L218 PolarHBondContact O-N 3.23Å; A215-M219 HydrophobicContact CB-CE 4.36Å; A215-M219 VanDerWaalsContact O-CG 3.3Å; A215-M219 WeakPolarHBondContact O-CG 3.34Å; A215-M219 PolarHBondContact O-N 2.97Å; A215-L243 HydrophobicContact CB-CD2 4.18Å; A215-Q246 HydrophobicContact CB-CB 4.47Å; A215-Q246 HydrophobicContact CB-CG 4.36Å
216Y97.6Very high97.9Very high62 Ų6234.6 Ų34.624%0.24320%0.201CC..Hα-helixtrans-58.9-42.8178.4-176.2-95000113A214 L218 M219 T220 H250 Q253 L254A214-Y216 PolarHBondContact O-N 3.43Å; Y216-L218 PolarHBondContact O-N 3.08Å; Y216-M219 WeakPolarHBondContact O-CB 3.49Å; Y216-M219 PolarHBondContact O-N 3.42Å; Y216-T220 HydrophobicContact CE1-CG2 4.25Å; Y216-T220 PolarHBondContact O-N 2.69Å; Y216-T220 PolarHBondContact O-OG1 2.98Å; Y216-H250 HydrophobicContact CD2-CB 4.35Å; Y216-H250 HydrophobicContact CE2-CB 3.86Å; Y216-Q253 WeakPolarHBondContact OH-CG 3.39Å; Y216-Q253 PolarHBondContact OH-NE2 3.04Å; Y216-Q253 VanDerWaalsContact OH-NE2 3.13Å; Y216-Q253 PolarHBondContact OH-OE1 3.08Å; Y216-L254 HydrophobicContact CD2-CD1 4.39Å; Y216-L254 HydrophobicContact CD2-CD2 4.16Å; Y216-L254 HydrophobicContact CD2-CG 4.47Å; Y216-L254 HydrophobicContact CE2-CD1 4.14Å; Y216-L254 HydrophobicContact CE2-CD2 3.62Å; Y216-L254 HydrophobicContact CE2-CG 3.8Å
217S98.3Very high98Very high58 Ų5832.2 Ų32.241%0.40619%0.189SC..Hα-helixtrans-59.6-48175.4176.20000110.7A214 A215 M219 T220 D221A214-S217 WeakPolarHBondContact O-CB 3.19Å; A214-S217 PolarHBondContact O-N 3.2Å; A215-S217 PolarHBondContact O-N 2.85Å; S217-M219 VanDerWaalsContact C-N 3.35Å; S217-M219 PolarHBondContact O-N 2.68Å; S217-T220 CarbonylContact O-C 3.29Å; S217-T220 PolarHBondContact O-N 3.29Å; S217-T220 VanDerWaalsContact O-N 3.1Å; S217-T220 PolarHBondContact O-OG1 3.07Å; S217-D221 PolarHBondContact O-N 3Å
218L98.7Very high98Very high0 Ų032.2 Ų32.20%019%0.189CC..Hα-helixtrans-63.8-35.2178.1-67.2172.1000112.7V180 Q184 I211 A214 A215 Y216 T220 D221 G224 N225 I228V180-L218 HydrophobicContact CG1-CD2 4.35Å; Q184-L218 HydrophobicContact CG-CD2 3.72Å; I211-L218 HydrophobicContact CB-CD1 3.69Å; I211-L218 HydrophobicContact CG2-CD1 3.71Å; A214-L218 HydrophobicContact CB-CD1 4.21Å; A214-L218 HydrophobicContact CB-CG 4.36Å; A214-L218 PolarHBondContact O-N 3.16Å; A215-L218 PolarHBondContact O-N 3.23Å; Y216-L218 PolarHBondContact O-N 3.08Å; L218-T220 PolarHBondContact O-N 2.97Å; L218-D221 PolarHBondContact O-N 3.09Å; L218-G224 CarbonylContact O-C 3.22Å; L218-N225 VanDerWaalsContact O-CA 3.3Å; L218-N225 WeakPolarHBondContact O-CA 3.34Å; L218-N225 PolarHBondContact O-N 3.15Å; L218-I228 HydrophobicContact CB-CD1 3.93Å; L218-I228 HydrophobicContact CB-CG1 3.95Å; L218-I228 HydrophobicContact CD1-CD1 4.34Å
219M98.7Very high98Very high0 Ų033.7 Ų33.70%020%0.196CC..Hα-helixtrans-59.5-35.4173.3-67.3179.1-16700112.4A215 Y216 S217 I228 L243 Q246 V247 L254 Y259 G260 V263A215-M219 HydrophobicContact CB-CE 4.36Å; A215-M219 VanDerWaalsContact O-CG 3.3Å; A215-M219 WeakPolarHBondContact O-CG 3.34Å; A215-M219 PolarHBondContact O-N 2.97Å; Y216-M219 WeakPolarHBondContact O-CB 3.49Å; Y216-M219 PolarHBondContact O-N 3.42Å; S217-M219 VanDerWaalsContact C-N 3.35Å; S217-M219 PolarHBondContact O-N 2.68Å; M219-I228 HydrophobicContact CE-CG2 4.09Å; M219-I228 HydrophobicContact CG-CB 4.39Å; M219-I228 HydrophobicContact CG-CG1 4.05Å; M219-I228 HydrophobicContact CG-CG2 3.98Å; M219-L243 HydrophobicContact CE-CD2 4.27Å; M219-Q246 HydrophobicContact CE-CB 4.19Å; M219-V247 HydrophobicContact CE-CG2 3.72Å; M219-V247 HydrophobicContact SD-CG2 3.84Å; M219-L254 HydrophobicContact CB-CD2 3.91Å; M219-L254 HydrophobicContact SD-CD1 3.81Å; M219-L254 HydrophobicContact SD-CD2 4.35Å; M219-Y259 CarbonylContact O-C 3.45Å; M219-G260 WeakPolarHBondContact O-CA 3.5Å; M219-G260 PolarHBondContact O-N 3Å; M219-V263 HydrophobicContact CB-CG2 4.09Å; M219-V263 HydrophobicContact CG-CB 4.41Å; M219-V263 HydrophobicContact CG-CG1 3.97Å; M219-V263 HydrophobicContact CG-CG2 4.19Å; M219-V263 HydrophobicContact SD-CG1 4.19Å
220T98.5Very high98.1Very high36 Ų3632.2 Ų32.222%0.22118%0.181CC..Hα-helixtrans-90.7-5.1179.861.70000114.6Y216 S217 L218 L254 Q257 Y259Y216-T220 HydrophobicContact CE1-CG2 4.25Å; Y216-T220 PolarHBondContact O-N 2.69Å; Y216-T220 PolarHBondContact O-OG1 2.98Å; S217-T220 CarbonylContact O-C 3.29Å; S217-T220 PolarHBondContact O-N 3.29Å; S217-T220 VanDerWaalsContact O-N 3.1Å; S217-T220 PolarHBondContact O-OG1 3.07Å; L218-T220 PolarHBondContact O-N 2.97Å; T220-L254 HydrophobicContact CG2-CD2 3.84Å; T220-Q257 HydrophobicContact CG2-CG 4.31Å; T220-Q257 PolarHBondContact O-NE2 2.86Å; T220-Y259 WeakPolarHBondContact O-CD2 3.34Å
221D98.7Very high98.1Very high37 Ų3730.4 Ų30.420%0.19817%0.172CC..SBendtrans-86.1149.5-178.2179.2-108.1000113.1S217 L218 F223 G224 N225S217-D221 PolarHBondContact O-N 3Å; L218-D221 PolarHBondContact O-N 3.09Å; D221-F223 VanDerWaalsContact C-N 3.29Å; D221-F223 PolarHBondContact O-N 3.21Å; D221-F223 WeakPolarHBondContact OD1-CA 2.98Å; D221-F223 PolarHBondContact OD1-N 2.87Å; D221-G224 PolarHBondContact OD1-N 2.9Å; D221-N225 WeakPolarHBondContact O-CB 3.44Å; D221-N225 PolarHBondContact O-N 3.06Å; D221-N225 PolarHBondContact O-ND2 3.08Å
222V98.2Very high98.1Very high50 Ų5030.4 Ų30.430%0.30317%0.172SC..THydrogen-bonded Turntrans-63.8-27.5-178.259.40000114N225 Y226 Y259V222-N225 PolarHBondContact O-ND2 2.78Å; V222-N225 VanDerWaalsContact O-ND2 3.11Å; V222-Y226 WeakPolarHBondContact O-CE2 3.49Å; V222-Y259 HydrophobicContact CB-CE1 4.12Å; V222-Y259 HydrophobicContact CB-CE2 3.87Å; V222-Y259 HydrophobicContact CG2-CE1 3.93Å; V222-Y259 HydrophobicContact CG2-CE2 4.43Å; V222-Y259 WeakPolarHBondContact CG2-OH 3.36Å
223F98.6Very high98.1Very high59 Ų5931.1 Ų31.126%0.25917%0.174SC..THydrogen-bonded Turntrans-115.2-31.5177.6-54-52.4000112.9S183 Q184 Q186 S189 D221 N225S183-F223 CarbonylContact O-C 3.51Å; S183-F223 VanDerWaalsContact O-C 3.22Å; Q184-F223 WeakPolarHBondContact O-CD2 3.36Å; Q186-F223 HydrophobicContact CB-CD1 4.25Å; Q186-F223 HydrophobicContact CB-CD2 4.3Å; Q186-F223 HydrophobicContact CB-CE1 3.85Å; Q186-F223 HydrophobicContact CB-CE2 3.89Å; Q186-F223 HydrophobicContact CB-CG 4.48Å; Q186-F223 HydrophobicContact CB-CZ 3.65Å; Q186-F223 HydrophobicContact CG-CD1 4.27Å; Q186-F223 HydrophobicContact CG-CE1 3.71Å; Q186-F223 HydrophobicContact CG-CZ 3.91Å; S189-F223 PolarHBondContact OG-O 3.47Å; D221-F223 VanDerWaalsContact C-N 3.29Å; D221-F223 PolarHBondContact O-N 3.21Å; D221-F223 WeakPolarHBondContact OD1-CA 2.98Å; D221-F223 PolarHBondContact OD1-N 2.87Å; F223-N225 VanDerWaalsContact C-N 3.33Å; F223-N225 PolarHBondContact O-N 3.23Å
224G98.6Very high98.2Very high0 Ų029.9 Ų29.90%015%0.15CC..Hα-helixtrans-65.1-32.5-179.400000113.8S183 L218 D221 Y226 V227 I228S183-G224 VanDerWaalsContact O-CA 3.25Å; S183-G224 WeakPolarHBondContact O-CA 3.28Å; S183-G224 PolarHBondContact O-N 3.1Å; L218-G224 CarbonylContact O-C 3.22Å; D221-G224 PolarHBondContact OD1-N 2.9Å; G224-Y226 PolarHBondContact O-N 2.95Å; G224-Y226 VanDerWaalsContact O-N 3.09Å; G224-V227 WeakPolarHBondContact O-CB 3.32Å; G224-V227 PolarHBondContact O-N 3.31Å; G224-I228 PolarHBondContact O-N 2.81Å
225N98.7Very high98.2Very high0 Ų029.3 Ų29.30%015%0.146CC..Hα-helixtrans-57.6-33-176.471.194.9000112.3L218 D221 V222 F223 I228 Q229 V263L218-N225 VanDerWaalsContact O-CA 3.3Å; L218-N225 WeakPolarHBondContact O-CA 3.34Å; L218-N225 PolarHBondContact O-N 3.15Å; D221-N225 WeakPolarHBondContact O-CB 3.44Å; D221-N225 PolarHBondContact O-N 3.06Å; D221-N225 PolarHBondContact O-ND2 3.08Å; V222-N225 PolarHBondContact O-ND2 2.78Å; V222-N225 VanDerWaalsContact O-ND2 3.11Å; F223-N225 VanDerWaalsContact C-N 3.33Å; F223-N225 PolarHBondContact O-N 3.23Å; N225-I228 PolarHBondContact O-N 3.01Å; N225-Q229 WeakPolarHBondContact O-CG 3.4Å; N225-Q229 PolarHBondContact O-N 3.29Å; N225-Q229 PolarHBondContact O-NE2 2.84Å; N225-Q229 PolarHBondContact OD1-NE2 3.02Å; N225-V263 HydrophobicContact CB-CG2 4.05Å
226Y98.7Very high98.1Very high80 Ų8031.7 Ų31.731%0.31416%0.16SC..Hα-helixtrans-71.6-29.9178.8-61.2-76.7000112.9Q193 V222 G224 K230 R262Q193-Y226 VanDerWaalsContact CD-CB 3.48Å; Q193-Y226 VanDerWaalsContact NE2-CB 3.3Å; V222-Y226 WeakPolarHBondContact O-CE2 3.49Å; G224-Y226 PolarHBondContact O-N 2.95Å; G224-Y226 VanDerWaalsContact O-N 3.09Å; Y226-K230 WeakPolarHBondContact O-CG 3.4Å; Y226-K230 PolarHBondContact O-N 3.26Å; Y226-R262 PolarHBondContact OH-NH1 2.95Å
227V98.6Very high98Very high0 Ų034 Ų340%018%0.183CC..Hα-helixtrans-69.8-44.9174.8-179.30000109.7I192 L196 I211 G224 Q229 K230 F231I192-V227 HydrophobicContact CB-CG2 4.4Å; I192-V227 HydrophobicContact CG2-CG1 3.82Å; I192-V227 HydrophobicContact CG2-CG2 4.03Å; L196-V227 HydrophobicContact CD1-CG1 4.25Å; I211-V227 HydrophobicContact CD1-CG1 4.36Å; I211-V227 HydrophobicContact CG2-CG1 4.41Å; G224-V227 WeakPolarHBondContact O-CB 3.32Å; G224-V227 PolarHBondContact O-N 3.31Å; V227-Q229 PolarHBondContact O-N 3.4Å; V227-K230 PolarHBondContact O-N 3.17Å; V227-K230 VanDerWaalsContact O-N 3.14Å; V227-F231 HydrophobicContact CG1-CD2 4.36Å; V227-F231 HydrophobicContact CG1-CE2 4.27Å; V227-F231 WeakPolarHBondContact O-CD2 3.31Å; V227-F231 PolarHBondContact O-N 3.16Å
228I98.8Very high97.9Very high0 Ų038 Ų380%020%0.195CC..Hα-helixtrans-60.8-44174.8-50.9-58000111I211 L218 M219 G224 N225 K230 F231 F232 L243 V263I211-I228 HydrophobicContact CD1-CD1 4.13Å; L218-I228 HydrophobicContact CB-CD1 3.93Å; L218-I228 HydrophobicContact CB-CG1 3.95Å; L218-I228 HydrophobicContact CD1-CD1 4.34Å; M219-I228 HydrophobicContact CE-CG2 4.09Å; M219-I228 HydrophobicContact CG-CB 4.39Å; M219-I228 HydrophobicContact CG-CG1 4.05Å; M219-I228 HydrophobicContact CG-CG2 3.98Å; G224-I228 PolarHBondContact O-N 2.81Å; N225-I228 PolarHBondContact O-N 3.01Å; I228-K230 VanDerWaalsContact C-N 3.31Å; I228-K230 PolarHBondContact O-N 2.9Å; I228-F231 PolarHBondContact O-N 3.3Å; I228-F231 VanDerWaalsContact O-N 3.09Å; I228-F232 HydrophobicContact CG2-CD2 4.08Å; I228-F232 HydrophobicContact CG2-CE2 3.92Å; I228-F232 PolarHBondContact O-N 2.9Å; I228-L243 HydrophobicContact CG2-CD1 4.12Å; I228-L243 HydrophobicContact CG2-CD2 4.24Å; I228-V263 HydrophobicContact CB-CG1 4.41Å; I228-V263 HydrophobicContact CB-CG2 4.47Å; I228-V263 HydrophobicContact CG2-CG1 3.69Å
229Q98.6Very high97.9Very high36 Ų3638.1 Ų38.117%0.16820%0.196CC..Hα-helixtrans-58.6-37.8174.2-79.1162.579.900112.8N225 V227 F231 F232 E233 V263 K266N225-Q229 WeakPolarHBondContact O-CG 3.4Å; N225-Q229 PolarHBondContact O-N 3.29Å; N225-Q229 PolarHBondContact O-NE2 2.84Å; N225-Q229 PolarHBondContact OD1-NE2 3.02Å; V227-Q229 PolarHBondContact O-N 3.4Å; Q229-F231 VanDerWaalsContact C-N 3.31Å; Q229-F231 PolarHBondContact O-N 3.32Å; Q229-F232 PolarHBondContact O-N 3.38Å; Q229-E233 WeakPolarHBondContact O-CB 3.4Å; Q229-E233 PolarHBondContact O-N 2.97Å; Q229-V263 HydrophobicContact CG-CG2 4.38Å; Q229-K266 HydrophobicContact CB-CB 4.42Å; Q229-K266 HydrophobicContact CB-CG 4.12Å; Q229-K266 HydrophobicContact CG-CB 3.8Å; Q229-K266 HydrophobicContact CG-CG 4.06Å
230K98.4Very high97.8Very high40 Ų4040 Ų4017%0.17420%0.204CC..Hα-helixtrans-69.9-23.5175.7-75-72.4168.4-171.40113.7Q193 L196 E197 Y226 V227 I228 E233 F234Q193-K230 HydrophobicContact CB-CG 4.32Å; Q193-K230 HydrophobicContact CG-CG 4.14Å; L196-K230 HydrophobicContact CD1-CB 4.11Å; E197-K230 WeakPolarHBondContact OE1-CE 3.48Å; E197-K230 IonicContact OE1-NZ 3.88Å; E197-K230 PolarHBondContact OE1-NZ 2.87Å; Y226-K230 WeakPolarHBondContact O-CG 3.4Å; Y226-K230 PolarHBondContact O-N 3.26Å; V227-K230 PolarHBondContact O-N 3.17Å; V227-K230 VanDerWaalsContact O-N 3.14Å; I228-K230 VanDerWaalsContact C-N 3.31Å; I228-K230 PolarHBondContact O-N 2.9Å; K230-E233 WeakPolarHBondContact CE-OE2 3.32Å; K230-E233 IonicContact NZ-OE2 3.93Å; K230-E233 PolarHBondContact NZ-OE2 2.84Å; K230-F234 HydrophobicContact CD-CD2 3.82Å; K230-F234 HydrophobicContact CD-CE2 3.69Å; K230-F234 PolarHBondContact O-N 3.12Å
231F98.5Very high97.6Very high2 Ų241.2 Ų41.21%0.00921%0.209CC..Hα-helixtrans-79-36.5168.9-83.8-79.6000113.1L196 K204 V207 F208 I211 V227 I228 Q229 E233 G235 L243L196-F231 HydrophobicContact CD1-CD2 4.1Å; L196-F231 HydrophobicContact CD1-CE2 3.62Å; L196-F231 HydrophobicContact CD1-CZ 4.22Å; L196-F231 HydrophobicContact CD2-CE1 4.32Å; L196-F231 HydrophobicContact CD2-CE2 3.89Å; L196-F231 HydrophobicContact CD2-CZ 3.6Å; L196-F231 HydrophobicContact CG-CE2 4.44Å; K204-F231 HydrophobicContact CB-CE1 4.27Å; K204-F231 WeakPolarHBondContact O-CE1 3.35Å; K204-F231 WeakPolarHBondContact O-CZ 3.34Å; V207-F231 HydrophobicContact CB-CZ 4.04Å; V207-F231 HydrophobicContact CG1-CE2 3.78Å; V207-F231 HydrophobicContact CG1-CZ 3.8Å; F208-F231 HydrophobicContact CB-CD1 4.46Å; F208-F231 HydrophobicContact CB-CE1 3.76Å; F208-F231 HydrophobicContact CB-CZ 4.01Å; F208-F231 AromaticContact CD2-CD1 3.56Å; F208-F231 HydrophobicContact CD2-CD1 3.56Å; F208-F231 AromaticContact CD2-CE1 3.73Å; F208-F231 HydrophobicContact CD2-CE1 3.73Å; F208-F231 HydrophobicContact CD2-CG 4Å; F208-F231 HydrophobicContact CD2-CZ 4.31Å; F208-F231 HydrophobicContact CE2-CD1 4.29Å; F208-F231 HydrophobicContact CG-CD1 4.44Å; F208-F231 HydrophobicContact CG-CE1 4.21Å; I211-F231 HydrophobicContact CD1-CD2 3.37Å; I211-F231 HydrophobicContact CD1-CE2 3.38Å; I211-F231 HydrophobicContact CD1-CG 4.19Å; I211-F231 HydrophobicContact CD1-CZ 4.2Å; V227-F231 HydrophobicContact CG1-CD2 4.36Å; V227-F231 HydrophobicContact CG1-CE2 4.27Å; V227-F231 WeakPolarHBondContact O-CD2 3.31Å; V227-F231 PolarHBondContact O-N 3.16Å; I228-F231 PolarHBondContact O-N 3.3Å; I228-F231 VanDerWaalsContact O-N 3.09Å; Q229-F231 VanDerWaalsContact C-N 3.31Å; Q229-F231 PolarHBondContact O-N 3.32Å; F231-E233 PolarHBondContact O-N 3.29Å; F231-G235 WeakPolarHBondContact O-CA 3.25Å; F231-G235 PolarHBondContact O-N 2.96Å; F231-L243 HydrophobicContact CB-CD1 3.62Å
232F98.1Very high97.5Very high0 Ų040.9 Ų40.90%021%0.209CC..Hα-helixtrans-61.8-34.8166.5-80-65.4000111.9I228 Q229 K240 L243 V247 V263 K266 A267 S270 I271I228-F232 HydrophobicContact CG2-CD2 4.08Å; I228-F232 HydrophobicContact CG2-CE2 3.92Å; I228-F232 PolarHBondContact O-N 2.9Å; Q229-F232 PolarHBondContact O-N 3.38Å; F232-K240 HydrophobicContact CD1-CB 4.49Å; F232-K240 WeakPolarHBondContact O-CD 3.35Å; F232-K240 WeakPolarHBondContact O-CE 3.36Å; F232-K240 PolarHBondContact O-NZ 3.15Å; F232-L243 HydrophobicContact CD2-CD1 4.36Å; F232-L243 HydrophobicContact CE1-CB 3.95Å; F232-L243 HydrophobicContact CE2-CB 3.94Å; F232-L243 HydrophobicContact CE2-CD1 4.21Å; F232-L243 HydrophobicContact CZ-CB 3.47Å; F232-L243 VanDerWaalsContact CZ-CB 3.47Å; F232-L243 HydrophobicContact CZ-CD1 4.43Å; F232-V247 HydrophobicContact CZ-CG2 4.42Å; F232-V263 HydrophobicContact CD2-CG1 4.03Å; F232-V263 HydrophobicContact CE2-CG1 3.65Å; F232-K266 HydrophobicContact CB-CG 4.08Å; F232-A267 HydrophobicContact CD1-CB 3.96Å; F232-A267 HydrophobicContact CD2-CB 4.25Å; F232-A267 HydrophobicContact CE1-CB 3.65Å; F232-A267 HydrophobicContact CE2-CB 3.95Å; F232-A267 HydrophobicContact CG-CB 4.25Å; F232-A267 HydrophobicContact CZ-CB 3.64Å; F232-S270 WeakPolarHBondContact O-CB 3.44Å; F232-S270 PolarHBondContact O-OG 3.04Å; F232-I271 HydrophobicContact CD1-CG2 3.95Å; F232-I271 HydrophobicContact CE1-CG2 3.76Å
233E97.3Very high97.4Very high64 Ų6438.5 Ų38.530%0.29919%0.194SC..Hα-helixtrans-73.1-60.9176.7-164.9157-104.900112.7Q229 K230 F231 K240 K266Q229-E233 WeakPolarHBondContact O-CB 3.4Å; Q229-E233 PolarHBondContact O-N 2.97Å; K230-E233 WeakPolarHBondContact CE-OE2 3.32Å; K230-E233 IonicContact NZ-OE2 3.93Å; K230-E233 PolarHBondContact NZ-OE2 2.84Å; F231-E233 PolarHBondContact O-N 3.29Å; E233-K240 PolarHBondContact O-NZ 2.97Å; E233-K240 VanDerWaalsContact O-NZ 3.16Å; E233-K266 WeakPolarHBondContact OE1-CE 3.49Å; E233-K266 IonicContact OE1-NZ 2.73Å; E233-K266 PolarHBondContact OE1-NZ 2.65Å
234F96.2Very high97.2Very high80 Ų8036.1 Ų36.135%0.35119%0.186SC..Hα-helixtrans-114.26.8-167.3-57.2-64.8000115.7E197 K204 K230E197-F234 HydrophobicContact CB-CE2 4.25Å; E197-F234 HydrophobicContact CG-CD2 4.21Å; E197-F234 HydrophobicContact CG-CE2 3.68Å; E197-F234 HydrophobicContact CG-CZ 4.34Å; K204-F234 PolarHBondContact NZ-O 3.23Å; K230-F234 HydrophobicContact CD-CD2 3.82Å; K230-F234 HydrophobicContact CD-CE2 3.69Å; K230-F234 PolarHBondContact O-N 3.12Å
235G96.6Very high96.8Very high11 Ų1141.2 Ų41.211%0.11321%0.211CC..SBendtrans-74.4163.1173.900000112.9F231 K240F231-G235 WeakPolarHBondContact O-CA 3.25Å; F231-G235 PolarHBondContact O-N 2.96Å; G235-K240 VanDerWaalsContact O-CE 3.23Å; G235-K240 WeakPolarHBondContact O-CE 3.42Å
236T96.2Very high96.5Very high50 Ų5045 Ų4531%0.30723%0.229SC..  trans-66.8158.6172.567.40000110.9E238 Q239 K240T236-E238 PolarHBondContact O-N 3.43Å; T236-Q239 WeakPolarHBondContact O-CB 3.37Å; T236-Q239 PolarHBondContact O-N 2.95Å; T236-Q239 VanDerWaalsContact OG1-CG 3.29Å; T236-Q239 WeakPolarHBondContact OG1-CG 3.43Å; T236-Q239 PolarHBondContact OG1-N 3.17Å; T236-K240 WeakPolarHBondContact O-CG 3.43Å; T236-K240 PolarHBondContact O-N 2.81Å
237P95.2Very high96.3Very high111 Ų11141.2 Ų41.272%0.72121%0.214SC*.Hα-helixtrans-53.1-36.8174.8-27.636.1000113.2K240 N241P237-K240 PolarHBondContact O-N 3.04Å; P237-N241 VanDerWaalsContact O-CB 3.23Å; P237-N241 WeakPolarHBondContact O-CB 3.44Å; P237-N241 PolarHBondContact O-N 2.93Å
238E96.2Very high95.9Very high141 Ų14146.3 Ų46.366%0.65924%0.236SC*.Hα-helixtrans-63.6-43.7174.1-177.2-179.4-163.100112.9T236 N241 T242T236-E238 PolarHBondContact O-N 3.43Å; E238-N241 PolarHBondContact O-N 2.97Å; E238-T242 VanDerWaalsContact O-CB 3.3Å; E238-T242 WeakPolarHBondContact O-CB 3.43Å; E238-T242 PolarHBondContact O-N 2.86Å; E238-T242 PolarHBondContact O-OG1 2.96Å
239Q97.8Very high95.7Very high3 Ų349.2 Ų49.21%0.01427%0.266CS..Hα-helixtrans-65-42.3175.6-71.8167.6-7.400111.4F208 T236 T242 L243F208-Q239 HydrophobicContact CD1-CG 3.9Å; F208-Q239 HydrophobicContact CD2-CB 3.97Å; F208-Q239 HydrophobicContact CD2-CG 3.85Å; F208-Q239 HydrophobicContact CE1-CB 4.33Å; F208-Q239 HydrophobicContact CE1-CG 4.02Å; F208-Q239 HydrophobicContact CE2-CB 3.66Å; F208-Q239 HydrophobicContact CE2-CG 3.96Å; F208-Q239 HydrophobicContact CG-CB 4.42Å; F208-Q239 HydrophobicContact CG-CG 3.81Å; F208-Q239 HydrophobicContact CZ-CB 3.87Å; F208-Q239 HydrophobicContact CZ-CG 4.06Å; F208-Q239 WeakPolarHBondContact CZ-O 3.49Å; T236-Q239 WeakPolarHBondContact O-CB 3.37Å; T236-Q239 PolarHBondContact O-N 2.95Å; T236-Q239 VanDerWaalsContact OG1-CG 3.29Å; T236-Q239 WeakPolarHBondContact OG1-CG 3.43Å; T236-Q239 PolarHBondContact OG1-N 3.17Å; Q239-T242 PolarHBondContact O-N 3.44Å; Q239-L243 PolarHBondContact O-N 3.29Å
240K97.1Very high95.6Very high40 Ų4051.4 Ų51.417%0.17428%0.276CS..Hα-helixtrans-63.7-46.5175.8-60.9-169.7-165.6-156.70111.6F232 E233 G235 T236 P237 T242 L243 G244 S270F232-K240 HydrophobicContact CD1-CB 4.49Å; F232-K240 WeakPolarHBondContact O-CD 3.35Å; F232-K240 WeakPolarHBondContact O-CE 3.36Å; F232-K240 PolarHBondContact O-NZ 3.15Å; E233-K240 PolarHBondContact O-NZ 2.97Å; E233-K240 VanDerWaalsContact O-NZ 3.16Å; G235-K240 VanDerWaalsContact O-CE 3.23Å; G235-K240 WeakPolarHBondContact O-CE 3.42Å; T236-K240 WeakPolarHBondContact O-CG 3.43Å; T236-K240 PolarHBondContact O-N 2.81Å; P237-K240 PolarHBondContact O-N 3.04Å; K240-T242 VanDerWaalsContact C-N 3.33Å; K240-T242 PolarHBondContact O-N 3.45Å; K240-L243 PolarHBondContact O-N 3.36Å; K240-G244 PolarHBondContact O-N 2.97Å; K240-S270 VanDerWaalsContact CD-O 3.26Å; K240-S270 WeakPolarHBondContact CD-O 3.35Å
241N94.3Very high95.6Very high62 Ų6249.5 Ų49.533%0.33227%0.267SS..Hα-helixtrans-58.8-44.1175.3175.960.4000111.8P237 E238 L243 G244 M245 Q275P237-N241 VanDerWaalsContact O-CB 3.23Å; P237-N241 WeakPolarHBondContact O-CB 3.44Å; P237-N241 PolarHBondContact O-N 2.93Å; E238-N241 PolarHBondContact O-N 2.97Å; N241-L243 PolarHBondContact O-N 3.11Å; N241-G244 WeakPolarHBondContact O-CA 3.1Å; N241-G244 PolarHBondContact O-N 3.05Å; N241-G244 VanDerWaalsContact O-N 3.14Å; N241-M245 PolarHBondContact O-N 3.21Å; N241-Q275 PolarHBondContact OD1-NE2 3.32Å
242T96.5Very high95.6Very high30 Ų3051 Ų5118%0.18428%0.276CS..Hα-helixtrans-65.4-38.2178.9-570000112F208 L212 E238 Q239 K240 M245 Q246F208-T242 HydrophobicContact CE1-CG2 4.08Å; F208-T242 HydrophobicContact CZ-CG2 4.06Å; L212-T242 HydrophobicContact CD1-CG2 3.78Å; L212-T242 HydrophobicContact CD2-CG2 3.89Å; E238-T242 VanDerWaalsContact O-CB 3.3Å; E238-T242 WeakPolarHBondContact O-CB 3.43Å; E238-T242 PolarHBondContact O-N 2.86Å; E238-T242 PolarHBondContact O-OG1 2.96Å; Q239-T242 PolarHBondContact O-N 3.44Å; K240-T242 VanDerWaalsContact C-N 3.33Å; K240-T242 PolarHBondContact O-N 3.45Å; T242-M245 PolarHBondContact O-N 3.05Å; T242-Q246 PolarHBondContact O-N 3.1Å
243L97Very high95.6Very high0 Ų056.7 Ų56.70%030%0.302CS..Hα-helixtrans-69.2-34.4170.5-72172.2000112.7F208 A215 M219 I228 F231 F232 Q239 K240 N241 M245 Q246 V247F208-L243 HydrophobicContact CE2-CD1 3.9Å; F208-L243 HydrophobicContact CE2-CD2 4.22Å; F208-L243 HydrophobicContact CE2-CG 3.75Å; F208-L243 HydrophobicContact CZ-CG 4.1Å; A215-L243 HydrophobicContact CB-CD2 4.18Å; M219-L243 HydrophobicContact CE-CD2 4.27Å; I228-L243 HydrophobicContact CG2-CD1 4.12Å; I228-L243 HydrophobicContact CG2-CD2 4.24Å; F231-L243 HydrophobicContact CB-CD1 3.62Å; F232-L243 HydrophobicContact CD2-CD1 4.36Å; F232-L243 HydrophobicContact CE1-CB 3.95Å; F232-L243 HydrophobicContact CE2-CB 3.94Å; F232-L243 HydrophobicContact CE2-CD1 4.21Å; F232-L243 HydrophobicContact CZ-CB 3.47Å; F232-L243 VanDerWaalsContact CZ-CB 3.47Å; F232-L243 HydrophobicContact CZ-CD1 4.43Å; Q239-L243 PolarHBondContact O-N 3.29Å; K240-L243 PolarHBondContact O-N 3.36Å; N241-L243 PolarHBondContact O-N 3.11Å; L243-M245 VanDerWaalsContact C-N 3.32Å; L243-M245 PolarHBondContact O-N 2.97Å; L243-Q246 WeakPolarHBondContact O-CB 3.34Å; L243-Q246 PolarHBondContact O-N 3.03Å; L243-V247 WeakPolarHBondContact O-CG2 3.36Å; L243-V247 PolarHBondContact O-N 2.85Å
244G93Very high95.7Very high8 Ų853.7 Ų53.78%0.08229%0.288CS..Hα-helixtrans-57.1-44.4170.500000112K240 N241 Q246 V247 K248K240-G244 PolarHBondContact O-N 2.97Å; N241-G244 WeakPolarHBondContact O-CA 3.1Å; N241-G244 PolarHBondContact O-N 3.05Å; N241-G244 VanDerWaalsContact O-N 3.14Å; G244-Q246 PolarHBondContact O-N 3.12Å; G244-V247 WeakPolarHBondContact O-CB 3.46Å; G244-V247 PolarHBondContact O-N 2.91Å; G244-V247 VanDerWaalsContact O-N 3.09Å; G244-K248 PolarHBondContact O-N 3.13Å
245M90.2Very high95.8Very high108 Ų10849.9 Ų49.953%0.53227%0.271SS..Hα-helixtrans-65.5-21.7173.8-66.2-170.8-67.300114.1N241 T242 L243N241-M245 PolarHBondContact O-N 3.21Å; T242-M245 PolarHBondContact O-N 3.05Å; L243-M245 VanDerWaalsContact C-N 3.32Å; L243-M245 PolarHBondContact O-N 2.97Å
246Q93.5Very high95.9Very high79 Ų7951.3 Ų51.337%0.36928%0.276SS..Hα-helixtrans-85.5-19.2171.9-67-65.7-72.700113.5L212 A215 M219 T242 L243 G244L212-Q246 HydrophobicContact CD1-CG 3.8Å; A215-Q246 HydrophobicContact CB-CB 4.47Å; A215-Q246 HydrophobicContact CB-CG 4.36Å; M219-Q246 HydrophobicContact CE-CB 4.19Å; T242-Q246 PolarHBondContact O-N 3.1Å; L243-Q246 WeakPolarHBondContact O-CB 3.34Å; L243-Q246 PolarHBondContact O-N 3.03Å; G244-Q246 PolarHBondContact O-N 3.12Å
247V94.3Very high96Very high0 Ų051.6 Ų51.60%027%0.274CS..Hα-helixtrans-81.7-32.6172.7164.10000111.3M219 F232 L243 G244 H250 V251 L254 I264 I279M219-V247 HydrophobicContact CE-CG2 3.72Å; M219-V247 HydrophobicContact SD-CG2 3.84Å; F232-V247 HydrophobicContact CZ-CG2 4.42Å; L243-V247 WeakPolarHBondContact O-CG2 3.36Å; L243-V247 PolarHBondContact O-N 2.85Å; G244-V247 WeakPolarHBondContact O-CB 3.46Å; G244-V247 PolarHBondContact O-N 2.91Å; G244-V247 VanDerWaalsContact O-N 3.09Å; V247-H250 CarbonylContact O-C 3.18Å; V247-H250 WeakPolarHBondContact O-CA 3.27Å; V247-H250 WeakPolarHBondContact O-CB 3.5Å; V247-H250 PolarHBondContact O-N 3.23Å; V247-V251 HydrophobicContact CG1-CG2 3.63Å; V247-V251 PolarHBondContact O-N 3.21Å; V247-L254 HydrophobicContact CG1-CD1 4.4Å; V247-L254 HydrophobicContact CG2-CD1 4.22Å; V247-I264 HydrophobicContact CB-CD1 4.47Å; V247-I264 HydrophobicContact CG1-CD1 3.39Å; V247-I264 HydrophobicContact CG2-CD1 4.26Å; V247-I279 HydrophobicContact CG1-CD1 3.9Å; V247-I279 HydrophobicContact CG1-CG1 4.12Å
248K90.4Very high96.1Very high108 Ų10851.1 Ų51.147%0.4726%0.263SS..THydrogen-bonded Turntrans-60.3135.5-177.8-166.6169.9-172.7167.50112.6G244 H250 E278 E282G244-K248 PolarHBondContact O-N 3.13Å; K248-H250 PolarHBondContact O-N 3.43Å; K248-E278 WeakPolarHBondContact CE-OE2 3.32Å; K248-E278 IonicContact NZ-OE1 3.71Å; K248-E278 IonicContact NZ-OE2 3.96Å; K248-E278 PolarHBondContact NZ-OE2 3.02Å; K248-E282 VanDerWaalsContact CA-OE1 3.31Å; K248-E282 WeakPolarHBondContact CA-OE1 3.25Å; K248-E282 WeakPolarHBondContact CG-OE1 3.29Å
249G94.2Very high96.2Very high60 Ų6046.8 Ų46.862%0.61924%0.241SC*.THydrogen-bonded Turntrans80-3.2-171.900000114.4E282G249-E282 WeakPolarHBondContact CA-OE2 3.37Å; G249-E282 VanDerWaalsContact N-CD 3.26Å; G249-E282 PolarHBondContact N-OE1 3.41Å; G249-E282 PolarHBondContact N-OE2 3.39Å; G249-E282 VanDerWaalsContact N-OE2 3.12Å
250H97.3Very high96.3Very high82 Ų8246.6 Ų46.638%0.3824%0.24SC..  trans-130.25.2-175.2-60.5-64000113.7Y216 V247 K248 L252 Q253 L254 E282Y216-H250 HydrophobicContact CD2-CB 4.35Å; Y216-H250 HydrophobicContact CE2-CB 3.86Å; V247-H250 CarbonylContact O-C 3.18Å; V247-H250 WeakPolarHBondContact O-CA 3.27Å; V247-H250 WeakPolarHBondContact O-CB 3.5Å; V247-H250 PolarHBondContact O-N 3.23Å; K248-H250 PolarHBondContact O-N 3.43Å; H250-L252 PolarHBondContact O-N 3.49Å; H250-Q253 PolarHBondContact O-N 3.22Å; H250-Q253 VanDerWaalsContact O-N 3.09Å; H250-L254 HydrophobicContact CB-CD1 4.26Å; H250-L254 PolarHBondContact O-N 3.49Å; H250-E282 PolarHBondContact N-OE2 2.99Å
251V97.9Very high96.3Very high0 Ų045 Ų450%023%0.234CC..Hα-helixtrans-58.9-47-171.5176.50000111.7V247 Q253 L254 A255 I264 I279 E282 L283V247-V251 HydrophobicContact CG1-CG2 3.63Å; V247-V251 PolarHBondContact O-N 3.21Å; V251-Q253 VanDerWaalsContact C-N 3.29Å; V251-Q253 PolarHBondContact O-N 3.02Å; V251-L254 PolarHBondContact O-N 3.41Å; V251-A255 WeakPolarHBondContact O-CB 3.43Å; V251-A255 PolarHBondContact O-N 3.5Å; V251-I264 HydrophobicContact CG1-CD1 4.43Å; V251-I264 HydrophobicContact CG1-CG2 4.45Å; V251-I279 HydrophobicContact CG1-CG2 3.79Å; V251-I279 HydrophobicContact CG2-CB 4.24Å; V251-I279 HydrophobicContact CG2-CG1 4.19Å; V251-I279 HydrophobicContact CG2-CG2 3.93Å; V251-E282 HydrophobicContact CB-CB 3.76Å; V251-E282 HydrophobicContact CB-CG 4.44Å; V251-E282 WeakPolarHBondContact CB-OE2 3.34Å; V251-E282 HydrophobicContact CG1-CB 4.42Å; V251-E282 HydrophobicContact CG2-CB 4.05Å; V251-E282 VanDerWaalsContact CG2-CD 3.47Å; V251-E282 HydrophobicContact CG2-CG 4.29Å; V251-E282 VanDerWaalsContact CG2-OE2 3.27Å; V251-E282 WeakPolarHBondContact CG2-OE2 3.49Å; V251-E282 PolarHBondContact N-OE2 3Å; V251-L283 HydrophobicContact CG1-CD2 3.92Å; V251-L283 HydrophobicContact CG1-CG 4.18Å
252L98.3Very high96.5Very high35 Ų3546.9 Ų46.918%0.18324%0.237CC..Hα-helixtrans-59.3-40.4178.7-179.568.1000112.3H250 L256 L283 H286 C290H250-L252 PolarHBondContact O-N 3.49Å; L252-L256 HydrophobicContact CD1-CD1 4.01Å; L252-L256 HydrophobicContact CD1-CG 4.46Å; L252-L256 HydrophobicContact CG-CD1 4.16Å; L252-L256 VanDerWaalsContact O-CG 3.31Å; L252-L256 WeakPolarHBondContact O-CG 3.46Å; L252-L256 PolarHBondContact O-N 2.89Å; L252-L283 HydrophobicContact CD1-CD2 4.44Å; L252-H286 HydrophobicContact CD1-CB 3.78Å; L252-H286 HydrophobicContact CD2-CB 4.47Å; L252-H286 VanDerWaalsContact CD2-CD2 3.46Å; L252-H286 WeakPolarHBondContact CD2-CD2 3.46Å; L252-C290 VanDerWaalsContact CD1-SG 3.58Å
253Q98.4Very high96.6Very high119 Ų11945.5 Ų45.556%0.55623%0.228SC*.Hα-helixtrans-69.9-41.4-178.7-172.4173.6-5.300111.1Y216 H250 V251Y216-Q253 WeakPolarHBondContact OH-CG 3.39Å; Y216-Q253 PolarHBondContact OH-NE2 3.04Å; Y216-Q253 VanDerWaalsContact OH-NE2 3.13Å; Y216-Q253 PolarHBondContact OH-OE1 3.08Å; H250-Q253 PolarHBondContact O-N 3.22Å; H250-Q253 VanDerWaalsContact O-N 3.09Å; V251-Q253 VanDerWaalsContact C-N 3.29Å; V251-Q253 PolarHBondContact O-N 3.02Å
254L98.7Very high96.7Very high0 Ų045.5 Ų45.50%023%0.228CC..Hα-helixtrans-68.5-41.8175.6-70.1169.4000112Y216 M219 T220 V247 H250 V251 L256 Q257 G260 C261 I264Y216-L254 HydrophobicContact CD2-CD1 4.39Å; Y216-L254 HydrophobicContact CD2-CD2 4.16Å; Y216-L254 HydrophobicContact CD2-CG 4.47Å; Y216-L254 HydrophobicContact CE2-CD1 4.14Å; Y216-L254 HydrophobicContact CE2-CD2 3.62Å; Y216-L254 HydrophobicContact CE2-CG 3.8Å; M219-L254 HydrophobicContact CB-CD2 3.91Å; M219-L254 HydrophobicContact SD-CD1 3.81Å; M219-L254 HydrophobicContact SD-CD2 4.35Å; T220-L254 HydrophobicContact CG2-CD2 3.84Å; V247-L254 HydrophobicContact CG1-CD1 4.4Å; V247-L254 HydrophobicContact CG2-CD1 4.22Å; H250-L254 HydrophobicContact CB-CD1 4.26Å; H250-L254 PolarHBondContact O-N 3.49Å; V251-L254 PolarHBondContact O-N 3.41Å; L254-L256 VanDerWaalsContact C-N 3.27Å; L254-L256 PolarHBondContact O-N 3.47Å; L254-Q257 PolarHBondContact O-N 2.9Å; L254-G260 CarbonylContact O-C 3.42Å; L254-C261 PolarHBondContact O-N 3.22Å; L254-I264 HydrophobicContact CB-CD1 3.83Å; L254-I264 HydrophobicContact CB-CG1 3.74Å; L254-I264 HydrophobicContact CD1-CD1 3.9Å
255A98.6Very high97Very high0 Ų047 Ų470%023%0.233CC..Hα-helixtrans-62.2-32.5-178.900000113.4V251 Q257 C261 L283 N295 G296 V299V251-A255 WeakPolarHBondContact O-CB 3.43Å; V251-A255 PolarHBondContact O-N 3.5Å; A255-Q257 VanDerWaalsContact C-N 3.34Å; A255-C261 WeakPolarHBondContact O-CB 3.42Å; A255-L283 HydrophobicContact CB-CD2 4.39Å; A255-N295 CarbonylContact O-C 3.55Å; A255-N295 WeakPolarHBondContact O-CB 3.49Å; A255-G296 WeakPolarHBondContact O-CA 3.49Å; A255-G296 PolarHBondContact O-N 3.26Å; A255-V299 HydrophobicContact CB-CB 4.14Å; A255-V299 HydrophobicContact CB-CG1 4.12Å; A255-V299 HydrophobicContact CB-CG2 3.85Å
256L98.5Very high97.4Very high41 Ų4143.8 Ų43.822%0.21522%0.216CC..THydrogen-bonded Turntrans-85.4-3.5176.2-61.5171.8000113.2L252 L254 K289 D293 N295L252-L256 HydrophobicContact CD1-CD1 4.01Å; L252-L256 HydrophobicContact CD1-CG 4.46Å; L252-L256 HydrophobicContact CG-CD1 4.16Å; L252-L256 VanDerWaalsContact O-CG 3.31Å; L252-L256 WeakPolarHBondContact O-CG 3.46Å; L252-L256 PolarHBondContact O-N 2.89Å; L254-L256 VanDerWaalsContact C-N 3.27Å; L254-L256 PolarHBondContact O-N 3.47Å; L256-K289 HydrophobicContact CD1-CD 4.21Å; L256-D293 HydrophobicContact CD2-CB 3.55Å; L256-D293 WeakPolarHBondContact CD2-OD1 3.47Å; L256-N295 PolarHBondContact O-ND2 2.94Å
257Q98.6Very high97.6Very high56 Ų5640 Ų4026%0.26220%0.198SC..SBendtrans-102136.5-176.7-153.8-85.91.600111.4T220 L254 A255 Y259 G260 C261T220-Q257 HydrophobicContact CG2-CG 4.31Å; T220-Q257 PolarHBondContact O-NE2 2.86Å; L254-Q257 PolarHBondContact O-N 2.9Å; A255-Q257 VanDerWaalsContact C-N 3.34Å; Q257-Y259 PolarHBondContact O-N 3.2Å; Q257-Y259 VanDerWaalsContact O-N 3.09Å; Q257-G260 PolarHBondContact O-N 2.99Å; Q257-C261 VanDerWaalsContact O-CB 3.27Å; Q257-C261 WeakPolarHBondContact O-CB 3.15Å; Q257-C261 PolarHBondContact O-N 3.3Å; Q257-C261 PolarHBondContact O-SG 3.45Å; Q257-C261 VanDerWaalsContact O-SG 3.36Å
258M97.4Very high97.7Very high101 Ų10140 Ų4050%0.49820%0.198SC..THydrogen-bonded Turntrans-59-24-168.8176.1170.548.200116.2R262 N295M258-R262 PolarHBondContact O-NE 3.11Å; M258-N295 WeakPolarHBondContact CA-OD1 3.45Å
259Y98.5Very high98Very high50 Ų5039.2 Ų39.220%0.19620%0.196CC..THydrogen-bonded Turntrans-110.3-40177.2-51-63.7000111.1M219 T220 V222 Q257 C261 R262 V263M219-Y259 CarbonylContact O-C 3.45Å; T220-Y259 WeakPolarHBondContact O-CD2 3.34Å; V222-Y259 HydrophobicContact CB-CE1 4.12Å; V222-Y259 HydrophobicContact CB-CE2 3.87Å; V222-Y259 HydrophobicContact CG2-CE1 3.93Å; V222-Y259 HydrophobicContact CG2-CE2 4.43Å; V222-Y259 WeakPolarHBondContact CG2-OH 3.36Å; Q257-Y259 PolarHBondContact O-N 3.2Å; Q257-Y259 VanDerWaalsContact O-N 3.09Å; Y259-C261 VanDerWaalsContact C-N 3.27Å; Y259-C261 PolarHBondContact O-N 2.97Å; Y259-R262 VanDerWaalsContact O-CB 3.29Å; Y259-R262 WeakPolarHBondContact O-CB 3.41Å; Y259-R262 PolarHBondContact O-N 3.14Å; Y259-V263 PolarHBondContact O-N 3.42Å
260G98.6Very high98.1Very high0 Ų037.5 Ų37.50%018%0.175CC..Hα-helixtrans-57.1-37.9175.700000112.9M219 L254 Q257 R262 V263 I264M219-G260 WeakPolarHBondContact O-CA 3.5Å; M219-G260 PolarHBondContact O-N 3Å; L254-G260 CarbonylContact O-C 3.42Å; Q257-G260 PolarHBondContact O-N 2.99Å; G260-R262 PolarHBondContact O-N 3.13Å; G260-V263 WeakPolarHBondContact O-CA 3.5Å; G260-V263 WeakPolarHBondContact O-CB 3.32Å; G260-V263 PolarHBondContact O-N 3.39Å; G260-I264 PolarHBondContact O-N 3.22Å
261C98.6Very high98Very high6 Ų634.7 Ų34.74%0.04116%0.162CC..Hα-helixtrans-61-29178.273.20000112.3L254 A255 Q257 Y259 Q265 N295 V299L254-C261 PolarHBondContact O-N 3.22Å; A255-C261 WeakPolarHBondContact O-CB 3.42Å; Q257-C261 VanDerWaalsContact O-CB 3.27Å; Q257-C261 WeakPolarHBondContact O-CB 3.15Å; Q257-C261 PolarHBondContact O-N 3.3Å; Q257-C261 PolarHBondContact O-SG 3.45Å; Q257-C261 VanDerWaalsContact O-SG 3.36Å; Y259-C261 VanDerWaalsContact C-N 3.27Å; Y259-C261 PolarHBondContact O-N 2.97Å; C261-Q265 WeakPolarHBondContact O-CB 3.47Å; C261-Q265 VanDerWaalsContact O-CG 3.28Å; C261-Q265 WeakPolarHBondContact O-CG 3.38Å; C261-Q265 PolarHBondContact O-N 3.19Å; C261-Q265 PolarHBondContact O-NE2 3.27Å; C261-N295 HydrophobicContact CB-CB 3.95Å; C261-V299 HydrophobicContact CB-CG2 3.96Å
262R98.6Very high97.8Very high102 Ų10236.9 Ų36.939%0.38518%0.178SC..Hα-helixtrans-73.9-37.1176.3-51.6179.6176.4-137.9-10.7111.2Y226 M258 Y259 G260 K266Y226-R262 PolarHBondContact OH-NH1 2.95Å; M258-R262 PolarHBondContact O-NE 3.11Å; Y259-R262 VanDerWaalsContact O-CB 3.29Å; Y259-R262 WeakPolarHBondContact O-CB 3.41Å; Y259-R262 PolarHBondContact O-N 3.14Å; G260-R262 PolarHBondContact O-N 3.13Å; R262-K266 WeakPolarHBondContact O-CB 3.17Å; R262-K266 PolarHBondContact O-N 3.33Å
263V98.6Very high97.6Very high0 Ų038.5 Ų38.50%019%0.19CC..Hα-helixtrans-65.6-46.6173.4-174.70000110.6M219 N225 I228 Q229 F232 Y259 G260 Q265 K266 A267M219-V263 HydrophobicContact CB-CG2 4.09Å; M219-V263 HydrophobicContact CG-CB 4.41Å; M219-V263 HydrophobicContact CG-CG1 3.97Å; M219-V263 HydrophobicContact CG-CG2 4.19Å; M219-V263 HydrophobicContact SD-CG1 4.19Å; N225-V263 HydrophobicContact CB-CG2 4.05Å; I228-V263 HydrophobicContact CB-CG1 4.41Å; I228-V263 HydrophobicContact CB-CG2 4.47Å; I228-V263 HydrophobicContact CG2-CG1 3.69Å; Q229-V263 HydrophobicContact CG-CG2 4.38Å; F232-V263 HydrophobicContact CD2-CG1 4.03Å; F232-V263 HydrophobicContact CE2-CG1 3.65Å; Y259-V263 PolarHBondContact O-N 3.42Å; G260-V263 WeakPolarHBondContact O-CA 3.5Å; G260-V263 WeakPolarHBondContact O-CB 3.32Å; G260-V263 PolarHBondContact O-N 3.39Å; V263-Q265 VanDerWaalsContact C-N 3.35Å; V263-Q265 PolarHBondContact O-N 3.06Å; V263-K266 PolarHBondContact O-N 2.87Å; V263-A267 WeakPolarHBondContact O-CB 3.47Å; V263-A267 PolarHBondContact O-N 3.03Å
264I98.5Very high97.4Very high0 Ų038.3 Ų38.30%019%0.189CC..Hα-helixtrans-59.5-45.7176.2-58.2-59.2000110.9V247 V251 L254 G260 K266 A267 L268 I279 V299V247-I264 HydrophobicContact CB-CD1 4.47Å; V247-I264 HydrophobicContact CG1-CD1 3.39Å; V247-I264 HydrophobicContact CG2-CD1 4.26Å; V251-I264 HydrophobicContact CG1-CD1 4.43Å; V251-I264 HydrophobicContact CG1-CG2 4.45Å; L254-I264 HydrophobicContact CB-CD1 3.83Å; L254-I264 HydrophobicContact CB-CG1 3.74Å; L254-I264 HydrophobicContact CD1-CD1 3.9Å; G260-I264 PolarHBondContact O-N 3.22Å; I264-K266 PolarHBondContact O-N 3.31Å; I264-A267 PolarHBondContact O-N 3.41Å; I264-L268 HydrophobicContact CG2-CD1 4.18Å; I264-L268 WeakPolarHBondContact O-CG 3.44Å; I264-L268 PolarHBondContact O-N 2.83Å; I264-I279 HydrophobicContact CG2-CG2 4.1Å; I264-V299 HydrophobicContact CB-CG1 4.49Å; I264-V299 HydrophobicContact CB-CG2 4.11Å; I264-V299 HydrophobicContact CG2-CG1 3.6Å; I264-V299 HydrophobicContact CG2-CG2 4.12Å
265Q98.6Very high97.2Very high41 Ų4139.7 Ų39.719%0.19220%0.196CC..Hα-helixtrans-57.3-47.9175.5-77.7165.783.100111.9C261 V263 A267 L268 E269 V299 K302C261-Q265 WeakPolarHBondContact O-CB 3.47Å; C261-Q265 VanDerWaalsContact O-CG 3.28Å; C261-Q265 WeakPolarHBondContact O-CG 3.38Å; C261-Q265 PolarHBondContact O-N 3.19Å; C261-Q265 PolarHBondContact O-NE2 3.27Å; V263-Q265 VanDerWaalsContact C-N 3.35Å; V263-Q265 PolarHBondContact O-N 3.06Å; Q265-A267 VanDerWaalsContact C-N 3.34Å; Q265-A267 PolarHBondContact O-N 3.11Å; Q265-L268 PolarHBondContact O-N 3.42Å; Q265-E269 WeakPolarHBondContact O-CG 3.3Å; Q265-E269 PolarHBondContact O-N 3.1Å; Q265-V299 HydrophobicContact CG-CG2 4.33Å; Q265-K302 HydrophobicContact CB-CB 4.46Å; Q265-K302 HydrophobicContact CB-CG 4.17Å; Q265-K302 HydrophobicContact CG-CB 3.88Å; Q265-K302 HydrophobicContact CG-CG 4.14Å
266K98.4Very high97.1Very high39 Ų3940.7 Ų40.717%0.1720%0.2CC..Hα-helixtrans-70.2-29.1-179.9-168.553.3168-179.30113.4Q229 F232 E233 R262 V263 I264 E269 S270Q229-K266 HydrophobicContact CB-CB 4.42Å; Q229-K266 HydrophobicContact CB-CG 4.12Å; Q229-K266 HydrophobicContact CG-CB 3.8Å; Q229-K266 HydrophobicContact CG-CG 4.06Å; F232-K266 HydrophobicContact CB-CG 4.08Å; E233-K266 WeakPolarHBondContact OE1-CE 3.49Å; E233-K266 IonicContact OE1-NZ 2.73Å; E233-K266 PolarHBondContact OE1-NZ 2.65Å; R262-K266 WeakPolarHBondContact O-CB 3.17Å; R262-K266 PolarHBondContact O-N 3.33Å; V263-K266 PolarHBondContact O-N 2.87Å; I264-K266 PolarHBondContact O-N 3.31Å; K266-E269 HydrophobicContact CD-CB 4.46Å; K266-E269 VanDerWaalsContact CD-OE2 3.29Å; K266-E269 WeakPolarHBondContact CD-OE2 3.26Å; K266-E269 IonicContact NZ-OE2 2.8Å; K266-E269 PolarHBondContact NZ-OE2 3.11Å; K266-E269 PolarHBondContact O-N 2.9Å; K266-S270 VanDerWaalsContact O-CB 3.23Å; K266-S270 WeakPolarHBondContact O-CB 3.47Å; K266-S270 PolarHBondContact O-N 2.83Å; K266-S270 PolarHBondContact O-OG 3.06Å
267A97.8Very high96.9Very high0 Ų043 Ų430%021%0.21CC..Hα-helixtrans-64.1-50.3172.300000110.4F232 V263 I264 Q265 E269 S270 I271 I279F232-A267 HydrophobicContact CD1-CB 3.96Å; F232-A267 HydrophobicContact CD2-CB 4.25Å; F232-A267 HydrophobicContact CE1-CB 3.65Å; F232-A267 HydrophobicContact CE2-CB 3.95Å; F232-A267 HydrophobicContact CG-CB 4.25Å; F232-A267 HydrophobicContact CZ-CB 3.64Å; V263-A267 WeakPolarHBondContact O-CB 3.47Å; V263-A267 PolarHBondContact O-N 3.03Å; I264-A267 PolarHBondContact O-N 3.41Å; Q265-A267 VanDerWaalsContact C-N 3.34Å; Q265-A267 PolarHBondContact O-N 3.11Å; A267-E269 PolarHBondContact O-N 3.19Å; A267-S270 PolarHBondContact O-N 3.02Å; A267-I271 HydrophobicContact CB-CD1 4.47Å; A267-I271 VanDerWaalsContact O-CG1 3.26Å; A267-I271 WeakPolarHBondContact O-CG1 3.47Å; A267-I271 WeakPolarHBondContact O-CG2 3.49Å; A267-I271 PolarHBondContact O-N 2.61Å; A267-I279 HydrophobicContact CB-CD1 4.28Å
268L97.4Very high96.6Very high0 Ų044.6 Ų44.60%022%0.218CC..Hα-helixtrans-56.6-34.2176.9-70167.8000112.9I264 Q265 S270 Q276 I279 V280 V299 K302 V307I264-L268 HydrophobicContact CG2-CD1 4.18Å; I264-L268 WeakPolarHBondContact O-CG 3.44Å; I264-L268 PolarHBondContact O-N 2.83Å; Q265-L268 PolarHBondContact O-N 3.42Å; L268-S270 VanDerWaalsContact C-N 3.29Å; L268-S270 PolarHBondContact O-N 3.45Å; L268-Q276 HydrophobicContact CD2-CB 4.31Å; L268-Q276 HydrophobicContact CD2-CG 4.34Å; L268-Q276 PolarHBondContact O-NE2 2.91Å; L268-I279 HydrophobicContact CD2-CB 4.46Å; L268-I279 HydrophobicContact CD2-CG2 4.05Å; L268-I279 HydrophobicContact CG-CG2 4.5Å; L268-V280 HydrophobicContact CD2-CG2 4.1Å; L268-V299 HydrophobicContact CD1-CG1 4.49Å; L268-K302 HydrophobicContact CB-CG 3.98Å; L268-K302 HydrophobicContact CD1-CB 4.16Å; L268-K302 HydrophobicContact CD1-CG 4Å; L268-V307 HydrophobicContact CD2-CG2 4.23Å
269E97.2Very high96.4Very high92 Ų9240.1 Ų40.143%0.4320%0.196SC..THydrogen-bonded Turntrans-72.8-12.2174.4-67.9178.5169.100114.8Q265 K266 A267 K302Q265-E269 WeakPolarHBondContact O-CG 3.3Å; Q265-E269 PolarHBondContact O-N 3.1Å; K266-E269 HydrophobicContact CD-CB 4.46Å; K266-E269 VanDerWaalsContact CD-OE2 3.29Å; K266-E269 WeakPolarHBondContact CD-OE2 3.26Å; K266-E269 IonicContact NZ-OE2 2.8Å; K266-E269 PolarHBondContact NZ-OE2 3.11Å; K266-E269 PolarHBondContact O-N 2.9Å; A267-E269 PolarHBondContact O-N 3.19Å; E269-K302 HydrophobicContact CG-CD 3.86Å; E269-K302 VanDerWaalsContact OE1-CE 3.3Å; E269-K302 WeakPolarHBondContact OE1-CE 3.48Å; E269-K302 IonicContact OE1-NZ 3.78Å; E269-K302 PolarHBondContact OE1-NZ 3.44Å
270S95.3Very high96.3Very high24 Ų2437.8 Ų37.817%0.16819%0.187CC..THydrogen-bonded Turntrans-136.1-7.5-159.3-51.40000117F232 K240 K266 A267 L268F232-S270 WeakPolarHBondContact O-CB 3.44Å; F232-S270 PolarHBondContact O-OG 3.04Å; K240-S270 VanDerWaalsContact CD-O 3.26Å; K240-S270 WeakPolarHBondContact CD-O 3.35Å; K266-S270 VanDerWaalsContact O-CB 3.23Å; K266-S270 WeakPolarHBondContact O-CB 3.47Å; K266-S270 PolarHBondContact O-N 2.83Å; K266-S270 PolarHBondContact O-OG 3.06Å; A267-S270 PolarHBondContact O-N 3.02Å; L268-S270 VanDerWaalsContact C-N 3.29Å; L268-S270 PolarHBondContact O-N 3.45Å
271I94.6Very high96.1Very high22 Ų2244 Ų4411%0.11322%0.215CC..SBendtrans-104.3175.3178.967.9-166.3000111.3F232 A267 Q275 Q276 I279F232-I271 HydrophobicContact CD1-CG2 3.95Å; F232-I271 HydrophobicContact CE1-CG2 3.76Å; A267-I271 HydrophobicContact CB-CD1 4.47Å; A267-I271 VanDerWaalsContact O-CG1 3.26Å; A267-I271 WeakPolarHBondContact O-CG1 3.47Å; A267-I271 WeakPolarHBondContact O-CG2 3.49Å; A267-I271 PolarHBondContact O-N 2.61Å; I271-Q275 HydrophobicContact CB-CB 4.04Å; I271-Q275 HydrophobicContact CD1-CB 3.76Å; I271-Q275 HydrophobicContact CG1-CB 3.88Å; I271-Q276 HydrophobicContact CD1-CG 4.33Å; I271-Q276 HydrophobicContact CG1-CG 3.86Å; I271-I279 HydrophobicContact CD1-CD1 3.54Å; I271-I279 HydrophobicContact CD1-CG1 4.47Å
272S94.6Very high96Very high47 Ų4746.1 Ų46.133%0.32923%0.225SC..  trans-78.3160.2178.879.40000112.7E274 Q275 Q276S272-E274 WeakPolarHBondContact CB-OE2 3.49Å; S272-E274 PolarHBondContact O-N 2.93Å; S272-E274 VanDerWaalsContact O-N 3.17Å; S272-E274 PolarHBondContact OG-OE2 3.44Å; S272-Q275 PolarHBondContact O-N 3Å; S272-Q276 PolarHBondContact O-N 2.81Å
273P95.1Very high96Very high68 Ų6841.4 Ų41.444%0.44221%0.207SC..Hα-helixtrans-57.5-30.5-177.9-26.436.5000114.5Q276 Q277P273-Q276 WeakPolarHBondContact O-CB 3.48Å; P273-Q277 VanDerWaalsContact O-CG 3.3Å; P273-Q277 WeakPolarHBondContact O-CG 3.36Å; P273-Q277 PolarHBondContact O-N 3.1Å; P273-Q277 PolarHBondContact O-NE2 3.45Å
274E93.6Very high95.9Very high116 Ų11644.9 Ų44.954%0.54223%0.226SC..Hα-helixtrans-67-44.1176.4-53.173-157.300110.3S272 Q277 E278S272-E274 WeakPolarHBondContact CB-OE2 3.49Å; S272-E274 PolarHBondContact O-N 2.93Å; S272-E274 VanDerWaalsContact O-N 3.17Å; S272-E274 PolarHBondContact OG-OE2 3.44Å; E274-Q277 PolarHBondContact O-N 3.15Å; E274-E278 PolarHBondContact O-N 3.11Å
275Q93.8Very high95.9Very high28 Ų2848.1 Ų48.113%0.13126%0.26CS..Hα-helixtrans-72.6-31.8177.8-53.7-159.1-81.200112.5N241 I271 S272 E278 I279N241-Q275 PolarHBondContact OD1-NE2 3.32Å; I271-Q275 HydrophobicContact CB-CB 4.04Å; I271-Q275 HydrophobicContact CD1-CB 3.76Å; I271-Q275 HydrophobicContact CG1-CB 3.88Å; S272-Q275 PolarHBondContact O-N 3Å; Q275-E278 PolarHBondContact O-N 3.3Å; Q275-I279 WeakPolarHBondContact O-CG1 3.46Å; Q275-I279 PolarHBondContact O-N 3.49Å; Q275-I279 VanDerWaalsContact O-N 3.09Å
276Q96Very high95.8Very high21 Ų2150 Ų5010%0.09827%0.268CS..Hα-helixtrans-58.4-49.5168.3-70.5179.3-27.500110.4L268 I271 S272 P273 E278 I279 V280 C306 V307L268-Q276 HydrophobicContact CD2-CB 4.31Å; L268-Q276 HydrophobicContact CD2-CG 4.34Å; L268-Q276 PolarHBondContact O-NE2 2.91Å; I271-Q276 HydrophobicContact CD1-CG 4.33Å; I271-Q276 HydrophobicContact CG1-CG 3.86Å; S272-Q276 PolarHBondContact O-N 2.81Å; P273-Q276 WeakPolarHBondContact O-CB 3.48Å; Q276-E278 PolarHBondContact O-N 3.41Å; Q276-I279 PolarHBondContact O-N 3.16Å; Q276-V280 WeakPolarHBondContact O-CB 3.32Å; Q276-V280 WeakPolarHBondContact O-CG2 3.46Å; Q276-V280 PolarHBondContact O-N 3.04Å; Q276-C306 PolarHBondContact NE2-O 3.31Å; Q276-C306 PolarHBondContact OE1-O 3.46Å; Q276-V307 HydrophobicContact CB-CG1 4.32Å; Q276-V307 HydrophobicContact CB-CG2 4.02Å; Q276-V307 HydrophobicContact CG-CG2 4.38Å
277Q95Very high95.8Very high90 Ų9048.4 Ų48.442%0.42126%0.262SS..Hα-helixtrans-61.3-41.3178.9-72.4173.348.500112.3P273 E274 I279 V280 H281 V307 A311P273-Q277 VanDerWaalsContact O-CG 3.3Å; P273-Q277 WeakPolarHBondContact O-CG 3.36Å; P273-Q277 PolarHBondContact O-N 3.1Å; P273-Q277 PolarHBondContact O-NE2 3.45Å; E274-Q277 PolarHBondContact O-N 3.15Å; Q277-I279 PolarHBondContact O-N 3.15Å; Q277-V280 PolarHBondContact O-N 2.88Å; Q277-H281 WeakPolarHBondContact O-CB 3.35Å; Q277-H281 PolarHBondContact O-N 3.11Å; Q277-V307 HydrophobicContact CG-CG1 4.48Å; Q277-A311 HydrophobicContact CG-CB 3.82Å
278E93.4Very high95.9Very high90 Ų9051 Ų5142%0.42128%0.275SS..Hα-helixtrans-58-47.9173.5-72.3-173.2-158.300112.4K248 E274 Q275 Q276K248-E278 WeakPolarHBondContact CE-OE2 3.32Å; K248-E278 IonicContact NZ-OE1 3.71Å; K248-E278 IonicContact NZ-OE2 3.96Å; K248-E278 PolarHBondContact NZ-OE2 3.02Å; E274-E278 PolarHBondContact O-N 3.11Å; Q275-E278 PolarHBondContact O-N 3.3Å; Q276-E278 PolarHBondContact O-N 3.41Å
279I93.3Very high95.9Very high6 Ų656.8 Ų56.83%0.03130%0.3CS..Hα-helixtrans-63.7-43.3177.7-72.7-178.8000111.2V247 V251 I264 A267 L268 I271 Q275 Q276 Q277 H281 E282V247-I279 HydrophobicContact CG1-CD1 3.9Å; V247-I279 HydrophobicContact CG1-CG1 4.12Å; V251-I279 HydrophobicContact CG1-CG2 3.79Å; V251-I279 HydrophobicContact CG2-CB 4.24Å; V251-I279 HydrophobicContact CG2-CG1 4.19Å; V251-I279 HydrophobicContact CG2-CG2 3.93Å; I264-I279 HydrophobicContact CG2-CG2 4.1Å; A267-I279 HydrophobicContact CB-CD1 4.28Å; L268-I279 HydrophobicContact CD2-CB 4.46Å; L268-I279 HydrophobicContact CD2-CG2 4.05Å; L268-I279 HydrophobicContact CG-CG2 4.5Å; I271-I279 HydrophobicContact CD1-CD1 3.54Å; I271-I279 HydrophobicContact CD1-CG1 4.47Å; Q275-I279 WeakPolarHBondContact O-CG1 3.46Å; Q275-I279 PolarHBondContact O-N 3.49Å; Q275-I279 VanDerWaalsContact O-N 3.09Å; Q276-I279 PolarHBondContact O-N 3.16Å; Q277-I279 PolarHBondContact O-N 3.15Å; I279-H281 VanDerWaalsContact C-N 3.35Å; I279-H281 PolarHBondContact O-N 3.28Å; I279-E282 PolarHBondContact O-N 3Å
280V95.2Very high96Very high2 Ų252.5 Ų52.51%0.01228%0.28CS..Hα-helixtrans-65.5-38-177.4167.70000111.6L268 Q276 Q277 E282 L283 C303 V307 L312 F314L268-V280 HydrophobicContact CD2-CG2 4.1Å; Q276-V280 WeakPolarHBondContact O-CB 3.32Å; Q276-V280 WeakPolarHBondContact O-CG2 3.46Å; Q276-V280 PolarHBondContact O-N 3.04Å; Q277-V280 PolarHBondContact O-N 2.88Å; V280-E282 VanDerWaalsContact C-N 3.29Å; V280-E282 PolarHBondContact O-N 3.43Å; V280-L283 WeakPolarHBondContact O-CB 3.45Å; V280-L283 PolarHBondContact O-N 3.47Å; V280-C303 HydrophobicContact CG2-CB 4.15Å; V280-V307 HydrophobicContact CG2-CG1 4.26Å; V280-V307 HydrophobicContact CG2-CG2 3.9Å; V280-L312 HydrophobicContact CG1-CD2 4Å; V280-F314 HydrophobicContact CG1-CE1 3.56Å; V280-F314 HydrophobicContact CG1-CZ 3.62Å; V280-F314 WeakPolarHBondContact O-CZ 3.39Å
281H94.3Very high96.2Very high129 Ų12951.3 Ų51.360%0.59727%0.272SS*.Hα-helixtrans-68.6-25.9-177.5-163.835.8000113Q277 I279 L283 D284Q277-H281 WeakPolarHBondContact O-CB 3.35Å; Q277-H281 PolarHBondContact O-N 3.11Å; I279-H281 VanDerWaalsContact C-N 3.35Å; I279-H281 PolarHBondContact O-N 3.28Å; H281-L283 PolarHBondContact O-N 3.07Å; H281-L283 VanDerWaalsContact O-N 3.16Å; H281-D284 IonicContact CE1-OD2 2.75Å; H281-D284 IonicContact ND1-OD2 2.7Å; H281-D284 WeakPolarHBondContact O-CB 3.23Å; H281-D284 PolarHBondContact O-N 2.83Å
282E97.1Very high96.3Very high51 Ų5153.9 Ų53.924%0.23828%0.283CS..THydrogen-bonded Turntrans-66.3-8.2170.1-75.8-176.1-137.700114.3K248 G249 H250 V251 I279 V280K248-E282 VanDerWaalsContact CA-OE1 3.31Å; K248-E282 WeakPolarHBondContact CA-OE1 3.25Å; K248-E282 WeakPolarHBondContact CG-OE1 3.29Å; G249-E282 WeakPolarHBondContact CA-OE2 3.37Å; G249-E282 VanDerWaalsContact N-CD 3.26Å; G249-E282 PolarHBondContact N-OE1 3.41Å; G249-E282 PolarHBondContact N-OE2 3.39Å; G249-E282 VanDerWaalsContact N-OE2 3.12Å; H250-E282 PolarHBondContact N-OE2 2.99Å; V251-E282 HydrophobicContact CB-CB 3.76Å; V251-E282 HydrophobicContact CB-CG 4.44Å; V251-E282 WeakPolarHBondContact CB-OE2 3.34Å; V251-E282 HydrophobicContact CG1-CB 4.42Å; V251-E282 HydrophobicContact CG2-CB 4.05Å; V251-E282 VanDerWaalsContact CG2-CD 3.47Å; V251-E282 HydrophobicContact CG2-CG 4.29Å; V251-E282 VanDerWaalsContact CG2-OE2 3.27Å; V251-E282 WeakPolarHBondContact CG2-OE2 3.49Å; V251-E282 PolarHBondContact N-OE2 3Å; I279-E282 PolarHBondContact O-N 3Å; V280-E282 VanDerWaalsContact C-N 3.29Å; V280-E282 PolarHBondContact O-N 3.43Å
283L97.4Very high96.5Very high4 Ų453.4 Ų53.42%0.02128%0.276CS..THydrogen-bonded Turntrans-95-4.2172.8-56.7178.4000113.1V251 L252 A255 V280 H281 H286 V287 V299 F314V251-L283 HydrophobicContact CG1-CD2 3.92Å; V251-L283 HydrophobicContact CG1-CG 4.18Å; L252-L283 HydrophobicContact CD1-CD2 4.44Å; A255-L283 HydrophobicContact CB-CD2 4.39Å; V280-L283 WeakPolarHBondContact O-CB 3.45Å; V280-L283 PolarHBondContact O-N 3.47Å; H281-L283 PolarHBondContact O-N 3.07Å; H281-L283 VanDerWaalsContact O-N 3.16Å; L283-H286 CarbonylContact O-C 3.3Å; L283-H286 WeakPolarHBondContact O-CA 3.45Å; L283-H286 PolarHBondContact O-N 3.08Å; L283-H286 VanDerWaalsContact O-N 3.08Å; L283-V287 PolarHBondContact O-N 3.44Å; L283-V287 VanDerWaalsContact O-N 3.09Å; L283-V299 HydrophobicContact CD1-CG1 3.93Å; L283-F314 HydrophobicContact CB-CE2 4.44Å
284D97.5Very high96.7Very high72 Ų7256 Ų5639%0.38528%0.282SS..THydrogen-bonded Turntrans-65.3148.5175-156.9-7.9000111H281 H286 F314H281-D284 IonicContact CE1-OD2 2.75Å; H281-D284 IonicContact ND1-OD2 2.7Å; H281-D284 WeakPolarHBondContact O-CB 3.23Å; H281-D284 PolarHBondContact O-N 2.83Å; D284-H286 PolarHBondContact O-N 3.15Å; D284-F314 HydrophobicContact CB-CD2 3.69Å; D284-F314 HydrophobicContact CB-CE2 3.95Å; D284-F314 HydrophobicContact CB-CG 4.25Å; D284-F314 VanDerWaalsContact CG-CD2 3.49Å; D284-F314 WeakPolarHBondContact OD1-CD2 3.46Å
285G97.4Very high96.9Very high69 Ų6951.5 Ų51.571%0.71126%0.262SS*.THydrogen-bonded Turntrans64-4.6-166.300000115.3
286H98.3Very high97.1Very high81 Ų8150.2 Ų50.238%0.37526%0.256SS..THydrogen-bonded Turntrans-124.9-5.6-172.8-62.3-34.1000114.7L252 L283 D284 L288 K289 C290L252-H286 HydrophobicContact CD1-CB 3.78Å; L252-H286 HydrophobicContact CD2-CB 4.47Å; L252-H286 VanDerWaalsContact CD2-CD2 3.46Å; L252-H286 WeakPolarHBondContact CD2-CD2 3.46Å; L283-H286 CarbonylContact O-C 3.3Å; L283-H286 WeakPolarHBondContact O-CA 3.45Å; L283-H286 PolarHBondContact O-N 3.08Å; L283-H286 VanDerWaalsContact O-N 3.08Å; D284-H286 PolarHBondContact O-N 3.15Å; H286-L288 PolarHBondContact O-N 3.37Å; H286-K289 VanDerWaalsContact O-CB 3.32Å; H286-K289 WeakPolarHBondContact O-CB 3.45Å; H286-K289 PolarHBondContact O-N 2.88Å; H286-C290 PolarHBondContact O-N 3.47Å; H286-C290 VanDerWaalsContact O-N 3.15Å
287V98.4Very high97.3Very high5 Ų549.2 Ų49.23%0.0325%0.251CS..Hα-helixtrans-39.7-58.2179.4179.90000113.5L283 K289 C290 V291 F314 I315 A318 F319L283-V287 PolarHBondContact O-N 3.44Å; L283-V287 VanDerWaalsContact O-N 3.09Å; V287-K289 VanDerWaalsContact C-N 3.26Å; V287-K289 PolarHBondContact O-N 3.34Å; V287-C290 PolarHBondContact O-N 3.18Å; V287-C290 VanDerWaalsContact O-N 3.1Å; V287-V291 HydrophobicContact CG1-CG2 4.1Å; V287-V291 VanDerWaalsContact O-CG2 3.32Å; V287-V291 WeakPolarHBondContact O-CG2 3.21Å; V287-V291 PolarHBondContact O-N 3.48Å; V287-F314 HydrophobicContact CG2-CD2 3.59Å; V287-F314 HydrophobicContact CG2-CE2 3.49Å; V287-F314 VanDerWaalsContact CG2-CE2 3.49Å; V287-I315 HydrophobicContact CG1-CB 4.39Å; V287-I315 HydrophobicContact CG1-CG2 3.87Å; V287-I315 HydrophobicContact CG2-CG1 4.2Å; V287-A318 HydrophobicContact CB-CB 3.85Å; V287-A318 HydrophobicContact CG1-CB 4.01Å; V287-A318 HydrophobicContact CG2-CB 4.19Å; V287-F319 HydrophobicContact CG1-CD2 4.23Å; V287-F319 HydrophobicContact CG1-CE2 3.82Å
288L98.4Very high97.4Very high55 Ų5548.1 Ų48.129%0.28825%0.246SC..Hα-helixtrans-63.9-28-175.4-69.3177.5000113.7H286 K292 A318 Q322 L326H286-L288 PolarHBondContact O-N 3.37Å; L288-K292 WeakPolarHBondContact O-CB 3.29Å; L288-K292 WeakPolarHBondContact O-CG 3.29Å; L288-K292 PolarHBondContact O-N 2.94Å; L288-A318 WeakPolarHBondContact CD2-O 3.44Å; L288-Q322 HydrophobicContact CD1-CG 4.07Å; L288-Q322 HydrophobicContact CD2-CB 4.4Å; L288-Q322 HydrophobicContact CD2-CG 4.26Å; L288-L326 HydrophobicContact CD2-CD1 3.88Å; L288-L326 HydrophobicContact CD2-CD2 4.39Å
289K98.6Very high97.7Very high121 Ų12143.9 Ų43.953%0.52623%0.226SC..Hα-helixtrans-70.2-46.4173.5-176.6-171.8178.8-169.90110.2L256 H286 V287 K292 D293L256-K289 HydrophobicContact CD1-CD 4.21Å; H286-K289 VanDerWaalsContact O-CB 3.32Å; H286-K289 WeakPolarHBondContact O-CB 3.45Å; H286-K289 PolarHBondContact O-N 2.88Å; V287-K289 VanDerWaalsContact C-N 3.26Å; V287-K289 PolarHBondContact O-N 3.34Å; K289-K292 PolarHBondContact O-N 3.22Å; K289-D293 WeakPolarHBondContact O-CB 3.05Å; K289-D293 PolarHBondContact O-N 3.34Å; K289-D293 VanDerWaalsContact O-N 3.15Å
290C98.7Very high97.9Very high1 Ų143.8 Ų43.81%0.00723%0.226CC..Hα-helixtrans-65.3-45.3178.4-63.30000112L252 H286 V287 K292 D293 G296 N297 V300L252-C290 VanDerWaalsContact CD1-SG 3.58Å; H286-C290 PolarHBondContact O-N 3.47Å; H286-C290 VanDerWaalsContact O-N 3.15Å; V287-C290 PolarHBondContact O-N 3.18Å; V287-C290 VanDerWaalsContact O-N 3.1Å; C290-K292 VanDerWaalsContact C-N 3.26Å; C290-K292 PolarHBondContact O-N 3.42Å; C290-D293 PolarHBondContact O-N 3.05Å; C290-D293 VanDerWaalsContact O-N 3.11Å; C290-G296 CarbonylContact O-C 3.47Å; C290-G296 WeakPolarHBondContact O-CA 3.34Å; C290-N297 PolarHBondContact O-N 3.02Å; C290-V300 HydrophobicContact CB-CG2 3.64Å
291V98.7Very high98.1Very high0 Ų044.3 Ų44.30%023%0.229CC..Hα-helixtrans-61.7-32.1178.9171.80000112.8V287 V300 F319 L326 Y331 V335V287-V291 HydrophobicContact CG1-CG2 4.1Å; V287-V291 VanDerWaalsContact O-CG2 3.32Å; V287-V291 WeakPolarHBondContact O-CG2 3.21Å; V287-V291 PolarHBondContact O-N 3.48Å; V291-V300 HydrophobicContact CG2-CB 4.23Å; V291-V300 HydrophobicContact CG2-CG1 3.88Å; V291-V300 HydrophobicContact CG2-CG2 4.1Å; V291-F319 HydrophobicContact CG1-CZ 4.1Å; V291-F319 HydrophobicContact CG2-CE2 3.86Å; V291-F319 HydrophobicContact CG2-CZ 3.88Å; V291-L326 HydrophobicContact CG1-CD2 3.7Å; V291-Y331 WeakPolarHBondContact O-CB 3.04Å; V291-V335 HydrophobicContact CG1-CB 4.34Å; V291-V335 HydrophobicContact CG1-CG2 3.95Å; V291-V335 HydrophobicContact CG2-CG1 4.23Å; V291-V335 HydrophobicContact CG2-CG2 4.22Å
292K98.4Very high98.3Very high76 Ų7639.5 Ų39.533%0.3321%0.206SC..Hα-helixtrans-90.1-5.7178.1-65.4177.9-178177.50113.4L288 K289 C290 L326L288-K292 WeakPolarHBondContact O-CB 3.29Å; L288-K292 WeakPolarHBondContact O-CG 3.29Å; L288-K292 PolarHBondContact O-N 2.94Å; K289-K292 PolarHBondContact O-N 3.22Å; C290-K292 VanDerWaalsContact C-N 3.26Å; C290-K292 PolarHBondContact O-N 3.42Å; K292-L326 VanDerWaalsContact CE-CD2 3.45Å; K292-L326 HydrophobicContact CG-CD2 4.27Å
293D98.8Very high98.4Very high36 Ų3637.1 Ų37.119%0.19320%0.195CC..SBendtrans-89.8148.6175.6177.9-111.4000113.5L256 K289 C290 N295 G296 N297L256-D293 HydrophobicContact CD2-CB 3.55Å; L256-D293 WeakPolarHBondContact CD2-OD1 3.47Å; K289-D293 WeakPolarHBondContact O-CB 3.05Å; K289-D293 PolarHBondContact O-N 3.34Å; K289-D293 VanDerWaalsContact O-N 3.15Å; C290-D293 PolarHBondContact O-N 3.05Å; C290-D293 VanDerWaalsContact O-N 3.11Å; D293-N295 VanDerWaalsContact C-N 3.3Å; D293-N295 PolarHBondContact O-N 3.18Å; D293-N295 WeakPolarHBondContact OD1-CA 3.32Å; D293-N295 WeakPolarHBondContact OD1-CB 3.36Å; D293-N295 PolarHBondContact OD1-N 3.09Å; D293-G296 PolarHBondContact OD1-N 3.03Å; D293-N297 WeakPolarHBondContact O-CB 3.46Å; D293-N297 PolarHBondContact O-N 3.35Å; D293-N297 PolarHBondContact O-ND2 3.05Å
294Q97.9Very high98.4Very high122 Ų12237 Ų3757%0.5719%0.194SC*.THydrogen-bonded Turntrans-65.8-26.2-178.969.5-171.2-41.600114.1N297 H298 Y331Q294-N297 VanDerWaalsContact C-ND2 3.33Å; Q294-N297 PolarHBondContact O-ND2 3.47Å; Q294-H298 PolarHBondContact O-CD2 3.48Å; Q294-Y331 HydrophobicContact CB-CE2 4.01Å
295N98.3Very high98.5Very high23 Ų2337 Ų3712%0.12319%0.192CC..THydrogen-bonded Turntrans-101.4-47177.8-56.6-50.3000110.4A255 L256 M258 C261 D293 N297 H298A255-N295 CarbonylContact O-C 3.55Å; A255-N295 WeakPolarHBondContact O-CB 3.49Å; L256-N295 PolarHBondContact O-ND2 2.94Å; M258-N295 WeakPolarHBondContact CA-OD1 3.45Å; C261-N295 HydrophobicContact CB-CB 3.95Å; D293-N295 VanDerWaalsContact C-N 3.3Å; D293-N295 PolarHBondContact O-N 3.18Å; D293-N295 WeakPolarHBondContact OD1-CA 3.32Å; D293-N295 WeakPolarHBondContact OD1-CB 3.36Å; D293-N295 PolarHBondContact OD1-N 3.09Å; N295-N297 VanDerWaalsContact C-N 3.29Å; N295-N297 PolarHBondContact O-N 3.12Å; N295-H298 WeakPolarHBondContact O-CB 3.42Å; N295-H298 PolarHBondContact O-N 3.38Å; N295-H298 VanDerWaalsContact O-N 3.13Å
296G98.7Very high98.5Very high0 Ų035.8 Ų35.80%017%0.172CC..Hα-helixtrans-59.9-33.2-175.200000114A255 C290 D293 H298 V299 V300A255-G296 WeakPolarHBondContact O-CA 3.49Å; A255-G296 PolarHBondContact O-N 3.26Å; C290-G296 CarbonylContact O-C 3.47Å; C290-G296 WeakPolarHBondContact O-CA 3.34Å; D293-G296 PolarHBondContact OD1-N 3.03Å; G296-H298 PolarHBondContact O-N 3.14Å; G296-V299 PolarHBondContact O-N 2.88Å; G296-V299 VanDerWaalsContact O-N 3.09Å; G296-V300 WeakPolarHBondContact O-CG2 3.41Å; G296-V300 PolarHBondContact O-N 3.11Å
297N98.7Very high98.5Very high0 Ų032.4 Ų32.40%016%0.157CC..Hα-helixtrans-61.6-31.2179.478.194.2000112.3C290 D293 Q294 N295 Q301 Y331 V335C290-N297 PolarHBondContact O-N 3.02Å; D293-N297 WeakPolarHBondContact O-CB 3.46Å; D293-N297 PolarHBondContact O-N 3.35Å; D293-N297 PolarHBondContact O-ND2 3.05Å; Q294-N297 VanDerWaalsContact C-ND2 3.33Å; Q294-N297 PolarHBondContact O-ND2 3.47Å; N295-N297 VanDerWaalsContact C-N 3.29Å; N295-N297 PolarHBondContact O-N 3.12Å; N297-Q301 WeakPolarHBondContact O-CG 3.4Å; N297-Q301 PolarHBondContact O-N 2.9Å; N297-Q301 PolarHBondContact O-NE2 3.18Å; N297-Q301 PolarHBondContact OD1-NE2 3.4Å; N297-Y331 HydrophobicContact CB-CG 4.4Å; N297-V335 HydrophobicContact CB-CG2 4.49Å
298H98.7Very high98.4Very high68 Ų6836.2 Ų36.232%0.31518%0.177SC..Hα-helixtrans-73.7-34.4177.3-69-75.6000112.1Q294 N295 G296 K302Q294-H298 PolarHBondContact O-CD2 3.48Å; N295-H298 WeakPolarHBondContact O-CB 3.42Å; N295-H298 PolarHBondContact O-N 3.38Å; N295-H298 VanDerWaalsContact O-N 3.13Å; G296-H298 PolarHBondContact O-N 3.14Å; H298-K302 WeakPolarHBondContact O-CB 3.41Å; H298-K302 PolarHBondContact O-N 3.45Å
299V98.7Very high98.4Very high0 Ų035.1 Ų35.10%017%0.174CC..Hα-helixtrans-65.9-47.1171.4175.40000110.5A255 C261 I264 Q265 L268 L283 G296 Q301 K302 C303A255-V299 HydrophobicContact CB-CB 4.14Å; A255-V299 HydrophobicContact CB-CG1 4.12Å; A255-V299 HydrophobicContact CB-CG2 3.85Å; C261-V299 HydrophobicContact CB-CG2 3.96Å; I264-V299 HydrophobicContact CB-CG1 4.49Å; I264-V299 HydrophobicContact CB-CG2 4.11Å; I264-V299 HydrophobicContact CG2-CG1 3.6Å; I264-V299 HydrophobicContact CG2-CG2 4.12Å; Q265-V299 HydrophobicContact CG-CG2 4.33Å; L268-V299 HydrophobicContact CD1-CG1 4.49Å; L283-V299 HydrophobicContact CD1-CG1 3.93Å; G296-V299 PolarHBondContact O-N 2.88Å; G296-V299 VanDerWaalsContact O-N 3.09Å; V299-Q301 PolarHBondContact O-N 3.5Å; V299-K302 CarbonylContact O-C 3.5Å; V299-K302 PolarHBondContact O-N 3.02Å; V299-C303 PolarHBondContact O-N 3.5Å; V299-C303 PolarHBondContact O-SG 2.97Å
300V98.8Very high98.3Very high4 Ų434.8 Ų34.82%0.02418%0.181CC..Hα-helixtrans-63.2-40.3179.7-177.40000111.7C290 V291 G296 K302 C303 I304 I315 V335C290-V300 HydrophobicContact CB-CG2 3.64Å; V291-V300 HydrophobicContact CG2-CB 4.23Å; V291-V300 HydrophobicContact CG2-CG1 3.88Å; V291-V300 HydrophobicContact CG2-CG2 4.1Å; G296-V300 WeakPolarHBondContact O-CG2 3.41Å; G296-V300 PolarHBondContact O-N 3.11Å; V300-K302 VanDerWaalsContact C-N 3.34Å; V300-K302 PolarHBondContact O-N 3.03Å; V300-C303 WeakPolarHBondContact O-CB 3.36Å; V300-C303 PolarHBondContact O-N 3.28Å; V300-I304 HydrophobicContact CG1-CD1 4.12Å; V300-I304 WeakPolarHBondContact O-CD1 3.44Å; V300-I304 WeakPolarHBondContact O-CG1 3.39Å; V300-I304 PolarHBondContact O-N 3.42Å; V300-I315 HydrophobicContact CG1-CD1 4.33Å; V300-I315 HydrophobicContact CG1-CG2 4.38Å; V300-V335 HydrophobicContact CG1-CG1 3.69Å
301Q98.8Very high98.2Very high14 Ų1436 Ų367%0.06519%0.192CC..Hα-helixtrans-57.5-45.9170.5-76.1165.595.600111.5N297 V299 C303 I304 E305 V335 R338N297-Q301 WeakPolarHBondContact O-CG 3.4Å; N297-Q301 PolarHBondContact O-N 2.9Å; N297-Q301 PolarHBondContact O-NE2 3.18Å; N297-Q301 PolarHBondContact OD1-NE2 3.4Å; V299-Q301 PolarHBondContact O-N 3.5Å; Q301-C303 PolarHBondContact O-N 3.06Å; Q301-I304 PolarHBondContact O-N 2.93Å; Q301-E305 WeakPolarHBondContact O-CG 3.41Å; Q301-E305 PolarHBondContact O-N 2.7Å; Q301-V335 HydrophobicContact CG-CG2 4.13Å; Q301-R338 HydrophobicContact CB-CG 3.91Å; Q301-R338 HydrophobicContact CG-CG 3.7Å
302K98.6Very high98.2Very high28 Ų2836.1 Ų36.112%0.12219%0.192CC..Hα-helixtrans-67-32.4179.7-169.459.260.4177.10113.6Q265 L268 E269 H298 V299 V300 I304 E305 C306Q265-K302 HydrophobicContact CB-CB 4.46Å; Q265-K302 HydrophobicContact CB-CG 4.17Å; Q265-K302 HydrophobicContact CG-CB 3.88Å; Q265-K302 HydrophobicContact CG-CG 4.14Å; L268-K302 HydrophobicContact CB-CG 3.98Å; L268-K302 HydrophobicContact CD1-CB 4.16Å; L268-K302 HydrophobicContact CD1-CG 4Å; E269-K302 HydrophobicContact CG-CD 3.86Å; E269-K302 VanDerWaalsContact OE1-CE 3.3Å; E269-K302 WeakPolarHBondContact OE1-CE 3.48Å; E269-K302 IonicContact OE1-NZ 3.78Å; E269-K302 PolarHBondContact OE1-NZ 3.44Å; H298-K302 WeakPolarHBondContact O-CB 3.41Å; H298-K302 PolarHBondContact O-N 3.45Å; V299-K302 CarbonylContact O-C 3.5Å; V299-K302 PolarHBondContact O-N 3.02Å; V300-K302 VanDerWaalsContact C-N 3.34Å; V300-K302 PolarHBondContact O-N 3.03Å; K302-I304 VanDerWaalsContact C-N 3.3Å; K302-I304 PolarHBondContact O-N 2.68Å; K302-E305 HydrophobicContact CD-CB 4.47Å; K302-E305 WeakPolarHBondContact CE-OE2 3.26Å; K302-E305 IonicContact NZ-OE2 3.83Å; K302-E305 PolarHBondContact NZ-OE2 2.79Å; K302-E305 PolarHBondContact O-N 2.66Å; K302-C306 WeakPolarHBondContact CD-SG 3.38Å; K302-C306 WeakPolarHBondContact O-CB 3.39Å; K302-C306 PolarHBondContact O-N 3.44Å; K302-C306 VanDerWaalsContact O-N 3.12Å
303C98.5Very high98.1Very high0 Ų036 Ų360%019%0.193CC..Hα-helixtrans-59.2-44.1169.1-60.60000110.7V280 V299 V300 Q301 V307 L312V280-C303 HydrophobicContact CG2-CB 4.15Å; V299-C303 PolarHBondContact O-N 3.5Å; V299-C303 PolarHBondContact O-SG 2.97Å; V300-C303 WeakPolarHBondContact O-CB 3.36Å; V300-C303 PolarHBondContact O-N 3.28Å; Q301-C303 PolarHBondContact O-N 3.06Å; C303-V307 WeakPolarHBondContact O-CB 3.37Å; C303-V307 WeakPolarHBondContact O-CG2 3.43Å; C303-V307 PolarHBondContact O-N 2.73Å; C303-L312 HydrophobicContact CB-CD2 4.25Å
304I98.6Very high98.1Very high3 Ų335.5 Ų35.52%0.01519%0.189CC..Hα-helixtrans-71.7-33.2-179.8-60.4155.2000112.4V300 Q301 K302 L312 I315 V335 R338 I339 H342V300-I304 HydrophobicContact CG1-CD1 4.12Å; V300-I304 WeakPolarHBondContact O-CD1 3.44Å; V300-I304 WeakPolarHBondContact O-CG1 3.39Å; V300-I304 PolarHBondContact O-N 3.42Å; Q301-I304 PolarHBondContact O-N 2.93Å; K302-I304 VanDerWaalsContact C-N 3.3Å; K302-I304 PolarHBondContact O-N 2.68Å; I304-L312 HydrophobicContact CB-CD1 4.33Å; I304-L312 HydrophobicContact CG1-CD1 4.17Å; I304-I315 HydrophobicContact CG1-CD1 4.48Å; I304-V335 HydrophobicContact CD1-CG1 3.54Å; I304-R338 HydrophobicContact CB-CB 4.02Å; I304-R338 HydrophobicContact CD1-CB 4.16Å; I304-R338 HydrophobicContact CG2-CB 3.69Å; I304-R338 VanDerWaalsContact CG2-O 3.3Å; I304-R338 WeakPolarHBondContact CG2-O 3.27Å; I304-I339 HydrophobicContact CD1-CG1 3.81Å; I304-H342 HydrophobicContact CG2-CB 3.78Å; I304-H342 WeakPolarHBondContact O-CB 3.32Å
305E98.4Very high98.1Very high70 Ų7030 Ų3033%0.32716%0.163SC..Hα-helixtrans-73.5-28177.9-72.1165.9-151.700114.3Q301 K302Q301-E305 WeakPolarHBondContact O-CG 3.41Å; Q301-E305 PolarHBondContact O-N 2.7Å; K302-E305 HydrophobicContact CD-CB 4.47Å; K302-E305 WeakPolarHBondContact CE-OE2 3.26Å; K302-E305 IonicContact NZ-OE2 3.83Å; K302-E305 PolarHBondContact NZ-OE2 2.79Å; K302-E305 PolarHBondContact O-N 2.66Å
306C97.6Very high98.1Very high44 Ų4429.2 Ų29.230%0.29716%0.159SC..Hα-helixtrans-123.6-8-164.5-66.60000116.2Q276 K302Q276-C306 PolarHBondContact NE2-O 3.31Å; Q276-C306 PolarHBondContact OE1-O 3.46Å; K302-C306 WeakPolarHBondContact CD-SG 3.38Å; K302-C306 WeakPolarHBondContact O-CB 3.39Å; K302-C306 PolarHBondContact O-N 3.44Å; K302-C306 VanDerWaalsContact O-N 3.12Å
307V97.8Very high98.1Very high10 Ų1034.1 Ų34.16%0.06119%0.185CC..SBendtrans-118.8149.5-170.2-171.10000110.2L268 Q276 Q277 V280 C303 P309 A311 L312L268-V307 HydrophobicContact CD2-CG2 4.23Å; Q276-V307 HydrophobicContact CB-CG1 4.32Å; Q276-V307 HydrophobicContact CB-CG2 4.02Å; Q276-V307 HydrophobicContact CG-CG2 4.38Å; Q277-V307 HydrophobicContact CG-CG1 4.48Å; V280-V307 HydrophobicContact CG2-CG1 4.26Å; V280-V307 HydrophobicContact CG2-CG2 3.9Å; C303-V307 WeakPolarHBondContact O-CB 3.37Å; C303-V307 WeakPolarHBondContact O-CG2 3.43Å; C303-V307 PolarHBondContact O-N 2.73Å; V307-P309 WeakPolarHBondContact O-CD 3.37Å; V307-A311 HydrophobicContact CG1-CB 4.26Å; V307-L312 HydrophobicContact CB-CD2 4.19Å; V307-L312 HydrophobicContact CG1-CD2 4.33Å
308D97.6Very high98.1Very high85 Ų8535.6 Ų35.646%0.45520%0.198SC..  trans-53.7123.1176.1-170.3-42.7000111.1V310 A311D308-V310 PolarHBondContact O-N 3.47Å; D308-V310 WeakPolarHBondContact OD1-CB 3.21Å; D308-V310 WeakPolarHBondContact OD1-CG2 3.08Å; D308-V310 PolarHBondContact OD1-N 3.12Å; D308-A311 WeakPolarHBondContact O-CB 3.32Å; D308-A311 PolarHBondContact O-N 2.92Å
309P97.5Very high98Very high33 Ų3332.4 Ų32.421%0.21418%0.183CC..G310 helixtrans-51.8-29.4178.5-30.337.4000115V307 A311 L312 H342 T344 Q347V307-P309 WeakPolarHBondContact O-CD 3.37Å; P309-A311 VanDerWaalsContact C-N 3.26Å; P309-A311 PolarHBondContact O-N 2.82Å; P309-L312 WeakPolarHBondContact O-CB 3.19Å; P309-L312 PolarHBondContact O-N 3.47Å; P309-H342 WeakPolarHBondContact CG-O 3.15Å; P309-T344 HydrophobicContact CB-CG2 3.84Å; P309-Q347 PolarHBondContact O-NE2 3.45Å
310V96.5Very high97.9Very high113 Ų11340.5 Ų40.569%0.68522%0.218SC*.G310 helixtrans-59.2-37.9176.41780000111.4D308 L312D308-V310 PolarHBondContact O-N 3.47Å; D308-V310 WeakPolarHBondContact OD1-CB 3.21Å; D308-V310 WeakPolarHBondContact OD1-CG2 3.08Å; D308-V310 PolarHBondContact OD1-N 3.12Å; V310-L312 VanDerWaalsContact C-N 3.27Å; V310-L312 PolarHBondContact O-N 2.67Å
311A97.1Very high97.8Very high28 Ų2842.8 Ų42.823%0.23124%0.242CC..G310 helixtrans-74.6-15177.500000113.4Q277 V307 D308 P309 F314Q277-A311 HydrophobicContact CG-CB 3.82Å; V307-A311 HydrophobicContact CG1-CB 4.26Å; D308-A311 WeakPolarHBondContact O-CB 3.32Å; D308-A311 PolarHBondContact O-N 2.92Å; P309-A311 VanDerWaalsContact C-N 3.26Å; P309-A311 PolarHBondContact O-N 2.82Å; A311-F314 WeakPolarHBondContact O-CD1 3.36Å; A311-F314 VanDerWaalsContact O-CE1 3.32Å; A311-F314 WeakPolarHBondContact O-CE1 2.82Å
312L97.8Very high97.8Very high1 Ų145 Ų451%0.00525%0.253CS..G310 helixtrans-90.62.2-175.7-55.7-179.6000113.8V280 C303 I304 V307 P309 V310 F314 I315 I316V280-L312 HydrophobicContact CG1-CD2 4Å; C303-L312 HydrophobicContact CB-CD2 4.25Å; I304-L312 HydrophobicContact CB-CD1 4.33Å; I304-L312 HydrophobicContact CG1-CD1 4.17Å; V307-L312 HydrophobicContact CB-CD2 4.19Å; V307-L312 HydrophobicContact CG1-CD2 4.33Å; P309-L312 WeakPolarHBondContact O-CB 3.19Å; P309-L312 PolarHBondContact O-N 3.47Å; V310-L312 VanDerWaalsContact C-N 3.27Å; V310-L312 PolarHBondContact O-N 2.67Å; L312-F314 PolarHBondContact O-N 2.75Å; L312-F314 VanDerWaalsContact O-N 3.11Å; L312-I315 HydrophobicContact CB-CD1 4.33Å; L312-I315 HydrophobicContact CD2-CD1 3.87Å; L312-I315 WeakPolarHBondContact O-CA 3.47Å; L312-I315 VanDerWaalsContact O-CB 3.27Å; L312-I315 WeakPolarHBondContact O-CB 3.48Å; L312-I315 PolarHBondContact O-N 3.37Å; L312-I316 PolarHBondContact O-N 2.86Å
313Q98Very high97.8Very high75 Ų7543.7 Ų43.735%0.3525%0.247SC..Hα-helixtrans-56.8-33-173.3-17257.44500113.9I315 I316 N317Q313-I315 VanDerWaalsContact C-N 3.27Å; Q313-I315 PolarHBondContact O-N 3.02Å; Q313-I316 PolarHBondContact O-N 3.08Å; Q313-N317 PolarHBondContact NE2-OD1 3.38Å; Q313-N317 WeakPolarHBondContact O-CB 3.48Å; Q313-N317 PolarHBondContact O-N 3.44Å; Q313-N317 PolarHBondContact O-ND2 2.94Å; Q313-N317 PolarHBondContact O-OD1 3.27Å
314F98.1Very high97.8Very high24 Ų2447.8 Ų47.811%0.10526%0.263CS..Hα-helixtrans-64.9-29.5176.174.3-79.7000112.9V280 L283 D284 V287 A311 L312 A318V280-F314 HydrophobicContact CG1-CE1 3.56Å; V280-F314 HydrophobicContact CG1-CZ 3.62Å; V280-F314 WeakPolarHBondContact O-CZ 3.39Å; L283-F314 HydrophobicContact CB-CE2 4.44Å; D284-F314 HydrophobicContact CB-CD2 3.69Å; D284-F314 HydrophobicContact CB-CE2 3.95Å; D284-F314 HydrophobicContact CB-CG 4.25Å; D284-F314 VanDerWaalsContact CG-CD2 3.49Å; D284-F314 WeakPolarHBondContact OD1-CD2 3.46Å; V287-F314 HydrophobicContact CG2-CD2 3.59Å; V287-F314 HydrophobicContact CG2-CE2 3.49Å; V287-F314 VanDerWaalsContact CG2-CE2 3.49Å; A311-F314 WeakPolarHBondContact O-CD1 3.36Å; A311-F314 VanDerWaalsContact O-CE1 3.32Å; A311-F314 WeakPolarHBondContact O-CE1 2.82Å; L312-F314 PolarHBondContact O-N 2.75Å; L312-F314 VanDerWaalsContact O-N 3.11Å; F314-A318 WeakPolarHBondContact O-CB 3.23Å; F314-A318 PolarHBondContact O-N 2.76Å
315I98Very high97.8Very high6 Ų650 Ų503%0.03128%0.279CS..Hα-helixtrans-65.9-48.5173-54.4-178000109.5V287 V300 I304 L312 Q313 N317 A318 F319V287-I315 HydrophobicContact CG1-CB 4.39Å; V287-I315 HydrophobicContact CG1-CG2 3.87Å; V287-I315 HydrophobicContact CG2-CG1 4.2Å; V300-I315 HydrophobicContact CG1-CD1 4.33Å; V300-I315 HydrophobicContact CG1-CG2 4.38Å; I304-I315 HydrophobicContact CG1-CD1 4.48Å; L312-I315 HydrophobicContact CB-CD1 4.33Å; L312-I315 HydrophobicContact CD2-CD1 3.87Å; L312-I315 WeakPolarHBondContact O-CA 3.47Å; L312-I315 VanDerWaalsContact O-CB 3.27Å; L312-I315 WeakPolarHBondContact O-CB 3.48Å; L312-I315 PolarHBondContact O-N 3.37Å; Q313-I315 VanDerWaalsContact C-N 3.27Å; Q313-I315 PolarHBondContact O-N 3.02Å; I315-N317 VanDerWaalsContact C-N 3.33Å; I315-N317 PolarHBondContact O-N 2.94Å; I315-A318 PolarHBondContact O-N 2.89Å; I315-F319 HydrophobicContact CG2-CD2 4.16Å; I315-F319 HydrophobicContact CG2-CE2 3.84Å; I315-F319 WeakPolarHBondContact O-CD2 3.3Å; I315-F319 PolarHBondContact O-N 2.76Å; I315-F319 VanDerWaalsContact O-N 3.16Å
316I97.9Very high97.8Very high7 Ų746.7 Ų46.74%0.03626%0.264CS..Hα-helixtrans-60.2-44.6177.4-50.2-58.7000110.5L312 Q313 A318 F319 K320 I339 C343 Q347 I351L312-I316 PolarHBondContact O-N 2.86Å; Q313-I316 PolarHBondContact O-N 3.08Å; I316-A318 VanDerWaalsContact C-N 3.3Å; I316-A318 PolarHBondContact O-N 3.45Å; I316-F319 PolarHBondContact O-N 3.48Å; I316-F319 VanDerWaalsContact O-N 3.1Å; I316-K320 PolarHBondContact O-N 2.77Å; I316-I339 HydrophobicContact CD1-CD1 4.15Å; I316-I339 HydrophobicContact CD1-CG1 4.19Å; I316-I339 HydrophobicContact CD1-CG2 3.66Å; I316-C343 HydrophobicContact CD1-CB 4.46Å; I316-Q347 HydrophobicContact CD1-CB 4.24Å; I316-Q347 HydrophobicContact CG1-CB 4.04Å; I316-Q347 HydrophobicContact CG1-CG 4.12Å; I316-I351 HydrophobicContact CG2-CD1 4.44Å
317N98.2Very high97.9Very high103 Ų10344.6 Ų44.655%0.55125%0.249SC*.Hα-helixtrans-60.2-38.7177-64.8-11.2000112.2Q313 I315 F319Q313-N317 PolarHBondContact NE2-OD1 3.38Å; Q313-N317 WeakPolarHBondContact O-CB 3.48Å; Q313-N317 PolarHBondContact O-N 3.44Å; Q313-N317 PolarHBondContact O-ND2 2.94Å; Q313-N317 PolarHBondContact O-OD1 3.27Å; I315-N317 VanDerWaalsContact C-N 3.33Å; I315-N317 PolarHBondContact O-N 2.94Å; N317-F319 VanDerWaalsContact C-N 3.29Å; N317-F319 PolarHBondContact O-N 3.37Å
318A98.1Very high97.9Very high32 Ų3245.7 Ų45.726%0.26426%0.256SS..Hα-helixtrans-74.6-14.2177.500000114.1V287 L288 F314 I315 I316V287-A318 HydrophobicContact CB-CB 3.85Å; V287-A318 HydrophobicContact CG1-CB 4.01Å; V287-A318 HydrophobicContact CG2-CB 4.19Å; L288-A318 WeakPolarHBondContact CD2-O 3.44Å; F314-A318 WeakPolarHBondContact O-CB 3.23Å; F314-A318 PolarHBondContact O-N 2.76Å; I315-A318 PolarHBondContact O-N 2.89Å; I316-A318 VanDerWaalsContact C-N 3.3Å; I316-A318 PolarHBondContact O-N 3.45Å
319F97.9Very high98Very high0 Ų043.9 Ų43.90%025%0.245CC..Hα-helixtrans-88.6-19.1177.6-88.5-129.6000113.3V287 V291 I315 I316 N317 G321 Q322 V323 L326 V335 I336 I339 I351V287-F319 HydrophobicContact CG1-CD2 4.23Å; V287-F319 HydrophobicContact CG1-CE2 3.82Å; V291-F319 HydrophobicContact CG1-CZ 4.1Å; V291-F319 HydrophobicContact CG2-CE2 3.86Å; V291-F319 HydrophobicContact CG2-CZ 3.88Å; I315-F319 HydrophobicContact CG2-CD2 4.16Å; I315-F319 HydrophobicContact CG2-CE2 3.84Å; I315-F319 WeakPolarHBondContact O-CD2 3.3Å; I315-F319 PolarHBondContact O-N 2.76Å; I315-F319 VanDerWaalsContact O-N 3.16Å; I316-F319 PolarHBondContact O-N 3.48Å; I316-F319 VanDerWaalsContact O-N 3.1Å; N317-F319 VanDerWaalsContact C-N 3.29Å; N317-F319 PolarHBondContact O-N 3.37Å; F319-G321 PolarHBondContact O-N 3.09Å; F319-Q322 CarbonylContact O-C 3.08Å; F319-Q322 WeakPolarHBondContact O-CA 3.34Å; F319-Q322 WeakPolarHBondContact O-CB 3.44Å; F319-Q322 PolarHBondContact O-N 3.31Å; F319-V323 WeakPolarHBondContact O-CG2 3.46Å; F319-V323 PolarHBondContact O-N 3.31Å; F319-L326 HydrophobicContact CD1-CD1 3.54Å; F319-L326 HydrophobicContact CD2-CD1 3.96Å; F319-L326 HydrophobicContact CE1-CD1 3.56Å; F319-L326 HydrophobicContact CE2-CD1 4Å; F319-L326 HydrophobicContact CG-CD1 3.74Å; F319-L326 HydrophobicContact CZ-CD1 3.8Å; F319-V335 HydrophobicContact CE1-CB 4.43Å; F319-V335 HydrophobicContact CE1-CG1 4.22Å; F319-V335 HydrophobicContact CE2-CG1 4.49Å; F319-V335 HydrophobicContact CZ-CB 4.03Å; F319-V335 HydrophobicContact CZ-CG1 3.57Å; F319-I336 HydrophobicContact CD1-CD1 3.49Å; F319-I336 VanDerWaalsContact CD1-CD1 3.49Å; F319-I336 HydrophobicContact CD1-CG1 4.49Å; F319-I336 HydrophobicContact CE1-CD1 3.54Å; F319-I336 HydrophobicContact CE1-CG1 4.08Å; F319-I339 HydrophobicContact CD1-CD1 3.64Å; F319-I339 HydrophobicContact CE1-CD1 3.48Å; F319-I339 VanDerWaalsContact CE1-CD1 3.48Å; F319-I339 HydrophobicContact CE2-CD1 4.42Å; F319-I339 HydrophobicContact CG-CD1 4.22Å; F319-I339 HydrophobicContact CZ-CD1 3.91Å; F319-I351 HydrophobicContact CB-CD1 3.82Å
320K95.7Very high98Very high170 Ų17044.3 Ų44.374%0.73925%0.248SC*.THydrogen-bonded Turntrans-61.9127.9-179.8-174.5172-177170.10111.7I316 Q322I316-K320 PolarHBondContact O-N 2.77Å; K320-Q322 PolarHBondContact O-N 2.86Å
321G97.4Very high98.1Very high52 Ų5242.6 Ų42.654%0.53623%0.23SC..THydrogen-bonded Turntrans70.517.2-172.900000113.7F319 E354F319-G321 PolarHBondContact O-N 3.09Å; G321-E354 VanDerWaalsContact C-OE1 3.27Å; G321-E354 VanDerWaalsContact CA-OE1 3.31Å; G321-E354 WeakPolarHBondContact CA-OE1 3.17Å; G321-E354 WeakPolarHBondContact CA-OE2 3.5Å; G321-E354 PolarHBondContact N-OE1 3.13Å; G321-E354 PolarHBondContact N-OE2 3.35Å
322Q98.4Very high98.2Very high62 Ų6241.3 Ų41.329%0.2922%0.219SC..THydrogen-bonded Turntrans-132.2-5.1177.6-64.9-68.8-77.300113.1L288 F319 K320 Y324 S325 L326 E354L288-Q322 HydrophobicContact CD1-CG 4.07Å; L288-Q322 HydrophobicContact CD2-CB 4.4Å; L288-Q322 HydrophobicContact CD2-CG 4.26Å; F319-Q322 CarbonylContact O-C 3.08Å; F319-Q322 WeakPolarHBondContact O-CA 3.34Å; F319-Q322 WeakPolarHBondContact O-CB 3.44Å; F319-Q322 PolarHBondContact O-N 3.31Å; K320-Q322 PolarHBondContact O-N 2.86Å; Q322-Y324 VanDerWaalsContact C-N 3.34Å; Q322-Y324 PolarHBondContact O-N 3.36Å; Q322-S325 CarbonylContact O-C 3.59Å; Q322-S325 PolarHBondContact O-N 3.49Å; Q322-L326 HydrophobicContact CB-CD1 3.92Å; Q322-L326 HydrophobicContact CB-CG 4.23Å; Q322-L326 WeakPolarHBondContact O-CB 2.98Å; Q322-L326 VanDerWaalsContact O-CG 3.31Å; Q322-L326 WeakPolarHBondContact O-CG 3.44Å; Q322-L326 PolarHBondContact O-N 3.05Å; Q322-E354 PolarHBondContact N-OE1 2.83Å
323V98.6Very high98.2Very high0 Ų041.6 Ų41.60%022%0.221CC..Hα-helixtrans-58.7-42.6-171175.70000111.6F319 L326 S327 I336 I351 E354 L355F319-V323 WeakPolarHBondContact O-CG2 3.46Å; F319-V323 PolarHBondContact O-N 3.31Å; V323-L326 PolarHBondContact O-N 3.2Å; V323-S327 VanDerWaalsContact O-CB 3.25Å; V323-S327 WeakPolarHBondContact O-CB 3.11Å; V323-S327 PolarHBondContact O-N 2.83Å; V323-S327 PolarHBondContact O-OG 2.85Å; V323-I336 HydrophobicContact CG1-CD1 4.11Å; V323-I351 HydrophobicContact CG1-CG2 4.05Å; V323-I351 HydrophobicContact CG2-CD1 3.76Å; V323-I351 HydrophobicContact CG2-CG2 4.23Å; V323-E354 HydrophobicContact CB-CB 3.92Å; V323-E354 VanDerWaalsContact CB-CD 3.48Å; V323-E354 HydrophobicContact CB-CG 3.83Å; V323-E354 VanDerWaalsContact CB-OE1 3.31Å; V323-E354 WeakPolarHBondContact CB-OE1 3.12Å; V323-E354 HydrophobicContact CG1-CB 4.34Å; V323-E354 HydrophobicContact CG2-CB 3.98Å; V323-E354 HydrophobicContact CG2-CG 4.16Å; V323-E354 PolarHBondContact N-OE1 2.93Å; V323-L355 HydrophobicContact CG1-CD2 3.69Å; V323-L355 HydrophobicContact CG1-CG 3.68Å
324Y98.7Very high98.3Very high85 Ų8542 Ų4233%0.33322%0.219SC..Hα-helixtrans-63-46.5173.7178.2-111000113Q322 L326 S327 T328 H358 Q361 L362Q322-Y324 VanDerWaalsContact C-N 3.34Å; Q322-Y324 PolarHBondContact O-N 3.36Å; Y324-L326 PolarHBondContact O-N 2.76Å; Y324-S327 PolarHBondContact O-N 2.82Å; Y324-T328 HydrophobicContact CD2-CG2 4.15Å; Y324-T328 HydrophobicContact CE2-CG2 3.71Å; Y324-T328 WeakPolarHBondContact O-CG2 3.17Å; Y324-T328 PolarHBondContact O-N 3.25Å; Y324-T328 PolarHBondContact O-OG1 2.99Å; Y324-H358 VanDerWaalsContact CB-CD2 3.48Å; Y324-H358 WeakPolarHBondContact CB-CD2 3.4Å; Y324-H358 HydrophobicContact CD2-CB 3.58Å; Y324-H358 AromaticContact CD2-CG 3.87Å; Y324-H358 HydrophobicContact CE2-CB 4.24Å; Y324-H358 HydrophobicContact CG-CB 4.19Å; Y324-H358 AromaticContact CG-CD2 3.99Å; Y324-H358 AromaticContact CG-CG 3.98Å; Y324-Q361 HydrophobicContact CE2-CB 3.69Å; Y324-Q361 HydrophobicContact CE2-CG 4.47Å; Y324-L362 HydrophobicContact CD2-CD1 4.45Å; Y324-L362 HydrophobicContact CD2-CD2 3.74Å; Y324-L362 HydrophobicContact CD2-CG 3.92Å; Y324-L362 HydrophobicContact CE2-CD2 3.95Å; Y324-L362 HydrophobicContact CE2-CG 4.13Å
325S98.7Very high98.3Very high50 Ų5040.9 Ų40.935%0.3521%0.214SC..Hα-helixtrans-64.1-26.5178.3175.40000112.7Q322 H329Q322-S325 CarbonylContact O-C 3.59Å; Q322-S325 PolarHBondContact O-N 3.49Å; S325-H329 WeakPolarHBondContact O-CB 3.12Å
326L98.8Very high98.3Very high0 Ų040.6 Ų40.60%021%0.213CC..Hα-helixtrans-88.6-41.3179.6-67.2175.2000111.4L288 V291 K292 F319 Q322 V323 Y324 T328 H329 G332 C333 I336L288-L326 HydrophobicContact CD2-CD1 3.88Å; L288-L326 HydrophobicContact CD2-CD2 4.39Å; V291-L326 HydrophobicContact CG1-CD2 3.7Å; K292-L326 VanDerWaalsContact CE-CD2 3.45Å; K292-L326 HydrophobicContact CG-CD2 4.27Å; F319-L326 HydrophobicContact CD1-CD1 3.54Å; F319-L326 HydrophobicContact CD2-CD1 3.96Å; F319-L326 HydrophobicContact CE1-CD1 3.56Å; F319-L326 HydrophobicContact CE2-CD1 4Å; F319-L326 HydrophobicContact CG-CD1 3.74Å; F319-L326 HydrophobicContact CZ-CD1 3.8Å; Q322-L326 HydrophobicContact CB-CD1 3.92Å; Q322-L326 HydrophobicContact CB-CG 4.23Å; Q322-L326 WeakPolarHBondContact O-CB 2.98Å; Q322-L326 VanDerWaalsContact O-CG 3.31Å; Q322-L326 WeakPolarHBondContact O-CG 3.44Å; Q322-L326 PolarHBondContact O-N 3.05Å; V323-L326 PolarHBondContact O-N 3.2Å; Y324-L326 PolarHBondContact O-N 2.76Å; L326-T328 PolarHBondContact O-N 3.12Å; L326-H329 VanDerWaalsContact O-CB 3.31Å; L326-H329 WeakPolarHBondContact O-CB 3.4Å; L326-H329 PolarHBondContact O-N 3.33Å; L326-G332 CarbonylContact O-C 3.52Å; L326-G332 VanDerWaalsContact O-CA 3.25Å; L326-G332 WeakPolarHBondContact O-CA 3.46Å; L326-C333 PolarHBondContact O-N 3.45Å; L326-I336 HydrophobicContact CB-CD1 4.39Å; L326-I336 HydrophobicContact CB-CG1 4.28Å
327S98.8Very high98.4Very high0 Ų041.9 Ų41.90%022%0.219CC..Hα-helixtrans-61.8-29.5173.7-660000113V323 Y324 C333 L355 Y367 G368V323-S327 VanDerWaalsContact O-CB 3.25Å; V323-S327 WeakPolarHBondContact O-CB 3.11Å; V323-S327 PolarHBondContact O-N 2.83Å; V323-S327 PolarHBondContact O-OG 2.85Å; Y324-S327 PolarHBondContact O-N 2.82Å; S327-C333 WeakPolarHBondContact O-CB 3.33Å; S327-L355 WeakPolarHBondContact OG-CD2 3.05Å; S327-Y367 CarbonylContact O-C 3.55Å; S327-G368 WeakPolarHBondContact O-CA 3.26Å; S327-G368 PolarHBondContact O-N 3.04Å; S327-G368 VanDerWaalsContact O-N 3.15Å
328T98.8Very high98.4Very high34 Ų3439.1 Ų39.121%0.20920%0.2CC..THydrogen-bonded Turntrans-90.17.4172.657.10000114Y324 L326 L362 D365 Y367Y324-T328 HydrophobicContact CD2-CG2 4.15Å; Y324-T328 HydrophobicContact CE2-CG2 3.71Å; Y324-T328 WeakPolarHBondContact O-CG2 3.17Å; Y324-T328 PolarHBondContact O-N 3.25Å; Y324-T328 PolarHBondContact O-OG1 2.99Å; L326-T328 PolarHBondContact O-N 3.12Å; T328-L362 HydrophobicContact CG2-CD2 3.81Å; T328-D365 WeakPolarHBondContact CA-OD1 3.31Å; T328-D365 HydrophobicContact CG2-CB 3.97Å; T328-Y367 WeakPolarHBondContact O-CD2 3.49Å
329H98.8Very high98.4Very high46 Ų4637.6 Ų37.621%0.21319%0.188CC..SBendtrans-100136.2178.1-166.2-106.1000111.5S325 L326 Y331 G332 C333S325-H329 WeakPolarHBondContact O-CB 3.12Å; L326-H329 VanDerWaalsContact O-CB 3.31Å; L326-H329 WeakPolarHBondContact O-CB 3.4Å; L326-H329 PolarHBondContact O-N 3.33Å; H329-Y331 AromaticContact CE1-CD2 3.67Å; H329-Y331 PolarHBondContact ND1-N 2.8Å; H329-Y331 PolarHBondContact O-N 3.09Å; H329-G332 PolarHBondContact ND1-N 2.99Å; H329-G332 PolarHBondContact O-N 3.18Å; H329-G332 VanDerWaalsContact O-N 3.11Å; H329-C333 PolarHBondContact O-N 2.95Å; H329-C333 VanDerWaalsContact O-N 3.1Å; H329-C333 PolarHBondContact O-SG 3.37Å
330P98.2Very high98.5Very high43 Ų4339.1 Ų39.128%0.27920%0.196SC..THydrogen-bonded Turntrans-54.7-27.1-178.418-32.8000115.2Y367P330-Y367 HydrophobicContact CB-CD1 4.46Å; P330-Y367 HydrophobicContact CB-CD2 4.48Å; P330-Y367 HydrophobicContact CB-CE1 3.9Å; P330-Y367 HydrophobicContact CB-CE2 3.91Å; P330-Y367 HydrophobicContact CG-CE2 4.25Å
331Y98.6Very high98.6Very high77 Ų7735 Ų3530%0.30218%0.179SC..THydrogen-bonded Turntrans-104.8-32.7176.4-48-34.1000112.4V291 Q294 N297 H329 C333 R334V291-Y331 WeakPolarHBondContact O-CB 3.04Å; Q294-Y331 HydrophobicContact CB-CE2 4.01Å; N297-Y331 HydrophobicContact CB-CG 4.4Å; H329-Y331 AromaticContact CE1-CD2 3.67Å; H329-Y331 PolarHBondContact ND1-N 2.8Å; H329-Y331 PolarHBondContact O-N 3.09Å; Y331-C333 PolarHBondContact O-N 3.02Å; Y331-R334 WeakPolarHBondContact O-CB 3.31Å; Y331-R334 PolarHBondContact O-N 3.22Å
332G98.7Very high98.6Very high0 Ų036.3 Ų36.30%017%0.171CC..Hα-helixtrans-68.5-36.2-174.600000112.4L326 H329 R334 V335 I336L326-G332 CarbonylContact O-C 3.52Å; L326-G332 VanDerWaalsContact O-CA 3.25Å; L326-G332 WeakPolarHBondContact O-CA 3.46Å; H329-G332 PolarHBondContact ND1-N 2.99Å; H329-G332 PolarHBondContact O-N 3.18Å; H329-G332 VanDerWaalsContact O-N 3.11Å; G332-R334 PolarHBondContact O-N 3.13Å; G332-R334 VanDerWaalsContact O-N 3.15Å; G332-V335 PolarHBondContact O-N 3.25Å; G332-I336 WeakPolarHBondContact O-CG1 3.39Å; G332-I336 PolarHBondContact O-N 2.84Å
333C98.6Very high98.6Very high7 Ų734.1 Ų34.15%0.04716%0.163CC..Hα-helixtrans-59.5-29.2178.268.90000112.5L326 S327 H329 Y331 Q337 V371L326-C333 PolarHBondContact O-N 3.45Å; S327-C333 WeakPolarHBondContact O-CB 3.33Å; H329-C333 PolarHBondContact O-N 2.95Å; H329-C333 VanDerWaalsContact O-N 3.1Å; H329-C333 PolarHBondContact O-SG 3.37Å; Y331-C333 PolarHBondContact O-N 3.02Å; C333-Q337 WeakPolarHBondContact O-CG 3.39Å; C333-Q337 PolarHBondContact O-N 2.8Å; C333-Q337 PolarHBondContact O-NE2 3.3Å; C333-V371 HydrophobicContact CB-CG2 3.91Å
334R98.6Very high98.6Very high85 Ų8536.4 Ų36.432%0.32118%0.176SC..Hα-helixtrans-75.3-38.2177-57-178.8169.9-166.5-9.1112Y331 G332 Q337 R338Y331-R334 WeakPolarHBondContact O-CB 3.31Å; Y331-R334 PolarHBondContact O-N 3.22Å; G332-R334 PolarHBondContact O-N 3.13Å; G332-R334 VanDerWaalsContact O-N 3.15Å; R334-Q337 PolarHBondContact O-N 3.39Å; R334-R338 PolarHBondContact O-N 2.65Å
335V98.8Very high98.5Very high0 Ų035.2 Ų35.20%018%0.184CC..Hα-helixtrans-68.9-40.4175.9-167.50000110.5V291 N297 V300 Q301 I304 F319 G332 Q337 R338 I339V291-V335 HydrophobicContact CG1-CB 4.34Å; V291-V335 HydrophobicContact CG1-CG2 3.95Å; V291-V335 HydrophobicContact CG2-CG1 4.23Å; V291-V335 HydrophobicContact CG2-CG2 4.22Å; N297-V335 HydrophobicContact CB-CG2 4.49Å; V300-V335 HydrophobicContact CG1-CG1 3.69Å; Q301-V335 HydrophobicContact CG-CG2 4.13Å; I304-V335 HydrophobicContact CD1-CG1 3.54Å; F319-V335 HydrophobicContact CE1-CB 4.43Å; F319-V335 HydrophobicContact CE1-CG1 4.22Å; F319-V335 HydrophobicContact CE2-CG1 4.49Å; F319-V335 HydrophobicContact CZ-CB 4.03Å; F319-V335 HydrophobicContact CZ-CG1 3.57Å; G332-V335 PolarHBondContact O-N 3.25Å; V335-Q337 VanDerWaalsContact C-N 3.32Å; V335-Q337 PolarHBondContact O-N 2.88Å; V335-R338 PolarHBondContact O-N 3.06Å; V335-I339 HydrophobicContact CG1-CD1 4.44Å; V335-I339 WeakPolarHBondContact O-CG1 3.45Å; V335-I339 PolarHBondContact O-N 3.04Å
336I98.8Very high98.5Very high0 Ų039.6 Ų39.60%020%0.199CC..Hα-helixtrans-55.6-46.7170.8-65-73.3000111F319 V323 L326 G332 I339 L340 I351 L355 V371F319-I336 HydrophobicContact CD1-CD1 3.49Å; F319-I336 VanDerWaalsContact CD1-CD1 3.49Å; F319-I336 HydrophobicContact CD1-CG1 4.49Å; F319-I336 HydrophobicContact CE1-CD1 3.54Å; F319-I336 HydrophobicContact CE1-CG1 4.08Å; V323-I336 HydrophobicContact CG1-CD1 4.11Å; L326-I336 HydrophobicContact CB-CD1 4.39Å; L326-I336 HydrophobicContact CB-CG1 4.28Å; G332-I336 WeakPolarHBondContact O-CG1 3.39Å; G332-I336 PolarHBondContact O-N 2.84Å; I336-I339 PolarHBondContact O-N 3.15Å; I336-L340 HydrophobicContact CG2-CD1 4.01Å; I336-L340 HydrophobicContact CG2-CG 4.48Å; I336-L340 WeakPolarHBondContact O-CG 3.48Å; I336-L340 PolarHBondContact O-N 3.17Å; I336-I351 HydrophobicContact CD1-CG2 4.13Å; I336-L355 HydrophobicContact CG2-CD1 4.45Å; I336-V371 HydrophobicContact CB-CG2 4.48Å; I336-V371 HydrophobicContact CG2-CG1 3.57Å; I336-V371 HydrophobicContact CG2-CG2 4.2Å
337Q98.8Very high98.5Very high34 Ų3439.9 Ų39.916%0.15920%0.201CC..Hα-helixtrans-60.8-44.6176.6-7716383.600112.4C333 R334 V335 I339 L340 E341 H374C333-Q337 WeakPolarHBondContact O-CG 3.39Å; C333-Q337 PolarHBondContact O-N 2.8Å; C333-Q337 PolarHBondContact O-NE2 3.3Å; R334-Q337 PolarHBondContact O-N 3.39Å; V335-Q337 VanDerWaalsContact C-N 3.32Å; V335-Q337 PolarHBondContact O-N 2.88Å; Q337-I339 VanDerWaalsContact C-N 3.33Å; Q337-I339 PolarHBondContact O-N 2.56Å; Q337-L340 PolarHBondContact O-N 3.22Å; Q337-E341 VanDerWaalsContact O-CG 3.26Å; Q337-E341 WeakPolarHBondContact O-CG 3.35Å; Q337-E341 PolarHBondContact O-N 3.24Å; Q337-H374 HydrophobicContact CG-CB 3.99Å
338R98.8Very high98.5Very high44 Ų4440.7 Ų40.717%0.16621%0.206CC..Hα-helixtrans-60.3-40.1174.4-66-57.684.370.72.5112.5Q301 I304 R334 V335 L340 E341 H342Q301-R338 HydrophobicContact CB-CG 3.91Å; Q301-R338 HydrophobicContact CG-CG 3.7Å; I304-R338 HydrophobicContact CB-CB 4.02Å; I304-R338 HydrophobicContact CD1-CB 4.16Å; I304-R338 HydrophobicContact CG2-CB 3.69Å; I304-R338 VanDerWaalsContact CG2-O 3.3Å; I304-R338 WeakPolarHBondContact CG2-O 3.27Å; R334-R338 PolarHBondContact O-N 2.65Å; V335-R338 PolarHBondContact O-N 3.06Å; R338-L340 VanDerWaalsContact C-N 3.35Å; R338-L340 PolarHBondContact O-N 3.09Å; R338-E341 IonicContact CZ-OE1 2.71Å; R338-E341 IonicContact CZ-OE2 2.85Å; R338-E341 IonicContact NE-OE1 2.73Å; R338-E341 IonicContact NE-OE2 3.3Å; R338-E341 PolarHBondContact NE-OE2 2.99Å; R338-E341 IonicContact NH2-OE1 3.73Å; R338-E341 PolarHBondContact NH2-OE1 2.85Å; R338-E341 IonicContact NH2-OE2 2.68Å; R338-E341 PolarHBondContact NH2-OE2 3.41Å; R338-E341 PolarHBondContact O-N 2.93Å; R338-H342 PolarHBondContact O-CD2 2.69Å; R338-H342 PolarHBondContact O-N 3.12Å
339I98.7Very high98.5Very high0 Ų041.5 Ų41.50%021%0.211CC..Hα-helixtrans-59.8-46.7176.1-68.6168.1000110.4I304 I316 F319 V335 I336 Q337 E341 C343 T348 I351I304-I339 HydrophobicContact CD1-CG1 3.81Å; I316-I339 HydrophobicContact CD1-CD1 4.15Å; I316-I339 HydrophobicContact CD1-CG1 4.19Å; I316-I339 HydrophobicContact CD1-CG2 3.66Å; F319-I339 HydrophobicContact CD1-CD1 3.64Å; F319-I339 HydrophobicContact CE1-CD1 3.48Å; F319-I339 VanDerWaalsContact CE1-CD1 3.48Å; F319-I339 HydrophobicContact CE2-CD1 4.42Å; F319-I339 HydrophobicContact CG-CD1 4.22Å; F319-I339 HydrophobicContact CZ-CD1 3.91Å; V335-I339 HydrophobicContact CG1-CD1 4.44Å; V335-I339 WeakPolarHBondContact O-CG1 3.45Å; V335-I339 PolarHBondContact O-N 3.04Å; I336-I339 PolarHBondContact O-N 3.15Å; Q337-I339 VanDerWaalsContact C-N 3.33Å; Q337-I339 PolarHBondContact O-N 2.56Å; I339-E341 PolarHBondContact O-N 3.02Å; I339-C343 HydrophobicContact CG2-CB 4.08Å; I339-C343 VanDerWaalsContact O-CB 3.25Å; I339-C343 WeakPolarHBondContact O-CB 3.2Å; I339-C343 PolarHBondContact O-N 3.49Å; I339-T348 HydrophobicContact CG2-CG2 4.36Å; I339-T348 VanDerWaalsContact O-CG2 3.27Å; I339-T348 WeakPolarHBondContact O-CG2 3.36Å; I339-I351 HydrophobicContact CG2-CG1 4.22Å
340L98.5Very high98.4Very high32 Ų3242 Ų4217%0.16822%0.217CC..Hα-helixtrans-66.5-21.9178.6-64.8172.2000113.8I336 Q337 R338 T348 L352 L355 V371 V375I336-L340 HydrophobicContact CG2-CD1 4.01Å; I336-L340 HydrophobicContact CG2-CG 4.48Å; I336-L340 WeakPolarHBondContact O-CG 3.48Å; I336-L340 PolarHBondContact O-N 3.17Å; Q337-L340 PolarHBondContact O-N 3.22Å; R338-L340 VanDerWaalsContact C-N 3.35Å; R338-L340 PolarHBondContact O-N 3.09Å; L340-T348 HydrophobicContact CD2-CG2 4.39Å; L340-L352 HydrophobicContact CD2-CD2 3.87Å; L340-L352 HydrophobicContact CD2-CG 3.93Å; L340-L355 HydrophobicContact CD1-CD1 4.15Å; L340-V371 HydrophobicContact CD1-CG1 4.25Å; L340-V375 HydrophobicContact CD1-CG2 3.84Å
341E98.3Very high98.4Very high83 Ų8340 Ų4039%0.38821%0.205SC..Hα-helixtrans-89.6-33.6179.2-72.6164.3-163.100114.1Q337 R338 I339 H374Q337-E341 VanDerWaalsContact O-CG 3.26Å; Q337-E341 WeakPolarHBondContact O-CG 3.35Å; Q337-E341 PolarHBondContact O-N 3.24Å; R338-E341 IonicContact CZ-OE1 2.71Å; R338-E341 IonicContact CZ-OE2 2.85Å; R338-E341 IonicContact NE-OE1 2.73Å; R338-E341 IonicContact NE-OE2 3.3Å; R338-E341 PolarHBondContact NE-OE2 2.99Å; R338-E341 IonicContact NH2-OE1 3.73Å; R338-E341 PolarHBondContact NH2-OE1 2.85Å; R338-E341 IonicContact NH2-OE2 2.68Å; R338-E341 PolarHBondContact NH2-OE2 3.41Å; R338-E341 PolarHBondContact O-N 2.93Å; I339-E341 PolarHBondContact O-N 3.02Å; E341-H374 WeakPolarHBondContact CG-CE1 3.49Å; E341-H374 IonicContact OE1-CE1 3.88Å; E341-H374 PolarHBondContact OE1-CE1 2.85Å; E341-H374 IonicContact OE1-ND1 3.04Å; E341-H374 PolarHBondContact OE1-ND1 2.93Å; E341-H374 IonicContact OE1-NE2 3.65Å
342H98.3Very high98.4Very high81 Ų8136.9 Ų36.938%0.37519%0.193SC..Hα-helixtrans-123.1-22-166.3-66.6-89.9000115.5I304 P309 R338I304-H342 HydrophobicContact CG2-CB 3.78Å; I304-H342 WeakPolarHBondContact O-CB 3.32Å; P309-H342 WeakPolarHBondContact CG-O 3.15Å; R338-H342 PolarHBondContact O-CD2 2.69Å; R338-H342 PolarHBondContact O-N 3.12Å
343C98.3Very high98.4Very high16 Ų1641.1 Ų41.111%0.10822%0.216CC..SBendtrans-82.6163.9-178.7-65.80000112.2I316 I339 Q347 T348I316-C343 HydrophobicContact CD1-CB 4.46Å; I339-C343 HydrophobicContact CG2-CB 4.08Å; I339-C343 VanDerWaalsContact O-CB 3.25Å; I339-C343 WeakPolarHBondContact O-CB 3.2Å; I339-C343 PolarHBondContact O-N 3.49Å; C343-Q347 HydrophobicContact CB-CB 3.87Å; C343-T348 HydrophobicContact CB-CG2 4.07Å
344T98.4Very high98.4Very high47 Ų4742.1 Ų42.129%0.28822%0.22SC..  trans-70.9169.8-175.982.20000112.8P309 E346 Q347 T348P309-T344 HydrophobicContact CB-CG2 3.84Å; T344-E346 VanDerWaalsContact C-N 3.27Å; T344-E346 WeakPolarHBondContact CB-OE2 3.39Å; T344-E346 PolarHBondContact O-N 3.28Å; T344-E346 PolarHBondContact OG1-N 3.2Å; T344-E346 PolarHBondContact OG1-OE2 2.86Å; T344-Q347 PolarHBondContact O-N 3Å; T344-Q347 PolarHBondContact OG1-N 3.17Å; T344-T348 WeakPolarHBondContact O-CB 3.49Å; T344-T348 WeakPolarHBondContact O-CG2 3.47Å; T344-T348 PolarHBondContact O-N 3.14Å; T344-T348 PolarHBondContact O-OG1 3.02Å
345A97.4Very high98.4Very high60 Ų6038.2 Ų38.250%0.49621%0.205SC..Hα-helixtrans-60.2-38.4176.200000112.1Q347 T348 T349A345-Q347 VanDerWaalsContact C-N 3.29Å; A345-Q347 PolarHBondContact O-N 3.21Å; A345-T348 WeakPolarHBondContact CA-OG1 3.31Å; A345-T348 PolarHBondContact O-OG1 2.89Å; A345-T349 WeakPolarHBondContact O-CB 3.35Å; A345-T349 PolarHBondContact O-N 3.23Å; A345-T349 PolarHBondContact O-OG1 3.12Å
346E98Very high98.4Very high143 Ų14339.9 Ų39.967%0.66821%0.213SC*.Hα-helixtrans-68.5-30178.6-54.370.9-152.800111.8T344 P350T344-E346 VanDerWaalsContact C-N 3.27Å; T344-E346 WeakPolarHBondContact CB-OE2 3.39Å; T344-E346 PolarHBondContact O-N 3.28Å; T344-E346 PolarHBondContact OG1-N 3.2Å; T344-E346 PolarHBondContact OG1-OE2 2.86Å; E346-P350 WeakPolarHBondContact O-CD 3.46Å
347Q98.4Very high98.4Very high6 Ų646.9 Ų46.93%0.02825%0.246CC..Hα-helixtrans-84.3-35.7177.8-70.9-178.5-31.100113.2P309 I316 C343 T344 A345P309-Q347 PolarHBondContact O-NE2 3.45Å; I316-Q347 HydrophobicContact CD1-CB 4.24Å; I316-Q347 HydrophobicContact CG1-CB 4.04Å; I316-Q347 HydrophobicContact CG1-CG 4.12Å; C343-Q347 HydrophobicContact CB-CB 3.87Å; T344-Q347 PolarHBondContact O-N 3Å; T344-Q347 PolarHBondContact OG1-N 3.17Å; A345-Q347 VanDerWaalsContact C-N 3.29Å; A345-Q347 PolarHBondContact O-N 3.21Å
348T98.4Very high98.4Very high17 Ų1747.7 Ų47.710%0.10425%0.25CC..Hα-helixtrans-81.2-31.2-179.549.20000112.9I339 L340 C343 T344 A345 I351 L352I339-T348 HydrophobicContact CG2-CG2 4.36Å; I339-T348 VanDerWaalsContact O-CG2 3.27Å; I339-T348 WeakPolarHBondContact O-CG2 3.36Å; L340-T348 HydrophobicContact CD2-CG2 4.39Å; C343-T348 HydrophobicContact CB-CG2 4.07Å; T344-T348 WeakPolarHBondContact O-CB 3.49Å; T344-T348 WeakPolarHBondContact O-CG2 3.47Å; T344-T348 PolarHBondContact O-N 3.14Å; T344-T348 PolarHBondContact O-OG1 3.02Å; A345-T348 WeakPolarHBondContact CA-OG1 3.31Å; A345-T348 PolarHBondContact O-OG1 2.89Å; T348-I351 WeakPolarHBondContact O-CB 3.33Å; T348-I351 PolarHBondContact O-N 3.41Å; T348-I351 VanDerWaalsContact O-N 3.11Å; T348-L352 WeakPolarHBondContact O-CG 3.14Å; T348-L352 PolarHBondContact O-N 2.9Å
349T98.3Very high98.3Very high51 Ų5145.8 Ų45.831%0.31324%0.242SC..Hα-helixtrans-51.8-56.2177.4-63.20000113.6A345 I351 L352 D353A345-T349 WeakPolarHBondContact O-CB 3.35Å; A345-T349 PolarHBondContact O-N 3.23Å; A345-T349 PolarHBondContact O-OG1 3.12Å; T349-I351 PolarHBondContact O-N 3.17Å; T349-I351 VanDerWaalsContact O-N 3.12Å; T349-L352 WeakPolarHBondContact O-CA 3.46Å; T349-L352 WeakPolarHBondContact O-CB 3.38Å; T349-L352 PolarHBondContact O-N 2.9Å; T349-D353 VanDerWaalsContact O-CG 3.26Å; T349-D353 PolarHBondContact O-N 3.38Å
350P98.3Very high98.3Very high55 Ų5550.4 Ų50.436%0.35726%0.264SS..Hα-helixtrans-65.6-18.518027.1-36.5000114E346E346-P350 WeakPolarHBondContact O-CD 3.46Å
351I98.6Very high98.3Very high3 Ų353 Ų532%0.01528%0.276CS..Hα-helixtrans-80-39.5172.3-55-63.5000110.2I316 F319 V323 I336 I339 T348 T349 L355I316-I351 HydrophobicContact CG2-CD1 4.44Å; F319-I351 HydrophobicContact CB-CD1 3.82Å; V323-I351 HydrophobicContact CG1-CG2 4.05Å; V323-I351 HydrophobicContact CG2-CD1 3.76Å; V323-I351 HydrophobicContact CG2-CG2 4.23Å; I336-I351 HydrophobicContact CD1-CG2 4.13Å; I339-I351 HydrophobicContact CG2-CG1 4.22Å; T348-I351 WeakPolarHBondContact O-CB 3.33Å; T348-I351 PolarHBondContact O-N 3.41Å; T348-I351 VanDerWaalsContact O-N 3.11Å; T349-I351 PolarHBondContact O-N 3.17Å; T349-I351 VanDerWaalsContact O-N 3.12Å; I351-L355 HydrophobicContact CG2-CD1 4.36Å; I351-L355 WeakPolarHBondContact O-CB 3.43Å; I351-L355 VanDerWaalsContact O-CG 3.23Å; I351-L355 WeakPolarHBondContact O-CG 3.24Å; I351-L355 PolarHBondContact O-N 3.44Å
352L98.6Very high98.3Very high11 Ų1149.1 Ų49.16%0.05826%0.257CS..Hα-helixtrans-65.3-42.3174.2-72.5163.7000111.6L340 T348 T349 E354 L355 H356 V375L340-L352 HydrophobicContact CD2-CD2 3.87Å; L340-L352 HydrophobicContact CD2-CG 3.93Å; T348-L352 WeakPolarHBondContact O-CG 3.14Å; T348-L352 PolarHBondContact O-N 2.9Å; T349-L352 WeakPolarHBondContact O-CA 3.46Å; T349-L352 WeakPolarHBondContact O-CB 3.38Å; T349-L352 PolarHBondContact O-N 2.9Å; L352-E354 PolarHBondContact O-N 2.86Å; L352-L355 HydrophobicContact CD2-CD1 4.37Å; L352-L355 WeakPolarHBondContact O-CB 3.44Å; L352-L355 PolarHBondContact O-N 3.31Å; L352-L355 VanDerWaalsContact O-N 3.17Å; L352-H356 PolarHBondContact O-CD2 3.13Å; L352-H356 VanDerWaalsContact O-CG 3.25Å; L352-H356 PolarHBondContact O-N 2.87Å; L352-V375 HydrophobicContact CD2-CG1 4.14Å; L352-V375 HydrophobicContact CD2-CG2 3.93Å
353D98.4Very high98.4Very high89 Ų8945.3 Ų45.348%0.47624%0.24SC..Hα-helixtrans-55.6-51.1176.4-63.2-32.3000111.3T349 L355 H356 E357T349-D353 VanDerWaalsContact O-CG 3.26Å; T349-D353 PolarHBondContact O-N 3.38Å; D353-L355 VanDerWaalsContact C-N 3.34Å; D353-L355 PolarHBondContact O-N 2.78Å; D353-H356 PolarHBondContact O-N 3.19Å; D353-E357 PolarHBondContact O-N 3.45Å
354E98.4Very high98.4Very high28 Ų2848.6 Ų48.613%0.13125%0.253CS..Hα-helixtrans-72.1-23178.9-160.9-177.3137.600113.1G321 Q322 V323 L352 H358G321-E354 VanDerWaalsContact C-OE1 3.27Å; G321-E354 VanDerWaalsContact CA-OE1 3.31Å; G321-E354 WeakPolarHBondContact CA-OE1 3.17Å; G321-E354 WeakPolarHBondContact CA-OE2 3.5Å; G321-E354 PolarHBondContact N-OE1 3.13Å; G321-E354 PolarHBondContact N-OE2 3.35Å; Q322-E354 PolarHBondContact N-OE1 2.83Å; V323-E354 HydrophobicContact CB-CB 3.92Å; V323-E354 VanDerWaalsContact CB-CD 3.48Å; V323-E354 HydrophobicContact CB-CG 3.83Å; V323-E354 VanDerWaalsContact CB-OE1 3.31Å; V323-E354 WeakPolarHBondContact CB-OE1 3.12Å; V323-E354 HydrophobicContact CG1-CB 4.34Å; V323-E354 HydrophobicContact CG2-CB 3.98Å; V323-E354 HydrophobicContact CG2-CG 4.16Å; V323-E354 PolarHBondContact N-OE1 2.93Å; L352-E354 PolarHBondContact O-N 2.86Å; E354-H358 PolarHBondContact O-CD2 2.92Å
355L98.4Very high98.4Very high3 Ų348 Ų482%0.01625%0.249CC..Hα-helixtrans-69-43.9167.2-75.6170.3000111.2V323 S327 I336 L340 I351 L352 D353 E357 H358 T359 L362 V371V323-L355 HydrophobicContact CG1-CD2 3.69Å; V323-L355 HydrophobicContact CG1-CG 3.68Å; S327-L355 WeakPolarHBondContact OG-CD2 3.05Å; I336-L355 HydrophobicContact CG2-CD1 4.45Å; L340-L355 HydrophobicContact CD1-CD1 4.15Å; I351-L355 HydrophobicContact CG2-CD1 4.36Å; I351-L355 WeakPolarHBondContact O-CB 3.43Å; I351-L355 VanDerWaalsContact O-CG 3.23Å; I351-L355 WeakPolarHBondContact O-CG 3.24Å; I351-L355 PolarHBondContact O-N 3.44Å; L352-L355 HydrophobicContact CD2-CD1 4.37Å; L352-L355 WeakPolarHBondContact O-CB 3.44Å; L352-L355 PolarHBondContact O-N 3.31Å; L352-L355 VanDerWaalsContact O-N 3.17Å; D353-L355 VanDerWaalsContact C-N 3.34Å; D353-L355 PolarHBondContact O-N 2.78Å; L355-E357 VanDerWaalsContact C-N 3.34Å; L355-E357 PolarHBondContact O-N 3.01Å; L355-H358 CarbonylContact O-C 3.49Å; L355-H358 PolarHBondContact O-N 3.01Å; L355-T359 PolarHBondContact O-N 2.98Å; L355-L362 HydrophobicContact CD2-CD1 3.62Å; L355-V371 HydrophobicContact CD1-CG1 3.87Å; L355-V371 HydrophobicContact CD2-CG1 3.74Å
356H98.6Very high98.5Very high34 Ų3449.6 Ų49.616%0.15725%0.246CC..Hα-helixtrans-63.3-40.2-176.1-71.6-46.2000111.4L352 D353 H358 T359 D383 I386L352-H356 PolarHBondContact O-CD2 3.13Å; L352-H356 VanDerWaalsContact O-CG 3.25Å; L352-H356 PolarHBondContact O-N 2.87Å; D353-H356 PolarHBondContact O-N 3.19Å; H356-H358 PolarHBondContact O-N 3.09Å; H356-H358 VanDerWaalsContact O-N 3.1Å; H356-T359 WeakPolarHBondContact CA-OG1 3.35Å; H356-T359 PolarHBondContact O-N 3.36Å; H356-T359 PolarHBondContact O-OG1 2.9Å; H356-D383 IonicContact CE1-OD1 2.72Å; H356-D383 IonicContact NE2-OD1 2.58Å; H356-D383 PolarHBondContact NE2-OD1 3.36Å; H356-I386 HydrophobicContact CB-CG2 4.26Å; H356-I386 WeakPolarHBondContact ND1-CG2 3.29Å
357E98.3Very high98.5Very high148 Ų14846.2 Ų46.269%0.69223%0.227SC*.THydrogen-bonded Turntrans-54.7-25.5172.6-72.7-174.5-155.800114.2D353 L355D353-E357 PolarHBondContact O-N 3.45Å; L355-E357 VanDerWaalsContact C-N 3.34Å; L355-E357 PolarHBondContact O-N 3.01Å
358H98.4Very high98.5Very high51 Ų5145.9 Ų45.924%0.23623%0.226CC..THydrogen-bonded Turntrans-120.218.1-174.2-63.2-52.8000114.1Y324 E354 L355 H356 E360 Q361 L362Y324-H358 VanDerWaalsContact CB-CD2 3.48Å; Y324-H358 WeakPolarHBondContact CB-CD2 3.4Å; Y324-H358 HydrophobicContact CD2-CB 3.58Å; Y324-H358 AromaticContact CD2-CG 3.87Å; Y324-H358 HydrophobicContact CE2-CB 4.24Å; Y324-H358 HydrophobicContact CG-CB 4.19Å; Y324-H358 AromaticContact CG-CD2 3.99Å; Y324-H358 AromaticContact CG-CG 3.98Å; E354-H358 PolarHBondContact O-CD2 2.92Å; L355-H358 CarbonylContact O-C 3.49Å; L355-H358 PolarHBondContact O-N 3.01Å; H356-H358 PolarHBondContact O-N 3.09Å; H356-H358 VanDerWaalsContact O-N 3.1Å; H358-E360 VanDerWaalsContact C-N 3.35Å; H358-E360 PolarHBondContact O-N 2.96Å; H358-Q361 VanDerWaalsContact C-OE1 3.29Å; H358-Q361 PolarHBondContact O-N 3.04Å; H358-Q361 PolarHBondContact O-OE1 3.05Å; H358-Q361 VanDerWaalsContact O-OE1 3.11Å; H358-L362 HydrophobicContact CB-CD1 4.01Å; H358-L362 HydrophobicContact CB-CG 4.27Å; H358-L362 WeakPolarHBondContact O-CB 3.45Å; H358-L362 VanDerWaalsContact O-CG 3.29Å; H358-L362 WeakPolarHBondContact O-CG 3.36Å; H358-L362 PolarHBondContact O-N 3.17Å
359T98.5Very high98.5Very high3 Ų345.1 Ų45.12%0.01822%0.221CC..Hα-helixtrans-51-47.9-175.3-62.60000113.3L355 H356 Q361 L362 I363 L387 S390L355-T359 PolarHBondContact O-N 2.98Å; H356-T359 WeakPolarHBondContact CA-OG1 3.35Å; H356-T359 PolarHBondContact O-N 3.36Å; H356-T359 PolarHBondContact O-OG1 2.9Å; T359-Q361 VanDerWaalsContact C-N 3.32Å; T359-Q361 PolarHBondContact O-N 3.09Å; T359-L362 PolarHBondContact O-N 3.26Å; T359-I363 HydrophobicContact CG2-CD1 3.54Å; T359-I363 HydrophobicContact CG2-CG1 4.13Å; T359-I363 WeakPolarHBondContact O-CB 3.46Å; T359-I363 WeakPolarHBondContact O-CG1 3.11Å; T359-I363 PolarHBondContact O-N 3.04Å; T359-L387 HydrophobicContact CG2-CD2 3.56Å; T359-S390 VanDerWaalsContact CG2-CB 3.46Å; T359-S390 WeakPolarHBondContact CG2-OG 3.38Å
360E97.8Very high98.6Very high97 Ų9748.1 Ų48.145%0.45323%0.227SC..Hα-helixtrans-67-34.1-172-56.6-151.4-170.300113.5H358 Q364 K394H358-E360 VanDerWaalsContact C-N 3.35Å; H358-E360 PolarHBondContact O-N 2.96Å; E360-Q364 PolarHBondContact O-NE2 2.96Å; E360-K394 IonicContact OE1-NZ 2.71Å; E360-K394 PolarHBondContact OE1-NZ 2.92Å; E360-K394 IonicContact OE2-NZ 2.76Å; E360-K394 PolarHBondContact OE2-NZ 3.3Å
361Q98.7Very high98.6Very high88 Ų8845.5 Ų45.541%0.41121%0.21SC..Hα-helixtrans-73.4-48.4175-59.386.5-26.400109.9Y324 H358 T359 I363 Q364 D365Y324-Q361 HydrophobicContact CE2-CB 3.69Å; Y324-Q361 HydrophobicContact CE2-CG 4.47Å; H358-Q361 VanDerWaalsContact C-OE1 3.29Å; H358-Q361 PolarHBondContact O-N 3.04Å; H358-Q361 PolarHBondContact O-OE1 3.05Å; H358-Q361 VanDerWaalsContact O-OE1 3.11Å; T359-Q361 VanDerWaalsContact C-N 3.32Å; T359-Q361 PolarHBondContact O-N 3.09Å; Q361-I363 PolarHBondContact O-N 3.01Å; Q361-Q364 PolarHBondContact O-N 3.29Å; Q361-D365 PolarHBondContact O-N 3.01Å
362L98.9Very high98.6Very high0 Ų045.4 Ų45.40%021%0.21CC..Hα-helixtrans-64.6-36.2-177.4-70.5172.2000112.9Y324 T328 L355 H358 T359 Q364 D365 G368 N369 I372Y324-L362 HydrophobicContact CD2-CD1 4.45Å; Y324-L362 HydrophobicContact CD2-CD2 3.74Å; Y324-L362 HydrophobicContact CD2-CG 3.92Å; Y324-L362 HydrophobicContact CE2-CD2 3.95Å; Y324-L362 HydrophobicContact CE2-CG 4.13Å; T328-L362 HydrophobicContact CG2-CD2 3.81Å; L355-L362 HydrophobicContact CD2-CD1 3.62Å; H358-L362 HydrophobicContact CB-CD1 4.01Å; H358-L362 HydrophobicContact CB-CG 4.27Å; H358-L362 WeakPolarHBondContact O-CB 3.45Å; H358-L362 VanDerWaalsContact O-CG 3.29Å; H358-L362 WeakPolarHBondContact O-CG 3.36Å; H358-L362 PolarHBondContact O-N 3.17Å; T359-L362 PolarHBondContact O-N 3.26Å; L362-Q364 PolarHBondContact O-N 3.47Å; L362-Q364 VanDerWaalsContact O-N 3.16Å; L362-D365 PolarHBondContact O-N 3.27Å; L362-G368 CarbonylContact O-C 3.48Å; L362-N369 WeakPolarHBondContact O-CA 3.4Å; L362-N369 PolarHBondContact O-N 3.4Å; L362-I372 HydrophobicContact CB-CD1 3.78Å; L362-I372 HydrophobicContact CB-CG1 3.76Å; L362-I372 HydrophobicContact CD1-CD1 4.19Å
363I98.8Very high98.6Very high2 Ų245.6 Ų45.61%0.0121%0.211CC..THydrogen-bonded Turntrans-55-31.4172.5-75.8172.5000112.1T359 Q361 I372 V391 L398 A404 V407T359-I363 HydrophobicContact CG2-CD1 3.54Å; T359-I363 HydrophobicContact CG2-CG1 4.13Å; T359-I363 WeakPolarHBondContact O-CB 3.46Å; T359-I363 WeakPolarHBondContact O-CG1 3.11Å; T359-I363 PolarHBondContact O-N 3.04Å; Q361-I363 PolarHBondContact O-N 3.01Å; I363-I372 HydrophobicContact CG1-CG1 4.26Å; I363-I372 HydrophobicContact CG1-CG2 3.97Å; I363-V391 HydrophobicContact CD1-CG2 3.74Å; I363-L398 HydrophobicContact CG2-CD1 4.31Å; I363-L398 HydrophobicContact CG2-CD2 4.02Å; I363-A404 HydrophobicContact CG2-CB 3.58Å; I363-A404 WeakPolarHBondContact O-CA 3.43Å; I363-A404 WeakPolarHBondContact O-CB 3.23Å; I363-V407 HydrophobicContact CG1-CG1 4.2Å; I363-V407 HydrophobicContact CG2-CB 4.4Å; I363-V407 HydrophobicContact CG2-CG2 4.35Å
364Q98.7Very high98.6Very high84 Ų8442 Ų4239%0.39319%0.191SC..THydrogen-bonded Turntrans-103.2-16.9-173.8-64.5177.182.100113.4E360 Q361 L362 L398 H401 F403 A404E360-Q364 PolarHBondContact O-NE2 2.96Å; Q361-Q364 PolarHBondContact O-N 3.29Å; L362-Q364 PolarHBondContact O-N 3.47Å; L362-Q364 VanDerWaalsContact O-N 3.16Å; Q364-L398 HydrophobicContact CG-CD2 4.06Å; Q364-H401 PolarHBondContact O-CE1 3.29Å; Q364-H401 VanDerWaalsContact O-CE1 3.29Å; Q364-F403 WeakPolarHBondContact O-CD2 2.98Å; Q364-A404 HydrophobicContact CG-CB 4.25Å
365D98.8Very high98.7Very high35 Ų3540.9 Ų40.919%0.18719%0.186CC..SBendtrans-70.4148177.2178.7-110.3000113.1T328 Q361 L362 Y367 G368 N369T328-D365 WeakPolarHBondContact CA-OD1 3.31Å; T328-D365 HydrophobicContact CG2-CB 3.97Å; Q361-D365 PolarHBondContact O-N 3.01Å; L362-D365 PolarHBondContact O-N 3.27Å; D365-Y367 PolarHBondContact O-N 3.22Å; D365-Y367 WeakPolarHBondContact OD1-CA 3.44Å; D365-Y367 PolarHBondContact OD1-N 2.82Å; D365-G368 PolarHBondContact OD1-N 2.8Å; D365-N369 WeakPolarHBondContact O-CB 3.44Å; D365-N369 PolarHBondContact O-N 3.44Å; D365-N369 PolarHBondContact O-ND2 3.49Å
366Q98.6Very high98.7Very high94 Ų9440.8 Ų40.844%0.43919%0.185SC..THydrogen-bonded Turntrans-64.1-22.4-178.872.5-170.3-39.700114.4N369 Y370 F403Q366-N369 PolarHBondContact O-ND2 3.22Å; Q366-Y370 WeakPolarHBondContact O-CE2 3.2Å; Q366-F403 HydrophobicContact CB-CD1 4.38Å; Q366-F403 HydrophobicContact CB-CD2 4.23Å; Q366-F403 HydrophobicContact CB-CE1 3.84Å; Q366-F403 HydrophobicContact CB-CE2 3.66Å; Q366-F403 HydrophobicContact CB-CZ 3.44Å; Q366-F403 VanDerWaalsContact CB-CZ 3.44Å
367Y98.7Very high98.7Very high71 Ų7142.4 Ų42.428%0.27819%0.193SC..THydrogen-bonded Turntrans-112.5-41.1175.9-56.8-59.1000111.7S327 T328 P330 D365 N369 Y370S327-Y367 CarbonylContact O-C 3.55Å; T328-Y367 WeakPolarHBondContact O-CD2 3.49Å; P330-Y367 HydrophobicContact CB-CD1 4.46Å; P330-Y367 HydrophobicContact CB-CD2 4.48Å; P330-Y367 HydrophobicContact CB-CE1 3.9Å; P330-Y367 HydrophobicContact CB-CE2 3.91Å; P330-Y367 HydrophobicContact CG-CE2 4.25Å; D365-Y367 PolarHBondContact O-N 3.22Å; D365-Y367 WeakPolarHBondContact OD1-CA 3.44Å; D365-Y367 PolarHBondContact OD1-N 2.82Å; Y367-N369 PolarHBondContact O-N 3.45Å; Y367-Y370 WeakPolarHBondContact O-CB 3.11Å; Y367-Y370 PolarHBondContact O-N 2.84Å
368G98.8Very high98.6Very high0 Ų041.7 Ų41.70%019%0.189CC..Hα-helixtrans-56.9-34.4179.100000113.4S327 L362 D365 Y370 V371 I372S327-G368 WeakPolarHBondContact O-CA 3.26Å; S327-G368 PolarHBondContact O-N 3.04Å; S327-G368 VanDerWaalsContact O-N 3.15Å; L362-G368 CarbonylContact O-C 3.48Å; D365-G368 PolarHBondContact OD1-N 2.8Å; G368-Y370 PolarHBondContact O-N 3.49Å; G368-Y370 VanDerWaalsContact O-N 3.11Å; G368-V371 WeakPolarHBondContact O-CB 3.27Å; G368-V371 PolarHBondContact O-N 2.89Å; G368-I372 PolarHBondContact O-N 2.79Å; G368-I372 VanDerWaalsContact O-N 3.09Å
369N98.8Very high98.5Very high1 Ų140.6 Ų40.61%0.00519%0.192CC..Hα-helixtrans-59.2-27.7178.377.895.8000112.6L362 D365 Q366 Y367 Q373 F403 V407L362-N369 WeakPolarHBondContact O-CA 3.4Å; L362-N369 PolarHBondContact O-N 3.4Å; D365-N369 WeakPolarHBondContact O-CB 3.44Å; D365-N369 PolarHBondContact O-N 3.44Å; D365-N369 PolarHBondContact O-ND2 3.49Å; Q366-N369 PolarHBondContact O-ND2 3.22Å; Y367-N369 PolarHBondContact O-N 3.45Å; N369-Q373 WeakPolarHBondContact O-CB 3.37Å; N369-Q373 WeakPolarHBondContact O-CG 3.35Å; N369-Q373 PolarHBondContact O-N 3.14Å; N369-Q373 PolarHBondContact O-NE2 3.19Å; N369-Q373 PolarHBondContact OD1-NE2 3.36Å; N369-F403 HydrophobicContact CB-CB 4.12Å; N369-V407 HydrophobicContact CB-CG2 3.98Å
370Y98.9Very high98.5Very high113 Ų11344.8 Ų44.844%0.44321%0.21SC..Hα-helixtrans-74.5-34.3175.6-65.2-73.1000112.3Q366 Y367 G368 Q373 H374Q366-Y370 WeakPolarHBondContact O-CE2 3.2Å; Y367-Y370 WeakPolarHBondContact O-CB 3.11Å; Y367-Y370 PolarHBondContact O-N 2.84Å; G368-Y370 PolarHBondContact O-N 3.49Å; G368-Y370 VanDerWaalsContact O-N 3.11Å; Y370-Q373 PolarHBondContact O-N 3.22Å; Y370-H374 WeakPolarHBondContact O-CB 3.44Å; Y370-H374 PolarHBondContact O-N 3.36Å
371V98.9Very high98.5Very high0 Ų044.3 Ų44.30%021%0.208CC..Hα-helixtrans-66.2-44.4174.4-177.40000110.4C333 I336 L340 L355 G368 Q373 H374 V375C333-V371 HydrophobicContact CB-CG2 3.91Å; I336-V371 HydrophobicContact CB-CG2 4.48Å; I336-V371 HydrophobicContact CG2-CG1 3.57Å; I336-V371 HydrophobicContact CG2-CG2 4.2Å; L340-V371 HydrophobicContact CD1-CG1 4.25Å; L355-V371 HydrophobicContact CD1-CG1 3.87Å; L355-V371 HydrophobicContact CD2-CG1 3.74Å; G368-V371 WeakPolarHBondContact O-CB 3.27Å; G368-V371 PolarHBondContact O-N 2.89Å; V371-Q373 PolarHBondContact O-N 3.05Å; V371-H374 WeakPolarHBondContact O-CB 3.5Å; V371-H374 PolarHBondContact O-N 3.46Å; V371-V375 PolarHBondContact O-N 3.36Å; V371-V375 VanDerWaalsContact O-N 3.08Å
372I98.9Very high98.5Very high1 Ų145.6 Ų45.61%0.00521%0.214CC..Hα-helixtrans-63.9-42.3176.4-55.8-55000111.5L362 I363 G368 H374 V375 L376 L387 V407L362-I372 HydrophobicContact CB-CD1 3.78Å; L362-I372 HydrophobicContact CB-CG1 3.76Å; L362-I372 HydrophobicContact CD1-CD1 4.19Å; I363-I372 HydrophobicContact CG1-CG1 4.26Å; I363-I372 HydrophobicContact CG1-CG2 3.97Å; G368-I372 PolarHBondContact O-N 2.79Å; G368-I372 VanDerWaalsContact O-N 3.09Å; I372-H374 VanDerWaalsContact C-N 3.33Å; I372-H374 PolarHBondContact O-N 3.42Å; I372-V375 PolarHBondContact O-N 3.21Å; I372-L376 HydrophobicContact CG2-CD1 4.15Å; I372-L376 WeakPolarHBondContact O-CG 3.47Å; I372-L376 PolarHBondContact O-N 2.97Å; I372-L387 HydrophobicContact CD1-CD2 3.97Å; I372-L387 HydrophobicContact CG2-CD1 4.07Å; I372-L387 HydrophobicContact CG2-CD2 4.1Å; I372-V407 HydrophobicContact CG2-CG1 3.71Å
373Q98.9Very high98.5Very high16 Ų1646 Ų468%0.07522%0.216CC..Hα-helixtrans-62-40.3174-73.1174.787.900112.1N369 Y370 V371 V375 L376 E377 V407 K410N369-Q373 WeakPolarHBondContact O-CB 3.37Å; N369-Q373 WeakPolarHBondContact O-CG 3.35Å; N369-Q373 PolarHBondContact O-N 3.14Å; N369-Q373 PolarHBondContact O-NE2 3.19Å; N369-Q373 PolarHBondContact OD1-NE2 3.36Å; Y370-Q373 PolarHBondContact O-N 3.22Å; V371-Q373 PolarHBondContact O-N 3.05Å; Q373-V375 PolarHBondContact O-N 2.76Å; Q373-L376 WeakPolarHBondContact O-CB 3.47Å; Q373-L376 PolarHBondContact O-N 3.05Å; Q373-E377 WeakPolarHBondContact O-CG 3.48Å; Q373-E377 PolarHBondContact O-N 3.26Å; Q373-V407 HydrophobicContact CG-CG2 4.14Å; Q373-K410 HydrophobicContact CB-CG 3.92Å; Q373-K410 HydrophobicContact CG-CB 4.41Å; Q373-K410 HydrophobicContact CG-CG 3.58Å
374H98.8Very high98.5Very high13 Ų1346.9 Ų46.96%0.0622%0.22CC..Hα-helixtrans-60-46.1176.9-17886.6000111.9Q337 E341 Y370 V371 I372 L376 E377 H378Q337-H374 HydrophobicContact CG-CB 3.99Å; E341-H374 WeakPolarHBondContact CG-CE1 3.49Å; E341-H374 IonicContact OE1-CE1 3.88Å; E341-H374 PolarHBondContact OE1-CE1 2.85Å; E341-H374 IonicContact OE1-ND1 3.04Å; E341-H374 PolarHBondContact OE1-ND1 2.93Å; E341-H374 IonicContact OE1-NE2 3.65Å; Y370-H374 WeakPolarHBondContact O-CB 3.44Å; Y370-H374 PolarHBondContact O-N 3.36Å; V371-H374 WeakPolarHBondContact O-CB 3.5Å; V371-H374 PolarHBondContact O-N 3.46Å; I372-H374 VanDerWaalsContact C-N 3.33Å; I372-H374 PolarHBondContact O-N 3.42Å; H374-L376 VanDerWaalsContact C-N 3.34Å; H374-L376 PolarHBondContact O-N 2.9Å; H374-E377 PolarHBondContact O-N 3.2Å; H374-H378 AromaticContact CE1-CD2 3.41Å; H374-H378 PolarHBondContact CE1-CD2 3.39Å; H374-H378 VanDerWaalsContact CE1-CD2 3.41Å; H374-H378 AromaticContact CE1-CG 3.91Å; H374-H378 AromaticContact ND1-CD2 3.54Å; H374-H378 AromaticContact NE2-CD2 3.98Å; H374-H378 PolarHBondContact O-N 3.47Å
375V98.8Very high98.5Very high5 Ų544.3 Ų44.33%0.0321%0.211CC..Hα-helixtrans-64-38.6175.2179.90000111.4L340 L352 V371 I372 Q373 E377 G379 D383 K384 L387L340-V375 HydrophobicContact CD1-CG2 3.84Å; L352-V375 HydrophobicContact CD2-CG1 4.14Å; L352-V375 HydrophobicContact CD2-CG2 3.93Å; V371-V375 PolarHBondContact O-N 3.36Å; V371-V375 VanDerWaalsContact O-N 3.08Å; I372-V375 PolarHBondContact O-N 3.21Å; Q373-V375 PolarHBondContact O-N 2.76Å; V375-E377 VanDerWaalsContact C-N 3.3Å; V375-E377 PolarHBondContact O-N 2.97Å; V375-G379 WeakPolarHBondContact O-CA 3.47Å; V375-G379 PolarHBondContact O-N 3.27Å; V375-D383 HydrophobicContact CG1-CB 3.63Å; V375-K384 WeakPolarHBondContact O-CE 3.5Å; V375-L387 HydrophobicContact CB-CD1 3.73Å; V375-L387 HydrophobicContact CG1-CD1 3.53Å
376L98.8Very high98.5Very high0 Ų046.2 Ų46.20%022%0.22CC..Hα-helixtrans-63.9-32.2174.2-71.7166.8000113.1I372 Q373 H374 K384 L387 I388 V407 K410 C411 H414I372-L376 HydrophobicContact CG2-CD1 4.15Å; I372-L376 WeakPolarHBondContact O-CG 3.47Å; I372-L376 PolarHBondContact O-N 2.97Å; Q373-L376 WeakPolarHBondContact O-CB 3.47Å; Q373-L376 PolarHBondContact O-N 3.05Å; H374-L376 VanDerWaalsContact C-N 3.34Å; H374-L376 PolarHBondContact O-N 2.9Å; L376-K384 HydrophobicContact CD2-CB 4.32Å; L376-K384 VanDerWaalsContact O-CD 3.32Å; L376-K384 WeakPolarHBondContact O-CD 3.4Å; L376-K384 WeakPolarHBondContact O-CE 3.36Å; L376-K384 PolarHBondContact O-NZ 3.28Å; L376-L387 HydrophobicContact CD2-CB 4.12Å; L376-L387 HydrophobicContact CD2-CD1 4.31Å; L376-L387 HydrophobicContact CG-CD1 4.12Å; L376-I388 HydrophobicContact CD2-CG1 4.25Å; L376-V407 HydrophobicContact CD1-CG1 3.68Å; L376-K410 HydrophobicContact CB-CB 4Å; L376-K410 HydrophobicContact CD1-CB 3.86Å; L376-C411 VanDerWaalsContact CD1-SG 3.54Å; L376-H414 WeakPolarHBondContact O-CB 3.28Å
377E98.6Very high98.5Very high69 Ų6941.9 Ų41.932%0.32220%0.2SC..Hα-helixtrans-81.1-50.6177-71.8-176.911500111.7Q373 H374 V375 K384 K410 H414Q373-E377 WeakPolarHBondContact O-CG 3.48Å; Q373-E377 PolarHBondContact O-N 3.26Å; H374-E377 PolarHBondContact O-N 3.2Å; V375-E377 VanDerWaalsContact C-N 3.3Å; V375-E377 PolarHBondContact O-N 2.97Å; E377-K384 VanDerWaalsContact C-NZ 3.34Å; E377-K384 PolarHBondContact O-NZ 3.21Å; E377-K410 HydrophobicContact CG-CD 4Å; E377-K410 IonicContact OE1-NZ 3.86Å; E377-K410 PolarHBondContact OE1-NZ 3Å; E377-K410 IonicContact OE2-NZ 4Å; E377-K410 PolarHBondContact OE2-NZ 3.45Å; E377-H414 IonicContact OE1-NE2 3.84Å
378H97.3Very high98.5Very high132 Ų13238.6 Ų38.661%0.61119%0.188SC*.Hα-helixtrans-112.9-19.2-164.9-56.7-75.7000115.8H374H374-H378 AromaticContact CE1-CD2 3.41Å; H374-H378 PolarHBondContact CE1-CD2 3.39Å; H374-H378 VanDerWaalsContact CE1-CD2 3.41Å; H374-H378 AromaticContact CE1-CG 3.91Å; H374-H378 AromaticContact ND1-CD2 3.54Å; H374-H378 AromaticContact NE2-CD2 3.98Å; H374-H378 PolarHBondContact O-N 3.47Å
379G96.8Very high98.5Very high28 Ų2843.1 Ų43.129%0.28921%0.211SC..SBendtrans-70.5178.9-175.500000115.3V375 K384V375-G379 WeakPolarHBondContact O-CA 3.47Å; V375-G379 PolarHBondContact O-N 3.27Å; G379-K384 WeakPolarHBondContact O-CE 3.45Å
380K97.4Very high98.4Very high92 Ų9244.2 Ų44.240%0.422%0.22SC..  trans-72.1153.9177.5-55.1169.5-70.5163.60110E382 D383 K384K380-E382 HydrophobicContact CB-CG 3.93Å; K380-E382 WeakPolarHBondContact CD-OE1 3.46Å; K380-E382 WeakPolarHBondContact CE-OE1 3.26Å; K380-E382 IonicContact NZ-OE1 2.88Å; K380-E382 PolarHBondContact NZ-OE1 2.91Å; K380-E382 PolarHBondContact O-N 2.83Å; K380-D383 WeakPolarHBondContact CB-OD2 3.49Å; K380-D383 WeakPolarHBondContact CE-OD2 3.3Å; K380-D383 PolarHBondContact N-OD2 3.1Å; K380-D383 IonicContact NZ-OD2 3.64Å; K380-D383 PolarHBondContact O-N 3.32Å; K380-D383 VanDerWaalsContact O-N 3.14Å; K380-K384 WeakPolarHBondContact O-CG 3.12Å; K380-K384 PolarHBondContact O-N 3.46Å
381Q98.3Very high98.4Very high87 Ų8738.9 Ų38.941%0.40720%0.198SC..Hα-helixtrans-60.4-32.7-178.118056.967.500112.9K384 S385 T416Q381-K384 PolarHBondContact O-N 3.28Å; Q381-S385 PolarHBondContact NE2-OG 3.4Å; Q381-S385 VanDerWaalsContact NE2-OG 3.16Å; Q381-S385 PolarHBondContact O-N 3.43Å; Q381-S385 PolarHBondContact O-OG 3.41Å; Q381-T416 HydrophobicContact CG-CG2 4.43Å
382E98.3Very high98.3Very high115 Ų11546.4 Ų46.454%0.53723%0.227SC..Hα-helixtrans-60.6-46.5174.460.1-162.1-178.400112.6K380 K384 S385 I386K380-E382 HydrophobicContact CB-CG 3.93Å; K380-E382 WeakPolarHBondContact CD-OE1 3.46Å; K380-E382 WeakPolarHBondContact CE-OE1 3.26Å; K380-E382 IonicContact NZ-OE1 2.88Å; K380-E382 PolarHBondContact NZ-OE1 2.91Å; K380-E382 PolarHBondContact O-N 2.83Å; E382-K384 VanDerWaalsContact C-N 3.33Å; E382-K384 PolarHBondContact O-N 3.28Å; E382-S385 PolarHBondContact O-N 3.45Å; E382-I386 WeakPolarHBondContact O-CG1 3.44Å; E382-I386 PolarHBondContact O-N 3.2Å
383D98.6Very high98.2Very high7 Ų749.4 Ų49.44%0.03726%0.258CS..Hα-helixtrans-60.9-43.5175.9-57.3-60.1000111.3H356 V375 K380 S385 I386 L387H356-D383 IonicContact CE1-OD1 2.72Å; H356-D383 IonicContact NE2-OD1 2.58Å; H356-D383 PolarHBondContact NE2-OD1 3.36Å; V375-D383 HydrophobicContact CG1-CB 3.63Å; K380-D383 WeakPolarHBondContact CB-OD2 3.49Å; K380-D383 WeakPolarHBondContact CE-OD2 3.3Å; K380-D383 PolarHBondContact N-OD2 3.1Å; K380-D383 IonicContact NZ-OD2 3.64Å; K380-D383 PolarHBondContact O-N 3.32Å; K380-D383 VanDerWaalsContact O-N 3.14Å; D383-S385 VanDerWaalsContact C-N 3.3Å; D383-S385 PolarHBondContact O-N 3.25Å; D383-I386 PolarHBondContact O-N 3.49Å; D383-L387 WeakPolarHBondContact O-CG 3.48Å; D383-L387 PolarHBondContact O-N 2.87Å
384K98.7Very high98.1Very high22 Ų2251.7 Ų51.710%0.09627%0.268CS..Hα-helixtrans-59.8-42.8177.6-59.3-173.4-168.8-156.10111V375 L376 E377 G379 K380 Q381 E382 L387 I388V375-K384 WeakPolarHBondContact O-CE 3.5Å; L376-K384 HydrophobicContact CD2-CB 4.32Å; L376-K384 VanDerWaalsContact O-CD 3.32Å; L376-K384 WeakPolarHBondContact O-CD 3.4Å; L376-K384 WeakPolarHBondContact O-CE 3.36Å; L376-K384 PolarHBondContact O-NZ 3.28Å; E377-K384 VanDerWaalsContact C-NZ 3.34Å; E377-K384 PolarHBondContact O-NZ 3.21Å; G379-K384 WeakPolarHBondContact O-CE 3.45Å; K380-K384 WeakPolarHBondContact O-CG 3.12Å; K380-K384 PolarHBondContact O-N 3.46Å; Q381-K384 PolarHBondContact O-N 3.28Å; E382-K384 VanDerWaalsContact C-N 3.33Å; E382-K384 PolarHBondContact O-N 3.28Å; K384-L387 PolarHBondContact O-N 3.29Å; K384-I388 HydrophobicContact CB-CD1 4.47Å; K384-I388 VanDerWaalsContact O-CB 3.32Å; K384-I388 WeakPolarHBondContact O-CB 3.07Å; K384-I388 VanDerWaalsContact O-CD1 3.29Å; K384-I388 WeakPolarHBondContact O-CD1 3.25Å; K384-I388 WeakPolarHBondContact O-CG1 3.49Å; K384-I388 PolarHBondContact O-N 2.99Å
385S98.7Very high98.1Very high30 Ų3051.1 Ų51.121%0.2127%0.265CS..Hα-helixtrans-66.1-36.6178-67.10000112.8Q381 E382 D383 N389 E419Q381-S385 PolarHBondContact NE2-OG 3.4Å; Q381-S385 VanDerWaalsContact NE2-OG 3.16Å; Q381-S385 PolarHBondContact O-N 3.43Å; Q381-S385 PolarHBondContact O-OG 3.41Å; E382-S385 PolarHBondContact O-N 3.45Å; D383-S385 VanDerWaalsContact C-N 3.3Å; D383-S385 PolarHBondContact O-N 3.25Å; S385-N389 WeakPolarHBondContact O-CB 3.45Å; S385-N389 VanDerWaalsContact O-CG 3.29Å; S385-N389 PolarHBondContact O-N 3.39Å; S385-N389 PolarHBondContact O-ND2 3.36Å; S385-E419 WeakPolarHBondContact CA-OE1 3.49Å; S385-E419 WeakPolarHBondContact CB-OE1 3.33Å; S385-E419 PolarHBondContact OG-OE1 3.46Å
386I98.6Very high98Very high74 Ų7452.6 Ų52.638%0.37927%0.273SS..Hα-helixtrans-60.8-53.3171.9-65.3164.4000110.1H356 E382 D383 I388 N389 S390H356-I386 HydrophobicContact CB-CG2 4.26Å; H356-I386 WeakPolarHBondContact ND1-CG2 3.29Å; E382-I386 WeakPolarHBondContact O-CG1 3.44Å; E382-I386 PolarHBondContact O-N 3.2Å; D383-I386 PolarHBondContact O-N 3.49Å; I386-I388 VanDerWaalsContact C-N 3.33Å; I386-I388 PolarHBondContact O-N 2.97Å; I386-N389 WeakPolarHBondContact O-CB 3.3Å; I386-N389 PolarHBondContact O-N 3.37Å; I386-N389 VanDerWaalsContact O-N 3.1Å; I386-S390 PolarHBondContact O-N 2.72Å; I386-S390 PolarHBondContact O-OG 3.44Å
387L98.8Very high98Very high3 Ų357.3 Ų57.32%0.01630%0.301CS..Hα-helixtrans-60.8-39.2-179.7-63.7174000112.8T359 I372 V375 L376 D383 K384 S390 V391T359-L387 HydrophobicContact CG2-CD2 3.56Å; I372-L387 HydrophobicContact CD1-CD2 3.97Å; I372-L387 HydrophobicContact CG2-CD1 4.07Å; I372-L387 HydrophobicContact CG2-CD2 4.1Å; V375-L387 HydrophobicContact CB-CD1 3.73Å; V375-L387 HydrophobicContact CG1-CD1 3.53Å; L376-L387 HydrophobicContact CD2-CB 4.12Å; L376-L387 HydrophobicContact CD2-CD1 4.31Å; L376-L387 HydrophobicContact CG-CD1 4.12Å; D383-L387 WeakPolarHBondContact O-CG 3.48Å; D383-L387 PolarHBondContact O-N 2.87Å; K384-L387 PolarHBondContact O-N 3.29Å; L387-S390 PolarHBondContact O-N 2.87Å; L387-V391 PolarHBondContact O-N 2.69Å
388I98.7Very high98Very high3 Ų354.4 Ų54.42%0.01529%0.288CS..Hα-helixtrans-64.6-39.7175.5-74.8161.3000111.4L376 K384 I386 S390 V391 R392 C411 A415 E419 L423L376-I388 HydrophobicContact CD2-CG1 4.25Å; K384-I388 HydrophobicContact CB-CD1 4.47Å; K384-I388 VanDerWaalsContact O-CB 3.32Å; K384-I388 WeakPolarHBondContact O-CB 3.07Å; K384-I388 VanDerWaalsContact O-CD1 3.29Å; K384-I388 WeakPolarHBondContact O-CD1 3.25Å; K384-I388 WeakPolarHBondContact O-CG1 3.49Å; K384-I388 PolarHBondContact O-N 2.99Å; I386-I388 VanDerWaalsContact C-N 3.33Å; I386-I388 PolarHBondContact O-N 2.97Å; I388-S390 VanDerWaalsContact C-N 3.3Å; I388-S390 PolarHBondContact O-N 2.95Å; I388-V391 PolarHBondContact O-N 3.45Å; I388-V391 VanDerWaalsContact O-N 3.14Å; I388-R392 PolarHBondContact O-N 3.45Å; I388-C411 HydrophobicContact CG1-CB 4.2Å; I388-A415 HydrophobicContact CD1-CB 3.61Å; I388-E419 HydrophobicContact CD1-CB 4.47Å; I388-E419 HydrophobicContact CG2-CB 4.1Å; I388-E419 HydrophobicContact CG2-CG 4.12Å; I388-L423 HydrophobicContact CG2-CD1 4.2Å
389N98.4Very high98.1Very high94 Ų9448.1 Ų48.150%0.50326%0.259SS..Hα-helixtrans-64.5-34.5177.2-76.7-42.5000112.1S385 I386 V391 R392S385-N389 WeakPolarHBondContact O-CB 3.45Å; S385-N389 VanDerWaalsContact O-CG 3.29Å; S385-N389 PolarHBondContact O-N 3.39Å; S385-N389 PolarHBondContact O-ND2 3.36Å; I386-N389 WeakPolarHBondContact O-CB 3.3Å; I386-N389 PolarHBondContact O-N 3.37Å; I386-N389 VanDerWaalsContact O-N 3.1Å; N389-V391 VanDerWaalsContact C-N 3.27Å; N389-V391 PolarHBondContact O-N 2.89Å; N389-R392 PolarHBondContact O-N 3.48Å
390S98.3Very high98.1Very high25 Ų2550.1 Ų50.118%0.17526%0.261CS..Hα-helixtrans-68-22.8173.6-56.20000114.2T359 I386 L387 I388 K394T359-S390 VanDerWaalsContact CG2-CB 3.46Å; T359-S390 WeakPolarHBondContact CG2-OG 3.38Å; I386-S390 PolarHBondContact O-N 2.72Å; I386-S390 PolarHBondContact O-OG 3.44Å; L387-S390 PolarHBondContact O-N 2.87Å; I388-S390 VanDerWaalsContact C-N 3.3Å; I388-S390 PolarHBondContact O-N 2.95Å; S390-K394 WeakPolarHBondContact O-CD 3.23Å; S390-K394 WeakPolarHBondContact O-CE 3.29Å; S390-K394 PolarHBondContact O-NZ 3.42Å
391V98.4Very high98.2Very high0 Ų048.9 Ų48.90%026%0.256CS..Hα-helixtrans-86.8-28.2176.6170.50000112.5I363 L387 I388 N389 K394 V395 L398 V408 L423I363-V391 HydrophobicContact CD1-CG2 3.74Å; L387-V391 PolarHBondContact O-N 2.69Å; I388-V391 PolarHBondContact O-N 3.45Å; I388-V391 VanDerWaalsContact O-N 3.14Å; N389-V391 VanDerWaalsContact C-N 3.27Å; N389-V391 PolarHBondContact O-N 2.89Å; V391-K394 WeakPolarHBondContact O-CB 3.4Å; V391-K394 PolarHBondContact O-N 2.71Å; V391-K394 VanDerWaalsContact O-N 3.12Å; V391-V395 HydrophobicContact CG1-CG2 4.18Å; V391-V395 PolarHBondContact O-N 3.48Å; V391-L398 HydrophobicContact CB-CD1 4.27Å; V391-L398 HydrophobicContact CG1-CD1 4.16Å; V391-L398 HydrophobicContact CG2-CD1 4.08Å; V391-V408 HydrophobicContact CG1-CG2 4.09Å; V391-L423 HydrophobicContact CG1-CD2 4.22Å
392R97.3Very high98.2Very high159 Ų15950.1 Ų50.160%0.626%0.26SS*.THydrogen-bonded Turntrans-62.9140.1-179.5-169.6176.9179.7-178-1.9111.9I388 N389 K394 L423I388-R392 PolarHBondContact O-N 3.45Å; N389-R392 PolarHBondContact O-N 3.48Å; R392-K394 PolarHBondContact O-N 3.16Å; R392-L423 HydrophobicContact CB-CD2 4.48Å
393G96.1Very high98.2Very high64 Ų6447.1 Ų47.166%0.6625%0.245SC*.THydrogen-bonded Turntrans76.3-4.2-171.900000114.4E426G393-E426 VanDerWaalsContact CA-OE1 3.31Å; G393-E426 WeakPolarHBondContact CA-OE1 3.3Å; G393-E426 VanDerWaalsContact N-CD 3.29Å; G393-E426 PolarHBondContact N-OE1 3.17Å; G393-E426 PolarHBondContact N-OE2 3.39Å
394K97.5Very high98.2Very high64 Ų6446.8 Ų46.828%0.27824%0.244SC..  trans-125.75.3-174.4-51.8176.2-161.5160.60112.6E360 S390 V391 R392 L396 V397 L398 E426E360-K394 IonicContact OE1-NZ 2.71Å; E360-K394 PolarHBondContact OE1-NZ 2.92Å; E360-K394 IonicContact OE2-NZ 2.76Å; E360-K394 PolarHBondContact OE2-NZ 3.3Å; S390-K394 WeakPolarHBondContact O-CD 3.23Å; S390-K394 WeakPolarHBondContact O-CE 3.29Å; S390-K394 PolarHBondContact O-NZ 3.42Å; V391-K394 WeakPolarHBondContact O-CB 3.4Å; V391-K394 PolarHBondContact O-N 2.71Å; V391-K394 VanDerWaalsContact O-N 3.12Å; R392-K394 PolarHBondContact O-N 3.16Å; K394-L396 VanDerWaalsContact C-N 3.31Å; K394-L396 PolarHBondContact O-N 3.1Å; K394-V397 PolarHBondContact O-N 3.46Å; K394-L398 HydrophobicContact CB-CD1 3.81Å; K394-L398 HydrophobicContact CB-CG 4.04Å; K394-L398 PolarHBondContact O-N 3.29Å; K394-E426 PolarHBondContact N-OE1 2.75Å; K394-E426 VanDerWaalsContact N-OE1 3.13Å
395V98.1Very high98.2Very high0 Ų045.9 Ų45.90%024%0.24CC..Hα-helixtrans-56.8-43.7-169.9176.40000111.4V391 V397 S399 V408 L423 E426 V427 M451V391-V395 HydrophobicContact CG1-CG2 4.18Å; V391-V395 PolarHBondContact O-N 3.48Å; V395-V397 PolarHBondContact O-N 2.81Å; V395-S399 WeakPolarHBondContact O-CB 3.23Å; V395-S399 PolarHBondContact O-N 3.06Å; V395-S399 PolarHBondContact O-OG 3.4Å; V395-V408 HydrophobicContact CG1-CG1 4.03Å; V395-L423 HydrophobicContact CG2-CB 4.48Å; V395-L423 HydrophobicContact CG2-CD2 3.67Å; V395-E426 VanDerWaalsContact CB-OE1 3.24Å; V395-E426 WeakPolarHBondContact CB-OE1 3.49Å; V395-E426 VanDerWaalsContact CG2-OE1 3.27Å; V395-E426 WeakPolarHBondContact CG2-OE1 3.14Å; V395-E426 PolarHBondContact N-OE1 2.8Å; V395-V427 HydrophobicContact CB-CG1 4.04Å; V395-V427 HydrophobicContact CG1-CG1 3.62Å; V395-M451 HydrophobicContact CG1-CE 3.79Å
396L97.3Very high98.3Very high36 Ų3647.1 Ų47.119%0.18825%0.245CC..Hα-helixtrans-59.4-41.9177.6173.360.7000112.8K394 Q400 A434 V437 M438K394-L396 VanDerWaalsContact C-N 3.31Å; K394-L396 PolarHBondContact O-N 3.1Å; L396-Q400 PolarHBondContact O-NE2 3.48Å; L396-A434 HydrophobicContact CB-CB 4.46Å; L396-A434 HydrophobicContact CD1-CB 4.05Å; L396-A434 HydrophobicContact CD2-CB 3.92Å; L396-A434 HydrophobicContact CG-CB 4.36Å; L396-V437 HydrophobicContact CD1-CB 4.34Å; L396-V437 HydrophobicContact CD1-CG1 4.22Å; L396-M438 HydrophobicContact CD1-CG 3.55Å; L396-M438 HydrophobicContact CD1-SD 4.08Å
397V97.9Very high98.3Very high99 Ų9943.6 Ų43.660%0.623%0.227SC*.Hα-helixtrans-76.4-49.8-176-179.40000110.2K394 V395 S399 Q400K394-V397 PolarHBondContact O-N 3.46Å; V395-V397 PolarHBondContact O-N 2.81Å; V397-S399 VanDerWaalsContact C-N 3.28Å; V397-S399 PolarHBondContact O-N 3.35Å; V397-Q400 PolarHBondContact O-N 3.05Å; V397-Q400 VanDerWaalsContact O-N 3.09Å
398L98.7Very high98.3Very high8 Ų843.5 Ų43.54%0.04223%0.226CC..Hα-helixtrans-63.7-33.9-179.4-64.4175.5000112.1I363 Q364 V391 K394 Q400 H401 A404 S405 V408I363-L398 HydrophobicContact CG2-CD1 4.31Å; I363-L398 HydrophobicContact CG2-CD2 4.02Å; Q364-L398 HydrophobicContact CG-CD2 4.06Å; V391-L398 HydrophobicContact CB-CD1 4.27Å; V391-L398 HydrophobicContact CG1-CD1 4.16Å; V391-L398 HydrophobicContact CG2-CD1 4.08Å; K394-L398 HydrophobicContact CB-CD1 3.81Å; K394-L398 HydrophobicContact CB-CG 4.04Å; K394-L398 PolarHBondContact O-N 3.29Å; L398-Q400 VanDerWaalsContact C-N 3.25Å; L398-Q400 PolarHBondContact O-N 3.23Å; L398-H401 PolarHBondContact O-N 3.3Å; L398-H401 VanDerWaalsContact O-N 3.12Å; L398-A404 HydrophobicContact CB-CB 4.02Å; L398-A404 HydrophobicContact CD2-CB 3.9Å; L398-A404 CarbonylContact O-C 3.58Å; L398-S405 PolarHBondContact O-N 3.42Å; L398-V408 HydrophobicContact CB-CG2 3.73Å
399S98.7Very high98.3Very high0 Ų045 Ų450%023%0.233CC..Hα-helixtrans-63.2-29.3175.1-61.20000113.6V395 V397 H401 S405 M438 Y443 A444V395-S399 WeakPolarHBondContact O-CB 3.23Å; V395-S399 PolarHBondContact O-N 3.06Å; V395-S399 PolarHBondContact O-OG 3.4Å; V397-S399 VanDerWaalsContact C-N 3.28Å; V397-S399 PolarHBondContact O-N 3.35Å; S399-H401 VanDerWaalsContact C-N 3.29Å; S399-S405 WeakPolarHBondContact O-CB 3.44Å; S399-M438 WeakPolarHBondContact OG-CE 3.26Å; S399-Y443 CarbonylContact O-C 3.59Å; S399-A444 WeakPolarHBondContact O-CA 3.45Å; S399-A444 WeakPolarHBondContact O-CB 3.5Å; S399-A444 PolarHBondContact O-N 3.46Å
400Q98.4Very high98.3Very high71 Ų7142.9 Ų42.933%0.33222%0.219SC..THydrogen-bonded Turntrans-860.4178.3-68.7171.396.800112.6L396 V397 L398 D441 Y443 A444L396-Q400 PolarHBondContact O-NE2 3.48Å; V397-Q400 PolarHBondContact O-N 3.05Å; V397-Q400 VanDerWaalsContact O-N 3.09Å; L398-Q400 VanDerWaalsContact C-N 3.25Å; L398-Q400 PolarHBondContact O-N 3.23Å; Q400-D441 HydrophobicContact CG-CB 4.18Å; Q400-Y443 WeakPolarHBondContact O-CD2 3.3Å; Q400-A444 HydrophobicContact CG-CB 3.97Å
401H98.8Very high98.3Very high66 Ų6641.7 Ų41.731%0.30621%0.211SC..SBendtrans-103.6127.8-178.9-173.6-114.7000111.8Q364 L398 S399 F403 A404 S405Q364-H401 PolarHBondContact O-CE1 3.29Å; Q364-H401 VanDerWaalsContact O-CE1 3.29Å; L398-H401 PolarHBondContact O-N 3.3Å; L398-H401 VanDerWaalsContact O-N 3.12Å; S399-H401 VanDerWaalsContact C-N 3.29Å; H401-F403 AromaticContact CE1-CD2 3.89Å; H401-F403 PolarHBondContact O-N 3.21Å; H401-A404 HydrophobicContact CB-CB 4.14Å; H401-A404 PolarHBondContact O-N 3.35Å; H401-A404 VanDerWaalsContact O-N 3.16Å; H401-S405 WeakPolarHBondContact O-CB 3.23Å; H401-S405 PolarHBondContact O-N 3.39Å; H401-S405 PolarHBondContact O-OG 3.11Å
402K98.4Very high98.3Very high113 Ų11341.7 Ų41.749%0.49121%0.211SC..THydrogen-bonded Turntrans-47.4-38.4-170.3-179.4174.6178.7178.90115.5N406 Y443K402-N406 PolarHBondContact O-ND2 3.09Å; K402-Y443 HydrophobicContact CB-CD1 4.4Å; K402-Y443 HydrophobicContact CB-CD2 4.36Å; K402-Y443 HydrophobicContact CB-CE1 3.88Å; K402-Y443 HydrophobicContact CB-CE2 3.84Å; K402-Y443 HydrophobicContact CD-CE1 4.38Å; K402-Y443 HydrophobicContact CG-CD1 4.45Å; K402-Y443 HydrophobicContact CG-CE1 3.72Å
403F98.7Very high98.4Very high51 Ų5136.5 Ų36.522%0.22420%0.197CC..THydrogen-bonded Turntrans-95.8-40.9-177.8-57-59000111.9Q364 Q366 N369 H401 S405 N406Q364-F403 WeakPolarHBondContact O-CD2 2.98Å; Q366-F403 HydrophobicContact CB-CD1 4.38Å; Q366-F403 HydrophobicContact CB-CD2 4.23Å; Q366-F403 HydrophobicContact CB-CE1 3.84Å; Q366-F403 HydrophobicContact CB-CE2 3.66Å; Q366-F403 HydrophobicContact CB-CZ 3.44Å; Q366-F403 VanDerWaalsContact CB-CZ 3.44Å; N369-F403 HydrophobicContact CB-CB 4.12Å; H401-F403 AromaticContact CE1-CD2 3.89Å; H401-F403 PolarHBondContact O-N 3.21Å; F403-S405 PolarHBondContact O-N 2.86Å; F403-N406 PolarHBondContact O-N 3.23Å; F403-N406 PolarHBondContact O-ND2 3Å
404A98.8Very high98.5Very high0 Ų036.3 Ų36.30%018%0.179CC..Hα-helixtrans-74.1-23.7-176.500000113.4I363 Q364 L398 H401 N406 V407 V408I363-A404 HydrophobicContact CG2-CB 3.58Å; I363-A404 WeakPolarHBondContact O-CA 3.43Å; I363-A404 WeakPolarHBondContact O-CB 3.23Å; Q364-A404 HydrophobicContact CG-CB 4.25Å; L398-A404 HydrophobicContact CB-CB 4.02Å; L398-A404 HydrophobicContact CD2-CB 3.9Å; L398-A404 CarbonylContact O-C 3.58Å; H401-A404 HydrophobicContact CB-CB 4.14Å; H401-A404 PolarHBondContact O-N 3.35Å; H401-A404 VanDerWaalsContact O-N 3.16Å; A404-N406 PolarHBondContact O-N 2.86Å; A404-V407 WeakPolarHBondContact O-CA 3.34Å; A404-V407 WeakPolarHBondContact O-CB 3.37Å; A404-V407 PolarHBondContact O-N 3.17Å; A404-V408 WeakPolarHBondContact O-CG2 3.15Å; A404-V408 PolarHBondContact O-N 3.01Å
405S98.8Very high98.5Very high4 Ų433.6 Ų33.63%0.02817%0.168CC..Hα-helixtrans-56-39.4174.763.30000112L398 S399 H401 F403 V408 E409L398-S405 PolarHBondContact O-N 3.42Å; S399-S405 WeakPolarHBondContact O-CB 3.44Å; H401-S405 WeakPolarHBondContact O-CB 3.23Å; H401-S405 PolarHBondContact O-N 3.39Å; H401-S405 PolarHBondContact O-OG 3.11Å; F403-S405 PolarHBondContact O-N 2.86Å; S405-V408 PolarHBondContact O-N 3.38Å; S405-E409 PolarHBondContact O-N 2.86Å
406N98.8Very high98.6Very high56 Ų5636.3 Ų36.330%0.29919%0.185SC..Hα-helixtrans-66.4-39.3177.1-43.4-78.6000111K402 F403 A404 E409 K410K402-N406 PolarHBondContact O-ND2 3.09Å; F403-N406 PolarHBondContact O-N 3.23Å; F403-N406 PolarHBondContact O-ND2 3Å; A404-N406 PolarHBondContact O-N 2.86Å; N406-E409 WeakPolarHBondContact O-CB 3.13Å; N406-E409 PolarHBondContact O-N 3.41Å; N406-K410 PolarHBondContact O-N 2.85Å
407V98.9Very high98.6Very high0 Ų042.7 Ų42.70%021%0.206CC..Hα-helixtrans-62.3-46.3173-172.90000110.8I363 N369 I372 Q373 L376 A404 E409 K410 C411I363-V407 HydrophobicContact CG1-CG1 4.2Å; I363-V407 HydrophobicContact CG2-CB 4.4Å; I363-V407 HydrophobicContact CG2-CG2 4.35Å; N369-V407 HydrophobicContact CB-CG2 3.98Å; I372-V407 HydrophobicContact CG2-CG1 3.71Å; Q373-V407 HydrophobicContact CG-CG2 4.14Å; L376-V407 HydrophobicContact CD1-CG1 3.68Å; A404-V407 WeakPolarHBondContact O-CA 3.34Å; A404-V407 WeakPolarHBondContact O-CB 3.37Å; A404-V407 PolarHBondContact O-N 3.17Å; V407-E409 VanDerWaalsContact C-N 3.28Å; V407-E409 PolarHBondContact O-N 3.3Å; V407-K410 CarbonylContact O-C 3.6Å; V407-K410 PolarHBondContact O-N 2.94Å; V407-C411 PolarHBondContact O-N 3.09Å; V407-C411 PolarHBondContact O-SG 3.14Å; V407-C411 VanDerWaalsContact O-SG 3.36Å
408V98.9Very high98.6Very high0 Ų040.6 Ų40.60%021%0.205CC..Hα-helixtrans-60.8-38.2177-177.50000111.1V391 V395 L398 A404 S405 C411 V412 V447V391-V408 HydrophobicContact CG1-CG2 4.09Å; V395-V408 HydrophobicContact CG1-CG1 4.03Å; L398-V408 HydrophobicContact CB-CG2 3.73Å; A404-V408 WeakPolarHBondContact O-CG2 3.15Å; A404-V408 PolarHBondContact O-N 3.01Å; S405-V408 PolarHBondContact O-N 3.38Å; V408-C411 PolarHBondContact O-N 3.31Å; V408-V412 PolarHBondContact O-N 2.75Å; V408-V447 HydrophobicContact CB-CG1 4.31Å; V408-V447 HydrophobicContact CB-CG2 4.36Å; V408-V447 HydrophobicContact CG1-CG1 3.58Å; V408-V447 HydrophobicContact CG1-CG2 4.49Å
409E98.8Very high98.6Very high36 Ų3641.9 Ų41.917%0.16821%0.211CC..Hα-helixtrans-61.3-42.9171.6-75.9-164.6-126.100112.9S405 N406 V407 V412 T413 Y446 V447 K450S405-E409 PolarHBondContact O-N 2.86Å; N406-E409 WeakPolarHBondContact O-CB 3.13Å; N406-E409 PolarHBondContact O-N 3.41Å; V407-E409 VanDerWaalsContact C-N 3.28Å; V407-E409 PolarHBondContact O-N 3.3Å; E409-V412 WeakPolarHBondContact O-CG2 3.32Å; E409-T413 WeakPolarHBondContact O-CB 3.3Å; E409-T413 PolarHBondContact O-N 2.84Å; E409-T413 VanDerWaalsContact O-N 3.11Å; E409-T413 PolarHBondContact O-OG1 2.89Å; E409-Y446 VanDerWaalsContact OE1-CB 3.26Å; E409-Y446 WeakPolarHBondContact OE1-CB 3.47Å; E409-V447 HydrophobicContact CG-CG2 4.14Å; E409-K450 HydrophobicContact CB-CB 4.4Å; E409-K450 HydrophobicContact CB-CG 4.1Å; E409-K450 HydrophobicContact CG-CB 3.75Å; E409-K450 HydrophobicContact CG-CG 4.02Å; E409-K450 WeakPolarHBondContact OE2-CE 3.06Å; E409-K450 IonicContact OE2-NZ 3.98Å
410K98.8Very high98.6Very high48 Ų4843.5 Ų43.521%0.20922%0.217CC..Hα-helixtrans-66.1-42.4173.7-61-58.2174.3145.20111.5Q373 L376 E377 N406 V407 V412 T413 H414Q373-K410 HydrophobicContact CB-CG 3.92Å; Q373-K410 HydrophobicContact CG-CB 4.41Å; Q373-K410 HydrophobicContact CG-CG 3.58Å; L376-K410 HydrophobicContact CB-CB 4Å; L376-K410 HydrophobicContact CD1-CB 3.86Å; E377-K410 HydrophobicContact CG-CD 4Å; E377-K410 IonicContact OE1-NZ 3.86Å; E377-K410 PolarHBondContact OE1-NZ 3Å; E377-K410 IonicContact OE2-NZ 4Å; E377-K410 PolarHBondContact OE2-NZ 3.45Å; N406-K410 PolarHBondContact O-N 2.85Å; V407-K410 CarbonylContact O-C 3.6Å; V407-K410 PolarHBondContact O-N 2.94Å; K410-V412 PolarHBondContact O-N 3.03Å; K410-T413 PolarHBondContact O-N 3.11Å; K410-H414 PolarHBondContact O-CD2 2.89Å; K410-H414 VanDerWaalsContact O-CD2 3.27Å; K410-H414 PolarHBondContact O-N 3.42Å
411C98.8Very high98.5Very high0 Ų041.8 Ų41.80%021%0.211CC..Hα-helixtrans-54.5-54.2175.6-70.30000111.1L376 I388 V407 V408 T413 H414 A415 L423L376-C411 VanDerWaalsContact CD1-SG 3.54Å; I388-C411 HydrophobicContact CG1-CB 4.2Å; V407-C411 PolarHBondContact O-N 3.09Å; V407-C411 PolarHBondContact O-SG 3.14Å; V407-C411 VanDerWaalsContact O-SG 3.36Å; V408-C411 PolarHBondContact O-N 3.31Å; C411-T413 PolarHBondContact O-N 3.01Å; C411-H414 PolarHBondContact O-N 3.49Å; C411-A415 WeakPolarHBondContact O-CB 3.46Å; C411-A415 PolarHBondContact O-N 3.18Å; C411-L423 HydrophobicContact CB-CD1 3.9Å
412V98.4Very high98.4Very high0 Ų039.9 Ų39.90%021%0.209CC..Hα-helixtrans-67.9-19.7179.3-58.40000113.5V408 E409 K410 R420 L423 K450 M451 V454V408-V412 PolarHBondContact O-N 2.75Å; E409-V412 WeakPolarHBondContact O-CG2 3.32Å; K410-V412 PolarHBondContact O-N 3.03Å; V412-R420 VanDerWaalsContact O-CD 3.25Å; V412-R420 WeakPolarHBondContact O-CD 3.41Å; V412-L423 HydrophobicContact CG1-CB 4.07Å; V412-L423 HydrophobicContact CG1-CD1 4.06Å; V412-K450 HydrophobicContact CG2-CB 4.37Å; V412-K450 HydrophobicContact CG2-CG 3.65Å; V412-M451 HydrophobicContact CG1-CE 4.11Å; V412-M451 HydrophobicContact CG1-CG 4.31Å; V412-M451 HydrophobicContact CG2-CG 4.42Å; V412-V454 HydrophobicContact CB-CG2 4.08Å; V412-V454 HydrophobicContact CG2-CG2 4.03Å; V412-V454 WeakPolarHBondContact O-CG2 3.36Å
413T98.6Very high98.4Very high51 Ų5134.6 Ų34.631%0.31319%0.186SC..Hα-helixtrans-82.2-43.9177.2-55.30000112.8E409 K410 C411 K450E409-T413 WeakPolarHBondContact O-CB 3.3Å; E409-T413 PolarHBondContact O-N 2.84Å; E409-T413 VanDerWaalsContact O-N 3.11Å; E409-T413 PolarHBondContact O-OG1 2.89Å; K410-T413 PolarHBondContact O-N 3.11Å; C411-T413 PolarHBondContact O-N 3.01Å; T413-K450 WeakPolarHBondContact OG1-CD 3.49Å
414H98.4Very high98.2Very high59 Ų5932.2 Ų32.227%0.27318%0.176SC..Hα-helixtrans-106.6-3.7-170.1-59.1-80.9000114.3L376 E377 K410 C411L376-H414 WeakPolarHBondContact O-CB 3.28Å; E377-H414 IonicContact OE1-NE2 3.84Å; K410-H414 PolarHBondContact O-CD2 2.89Å; K410-H414 VanDerWaalsContact O-CD2 3.27Å; K410-H414 PolarHBondContact O-N 3.42Å; C411-H414 PolarHBondContact O-N 3.49Å
415A98.2Very high98Very high7 Ų733.3 Ų33.36%0.05818%0.182CC..SBendtrans-61.6153.5169.600000113.5I388 C411 E419 R420I388-A415 HydrophobicContact CD1-CB 3.61Å; C411-A415 WeakPolarHBondContact O-CB 3.46Å; C411-A415 PolarHBondContact O-N 3.18Å; A415-E419 HydrophobicContact CB-CB 3.74Å; A415-R420 HydrophobicContact CB-CB 4.06Å; A415-R420 PolarHBondContact O-NH1 3.31Å
416T98.5Very high97.9Very high58 Ų5834.8 Ų34.836%0.35619%0.188SC..  trans-60.5165.5164.4660000111.4Q381 G418 E419 R420Q381-T416 HydrophobicContact CG-CG2 4.43Å; T416-G418 VanDerWaalsContact C-N 3.26Å; T416-G418 PolarHBondContact O-N 3.17Å; T416-E419 VanDerWaalsContact CB-OE2 3.25Å; T416-E419 WeakPolarHBondContact CB-OE2 3.41Å; T416-E419 VanDerWaalsContact CG2-OE2 3.27Å; T416-E419 WeakPolarHBondContact CG2-OE2 3.48Å; T416-E419 PolarHBondContact N-OE2 2.97Å; T416-E419 PolarHBondContact O-N 2.84Å; T416-E419 VanDerWaalsContact OG1-CD 3.24Å; T416-E419 WeakPolarHBondContact OG1-CG 3.46Å; T416-E419 PolarHBondContact OG1-N 3.03Å; T416-E419 PolarHBondContact OG1-OE2 3.44Å; T416-R420 VanDerWaalsContact O-CB 3.31Å; T416-R420 WeakPolarHBondContact O-CB 3.3Å; T416-R420 PolarHBondContact O-N 2.91Å
417R97.9Very high97.6Very high169 Ų16932.2 Ų32.264%0.63818%0.175SC*.Hα-helixtrans-57.3-37.5179.8-58.1-178.363.5-160.4-2.8113T421 E456R417-T421 WeakPolarHBondContact O-CB 3.48Å; R417-T421 PolarHBondContact O-N 3.45Å; R417-T421 VanDerWaalsContact O-N 3.13Å; R417-T421 PolarHBondContact O-OG1 3.09Å; R417-E456 WeakPolarHBondContact CG-OE1 3.42Å; R417-E456 IonicContact CZ-OE1 3.48Å; R417-E456 IonicContact CZ-OE2 2.79Å; R417-E456 VanDerWaalsContact CZ-OE2 3.3Å; R417-E456 IonicContact NE-OE1 3.98Å; R417-E456 PolarHBondContact NE-OE1 2.86Å; R417-E456 IonicContact NE-OE2 2.69Å; R417-E456 PolarHBondContact NE-OE2 3.36Å; R417-E456 VanDerWaalsContact NE-OE2 3.1Å; R417-E456 IonicContact NH2-OE2 2.69Å; R417-E456 PolarHBondContact NH2-OE2 3.32Å
418G98Very high97Very high55 Ų5532.5 Ų32.557%0.56718%0.177SC*.Hα-helixtrans-72.1-49.2179.100000112.6T416 T421 G422T416-G418 VanDerWaalsContact C-N 3.26Å; T416-G418 PolarHBondContact O-N 3.17Å; G418-T421 WeakPolarHBondContact O-CB 3.33Å; G418-T421 PolarHBondContact O-N 3Å; G418-G422 PolarHBondContact O-N 3.48Å
419E98.4Very high96.1Very high35 Ų3535.8 Ų35.816%0.16420%0.197CC..Hα-helixtrans-59.4-49.8176.2-73.5163.9144.100112.1S385 I388 A415 T416 T421 G422 L423S385-E419 WeakPolarHBondContact CA-OE1 3.49Å; S385-E419 WeakPolarHBondContact CB-OE1 3.33Å; S385-E419 PolarHBondContact OG-OE1 3.46Å; I388-E419 HydrophobicContact CD1-CB 4.47Å; I388-E419 HydrophobicContact CG2-CB 4.1Å; I388-E419 HydrophobicContact CG2-CG 4.12Å; A415-E419 HydrophobicContact CB-CB 3.74Å; T416-E419 VanDerWaalsContact CB-OE2 3.25Å; T416-E419 WeakPolarHBondContact CB-OE2 3.41Å; T416-E419 VanDerWaalsContact CG2-OE2 3.27Å; T416-E419 WeakPolarHBondContact CG2-OE2 3.48Å; T416-E419 PolarHBondContact N-OE2 2.97Å; T416-E419 PolarHBondContact O-N 2.84Å; T416-E419 VanDerWaalsContact OG1-CD 3.24Å; T416-E419 WeakPolarHBondContact OG1-CG 3.46Å; T416-E419 PolarHBondContact OG1-N 3.03Å; T416-E419 PolarHBondContact OG1-OE2 3.44Å; E419-T421 VanDerWaalsContact C-N 3.27Å; E419-T421 PolarHBondContact O-N 3.41Å; E419-G422 PolarHBondContact O-N 2.9Å; E419-L423 WeakPolarHBondContact O-CG 3.49Å; E419-L423 PolarHBondContact O-N 3.26Å
420R98.4Very high94.6Very high35 Ų3542 Ų4213%0.13222%0.224CC..Hα-helixtrans-56.8-41.8175.5175173.455.7-99.50.8111.4V412 A415 T416 I424 V454 E456V412-R420 VanDerWaalsContact O-CD 3.25Å; V412-R420 WeakPolarHBondContact O-CD 3.41Å; A415-R420 HydrophobicContact CB-CB 4.06Å; A415-R420 PolarHBondContact O-NH1 3.31Å; T416-R420 VanDerWaalsContact O-CB 3.31Å; T416-R420 WeakPolarHBondContact O-CB 3.3Å; T416-R420 PolarHBondContact O-N 2.91Å; R420-I424 HydrophobicContact CG-CD1 3.68Å; R420-I424 WeakPolarHBondContact O-CD1 3.43Å; R420-I424 VanDerWaalsContact O-CG1 3.27Å; R420-I424 WeakPolarHBondContact O-CG1 3.22Å; R420-I424 PolarHBondContact O-N 3.45Å; R420-I424 VanDerWaalsContact O-N 3.16Å; R420-V454 VanDerWaalsContact CD-O 3.28Å; R420-V454 WeakPolarHBondContact CD-O 3.29Å; R420-V454 PolarHBondContact NE-O 2.78Å; R420-E456 IonicContact CZ-OE1 2.74Å; R420-E456 IonicContact NH2-OE1 3.1Å; R420-E456 PolarHBondContact NH2-OE1 3.4Å
421T97.4Very high93.2Very high34 Ų3443.3 Ų43.321%0.20923%0.233CC..Hα-helixtrans-60.4-46.8175-67.20000111.3R417 G418 E419 I424 D425 Q459R417-T421 WeakPolarHBondContact O-CB 3.48Å; R417-T421 PolarHBondContact O-N 3.45Å; R417-T421 VanDerWaalsContact O-N 3.13Å; R417-T421 PolarHBondContact O-OG1 3.09Å; G418-T421 WeakPolarHBondContact O-CB 3.33Å; G418-T421 PolarHBondContact O-N 3Å; E419-T421 VanDerWaalsContact C-N 3.27Å; E419-T421 PolarHBondContact O-N 3.41Å; T421-I424 PolarHBondContact O-N 3.41Å; T421-D425 WeakPolarHBondContact O-CB 3.33Å; T421-D425 PolarHBondContact O-N 2.85Å; T421-Q459 HydrophobicContact CG2-CG 4.17Å; T421-Q459 PolarHBondContact OG1-NE2 3.19Å
422G96.6Very high91.7Very high26 Ų2648.8 Ų48.827%0.26826%0.262SS..Hα-helixtrans-59-48.617800000113.3G418 E419 I424 D425 E426G418-G422 PolarHBondContact O-N 3.48Å; E419-G422 PolarHBondContact O-N 2.9Å; G422-I424 VanDerWaalsContact C-N 3.31Å; G422-I424 PolarHBondContact O-N 3.19Å; G422-D425 PolarHBondContact O-N 3.25Å; G422-E426 PolarHBondContact O-N 3.39Å
423L97.4Very high91.1Very high2 Ų253 Ų531%0.0128%0.284CS..Hα-helixtrans-63.2-33.4179.9-65174.7000113.2I388 V391 R392 V395 C411 V412 E419I388-L423 HydrophobicContact CG2-CD1 4.2Å; V391-L423 HydrophobicContact CG1-CD2 4.22Å; R392-L423 HydrophobicContact CB-CD2 4.48Å; V395-L423 HydrophobicContact CG2-CB 4.48Å; V395-L423 HydrophobicContact CG2-CD2 3.67Å; C411-L423 HydrophobicContact CB-CD1 3.9Å; V412-L423 HydrophobicContact CG1-CB 4.07Å; V412-L423 HydrophobicContact CG1-CD1 4.06Å; E419-L423 WeakPolarHBondContact O-CG 3.49Å; E419-L423 PolarHBondContact O-N 3.26Å
424I96.1Very high90.8Very high1 Ų150.6 Ų50.61%0.00527%0.27CS..Hα-helixtrans-80.3-38.9177.9-64.3167.7000110.8R420 T421 G422 E426 V427 C428 M451 Q459 L463R420-I424 HydrophobicContact CG-CD1 3.68Å; R420-I424 WeakPolarHBondContact O-CD1 3.43Å; R420-I424 VanDerWaalsContact O-CG1 3.27Å; R420-I424 WeakPolarHBondContact O-CG1 3.22Å; R420-I424 PolarHBondContact O-N 3.45Å; R420-I424 VanDerWaalsContact O-N 3.16Å; T421-I424 PolarHBondContact O-N 3.41Å; G422-I424 VanDerWaalsContact C-N 3.31Å; G422-I424 PolarHBondContact O-N 3.19Å; I424-E426 VanDerWaalsContact C-N 3.33Å; I424-E426 PolarHBondContact O-N 2.67Å; I424-V427 WeakPolarHBondContact O-CG2 3.47Å; I424-V427 PolarHBondContact O-N 3.21Å; I424-C428 WeakPolarHBondContact O-CB 3.46Å; I424-C428 PolarHBondContact O-N 3.03Å; I424-C428 PolarHBondContact O-SG 2.76Å; I424-M451 HydrophobicContact CG1-CB 4.32Å; I424-M451 HydrophobicContact CG1-CE 4.39Å; I424-M451 HydrophobicContact CG1-CG 3.97Å; I424-M451 HydrophobicContact CG1-SD 4.23Å; I424-Q459 HydrophobicContact CG2-CB 4.15Å; I424-L463 HydrophobicContact CG2-CD1 3.97Å; I424-L463 HydrophobicContact CG2-CD2 4.48Å; I424-L463 HydrophobicContact CG2-CG 4.1Å
425D94.7Very high90.6Very high24 Ų2448 Ų4813%0.12826%0.258CS..Hα-helixtrans-68.6-30.8177.8-82.3-15.2000112.7T421 G422 V427 C428 T429 K462T421-D425 WeakPolarHBondContact O-CB 3.33Å; T421-D425 PolarHBondContact O-N 2.85Å; G422-D425 PolarHBondContact O-N 3.25Å; D425-V427 VanDerWaalsContact C-N 3.31Å; D425-V427 PolarHBondContact O-N 3.09Å; D425-C428 PolarHBondContact O-N 3.31Å; D425-T429 WeakPolarHBondContact O-CA 3.48Å; D425-T429 VanDerWaalsContact O-CB 3.29Å; D425-T429 WeakPolarHBondContact O-CB 3.25Å; D425-T429 PolarHBondContact O-N 2.72Å; D425-T429 PolarHBondContact O-OG1 2.86Å; D425-K462 WeakPolarHBondContact OD1-CD 3.33Å; D425-K462 WeakPolarHBondContact OD1-CE 3.3Å; D425-K462 IonicContact OD1-NZ 3.86Å; D425-K462 PolarHBondContact OD1-NZ 3.42Å; D425-K462 IonicContact OD2-NZ 2.68Å; D425-K462 PolarHBondContact OD2-NZ 3.43Å
426E95Very high90.4Very high34 Ų3449.2 Ų49.216%0.15926%0.263CS..Iπ-helixtrans-48.9-50.5172-171.9174.3133.600111.9G393 K394 V395 G422 I424G393-E426 VanDerWaalsContact CA-OE1 3.31Å; G393-E426 WeakPolarHBondContact CA-OE1 3.3Å; G393-E426 VanDerWaalsContact N-CD 3.29Å; G393-E426 PolarHBondContact N-OE1 3.17Å; G393-E426 PolarHBondContact N-OE2 3.39Å; K394-E426 PolarHBondContact N-OE1 2.75Å; K394-E426 VanDerWaalsContact N-OE1 3.13Å; V395-E426 VanDerWaalsContact CB-OE1 3.24Å; V395-E426 WeakPolarHBondContact CB-OE1 3.49Å; V395-E426 VanDerWaalsContact CG2-OE1 3.27Å; V395-E426 WeakPolarHBondContact CG2-OE1 3.14Å; V395-E426 PolarHBondContact N-OE1 2.8Å; G422-E426 PolarHBondContact O-N 3.39Å; I424-E426 VanDerWaalsContact C-N 3.33Å; I424-E426 PolarHBondContact O-N 2.67Å
427V93.3Very high90.2Very high3 Ų348.5 Ų48.52%0.01826%0.258CS..Iπ-helixtrans-86.5-11.7-177.7-57.50000114.1V395 I424 D425 A434 L435 M438 M451V395-V427 HydrophobicContact CB-CG1 4.04Å; V395-V427 HydrophobicContact CG1-CG1 3.62Å; I424-V427 WeakPolarHBondContact O-CG2 3.47Å; I424-V427 PolarHBondContact O-N 3.21Å; D425-V427 VanDerWaalsContact C-N 3.31Å; D425-V427 PolarHBondContact O-N 3.09Å; V427-A434 HydrophobicContact CB-CB 4.31Å; V427-L435 HydrophobicContact CG2-CD1 4.2Å; V427-M438 HydrophobicContact CB-SD 3.91Å; V427-M438 HydrophobicContact CG1-CE 4.24Å; V427-M438 HydrophobicContact CG1-SD 3.58Å; V427-M438 VanDerWaalsContact CG1-SD 3.58Å; V427-M438 HydrophobicContact CG2-SD 4.43Å; V427-M451 HydrophobicContact CG2-CE 3.9Å; V427-M451 HydrophobicContact CG2-SD 3.77Å
428C86.7Confident90.2Very high5 Ų540.5 Ų40.53%0.03423%0.228CC..Iπ-helixtrans-105.4-23.8-177.3-65.90000115I424 D425 K462 L463 K466I424-C428 WeakPolarHBondContact O-CB 3.46Å; I424-C428 PolarHBondContact O-N 3.03Å; I424-C428 PolarHBondContact O-SG 2.76Å; D425-C428 PolarHBondContact O-N 3.31Å; C428-K462 HydrophobicContact CB-CB 4.44Å; C428-L463 WeakPolarHBondContact SG-CD2 3.44Å; C428-K466 WeakPolarHBondContact O-CE 3.35Å
429T79.8Confident90.2Very high69 Ų6937.9 Ų37.942%0.42320%0.201SC..Iπ-helixtrans-123.9-36.8-167.7-53.70000113D425D425-T429 WeakPolarHBondContact O-CA 3.48Å; D425-T429 VanDerWaalsContact O-CB 3.29Å; D425-T429 WeakPolarHBondContact O-CB 3.25Å; D425-T429 PolarHBondContact O-N 2.72Å; D425-T429 PolarHBondContact O-OG1 2.86Å
430F68Low90.1Very high167 Ų16738.7 Ų38.773%0.73220%0.204SC*.Iπ-helixtrans-97.2-21.2-172-63.5-85.7000114.4
431N67.9Low90Very high76 Ų7638.3 Ų38.341%0.40621%0.205SC..  trans-136.496178.6-175.8-24000109.8N433 A434N431-N433 PolarHBondContact O-N 3.17Å; N431-A434 HydrophobicContact CB-CB 3.82Å; N431-A434 VanDerWaalsContact O-CB 3.28Å; N431-A434 WeakPolarHBondContact O-CB 3.42Å; N431-A434 PolarHBondContact O-N 3.42Å; N431-A434 PolarHBondContact OD1-N 3.39Å
432D67.9Low90.1Very high115 Ų11540.6 Ų40.662%0.61521%0.213SC*.THydrogen-bonded Turntrans-58.1-24.2-168.7-87.7-17.4000115.4K466D432-K466 IonicContact OD1-NZ 2.65Å; D432-K466 PolarHBondContact OD1-NZ 3.42Å
433N85.6Confident90.1Very high87 Ų8742.3 Ų42.347%0.46521%0.212SC..THydrogen-bonded Turntrans-101.1-8.6179.7-160.426.6000112.8N431 H436 V437N431-N433 PolarHBondContact O-N 3.17Å; N433-H436 PolarHBondContact O-N 3.19Å; N433-H436 PolarHBondContact OD1-ND1 3.42Å; N433-V437 WeakPolarHBondContact O-CG2 3.43Å; N433-V437 PolarHBondContact O-N 2.69Å
434A93.3Very high90.2Very high1 Ų142.2 Ų42.21%0.00821%0.211CC..Hα-helixtrans-57.2-55.8-176.300000112.1L396 V427 N431 H436 V437 M438L396-A434 HydrophobicContact CB-CB 4.46Å; L396-A434 HydrophobicContact CD1-CB 4.05Å; L396-A434 HydrophobicContact CD2-CB 3.92Å; L396-A434 HydrophobicContact CG-CB 4.36Å; V427-A434 HydrophobicContact CB-CB 4.31Å; N431-A434 HydrophobicContact CB-CB 3.82Å; N431-A434 VanDerWaalsContact O-CB 3.28Å; N431-A434 WeakPolarHBondContact O-CB 3.42Å; N431-A434 PolarHBondContact O-N 3.42Å; N431-A434 PolarHBondContact OD1-N 3.39Å; A434-H436 PolarHBondContact O-N 3.44Å; A434-V437 PolarHBondContact O-N 3.23Å; A434-V437 VanDerWaalsContact O-N 3.13Å; A434-M438 VanDerWaalsContact O-CG 3.28Å; A434-M438 WeakPolarHBondContact O-CG 3.3Å; A434-M438 PolarHBondContact O-N 3.4Å
435L93.6Very high90.3Very high4 Ų442.2 Ų42.22%0.02121%0.211CC..Hα-helixtrans-58.6-37.4178.3-165.671.6000112.2V427 M438 M439 V448 L463 K466 I467V427-L435 HydrophobicContact CG2-CD1 4.2Å; L435-M438 PolarHBondContact O-N 3.3Å; L435-M439 WeakPolarHBondContact O-CB 3.27Å; L435-M439 VanDerWaalsContact O-CG 3.26Å; L435-M439 WeakPolarHBondContact O-CG 3.16Å; L435-M439 PolarHBondContact O-N 2.95Å; L435-V448 HydrophobicContact CD1-CG1 4.04Å; L435-V448 HydrophobicContact CD1-CG2 3.81Å; L435-L463 HydrophobicContact CD1-CD2 3.65Å; L435-L463 HydrophobicContact CD2-CD2 3.87Å; L435-L463 HydrophobicContact CG-CD2 4.44Å; L435-K466 HydrophobicContact CD2-CB 3.64Å; L435-I467 HydrophobicContact CD2-CD1 4.33Å; L435-I467 HydrophobicContact CD2-CG1 3.71Å
436H93Very high90.5Very high34 Ų3446.5 Ų46.516%0.15723%0.226CC..Hα-helixtrans-69.6-36178.1172.8-142.2000112.8N433 A434 M439 K440 H470N433-H436 PolarHBondContact O-N 3.19Å; N433-H436 PolarHBondContact OD1-ND1 3.42Å; A434-H436 PolarHBondContact O-N 3.44Å; H436-M439 HydrophobicContact CB-CE 4.42Å; H436-K440 PolarHBondContact CD2-NZ 3.45Å; H436-K440 PolarHBondContact CE1-NZ 2.7Å; H436-K440 PolarHBondContact NE2-NZ 2.71Å; H436-K440 WeakPolarHBondContact O-CE 3.17Å; H436-K440 WeakPolarHBondContact O-CG 3.5Å; H436-H470 AromaticContact CD2-CE1 3.95Å; H436-H470 AromaticContact CD2-CG 3.84Å; H436-H470 AromaticContact CD2-ND1 3.71Å; H436-H470 AromaticContact CE1-CE1 3.92Å; H436-H470 AromaticContact CE1-ND1 3.99Å; H436-H470 AromaticContact CG-CE1 3.77Å; H436-H470 AromaticContact CG-NE2 3.85Å; H436-H470 AromaticContact ND1-CE1 3.78Å; H436-H470 AromaticContact NE2-ND1 3.75Å
437V95.7Very high90.6Very high43 Ų4344.9 Ų44.926%0.26122%0.219SC..Hα-helixtrans-63.7-53168.6170.50000109.9L396 N433 A434 M439 K440 D441L396-V437 HydrophobicContact CD1-CB 4.34Å; L396-V437 HydrophobicContact CD1-CG1 4.22Å; N433-V437 WeakPolarHBondContact O-CG2 3.43Å; N433-V437 PolarHBondContact O-N 2.69Å; A434-V437 PolarHBondContact O-N 3.23Å; A434-V437 VanDerWaalsContact O-N 3.13Å; V437-M439 VanDerWaalsContact C-N 3.33Å; V437-M439 PolarHBondContact O-N 3.42Å; V437-K440 PolarHBondContact O-N 2.83Å; V437-D441 PolarHBondContact O-N 3.41Å
438M97.5Very high90.8Very high0 Ų044.8 Ų44.80%022%0.218CC..Hα-helixtrans-57.5-42.5-176.3-68.3169.56500112.9L396 S399 V427 A434 L435 K440 D441 A444 N445 V447 V448 M451L396-M438 HydrophobicContact CD1-CG 3.55Å; L396-M438 HydrophobicContact CD1-SD 4.08Å; S399-M438 WeakPolarHBondContact OG-CE 3.26Å; V427-M438 HydrophobicContact CB-SD 3.91Å; V427-M438 HydrophobicContact CG1-CE 4.24Å; V427-M438 HydrophobicContact CG1-SD 3.58Å; V427-M438 VanDerWaalsContact CG1-SD 3.58Å; V427-M438 HydrophobicContact CG2-SD 4.43Å; A434-M438 VanDerWaalsContact O-CG 3.28Å; A434-M438 WeakPolarHBondContact O-CG 3.3Å; A434-M438 PolarHBondContact O-N 3.4Å; L435-M438 PolarHBondContact O-N 3.3Å; M438-K440 PolarHBondContact O-N 2.93Å; M438-K440 VanDerWaalsContact O-N 3.12Å; M438-D441 PolarHBondContact O-N 3.42Å; M438-A444 HydrophobicContact CB-CB 3.69Å; M438-A444 HydrophobicContact CG-CB 3.86Å; M438-A444 CarbonylContact O-C 3.35Å; M438-A444 VanDerWaalsContact O-C 3.27Å; M438-N445 WeakPolarHBondContact O-CA 3.4Å; M438-N445 PolarHBondContact O-N 3.29Å; M438-V447 HydrophobicContact CE-CB 4.28Å; M438-V447 HydrophobicContact CE-CG1 4.05Å; M438-V448 HydrophobicContact CB-CG2 3.61Å; M438-V448 HydrophobicContact CE-CG2 3.95Å; M438-M451 HydrophobicContact CE-CE 4.49Å
439M97Very high91.4Very high0 Ų046.3 Ų46.30%023%0.225CC..THydrogen-bonded Turntrans-59.3-22.7176.6-77-170.3-69.500114.3L435 H436 V437 V448 I467 H470 L474 G480 I483L435-M439 WeakPolarHBondContact O-CB 3.27Å; L435-M439 VanDerWaalsContact O-CG 3.26Å; L435-M439 WeakPolarHBondContact O-CG 3.16Å; L435-M439 PolarHBondContact O-N 2.95Å; H436-M439 HydrophobicContact CB-CE 4.42Å; V437-M439 VanDerWaalsContact C-N 3.33Å; V437-M439 PolarHBondContact O-N 3.42Å; M439-V448 HydrophobicContact CG-CB 4.47Å; M439-V448 HydrophobicContact CG-CG1 3.96Å; M439-V448 HydrophobicContact CG-CG2 4.26Å; M439-I467 HydrophobicContact CE-CG1 4.22Å; M439-I467 HydrophobicContact CE-CG2 4.42Å; M439-I467 HydrophobicContact SD-CB 4.18Å; M439-I467 HydrophobicContact SD-CD1 4.47Å; M439-I467 HydrophobicContact SD-CG1 3.71Å; M439-I467 HydrophobicContact SD-CG2 3.68Å; M439-H470 HydrophobicContact CE-CB 4.29Å; M439-L474 HydrophobicContact CB-CD2 3.86Å; M439-L474 HydrophobicContact CE-CD1 4.16Å; M439-L474 HydrophobicContact SD-CD1 3.6Å; M439-L474 VanDerWaalsContact SD-CD1 3.6Å; M439-L474 HydrophobicContact SD-CD2 4.32Å; M439-G480 WeakPolarHBondContact O-CA 3.31Å; M439-G480 PolarHBondContact O-N 3.3Å; M439-I483 HydrophobicContact CB-CG1 4.01Å; M439-I483 HydrophobicContact CG-CD1 4.3Å; M439-I483 HydrophobicContact CG-CG1 3.89Å; M439-I483 HydrophobicContact CG-CG2 4.34Å; M439-I483 HydrophobicContact SD-CG1 4.4Å; M439-I483 HydrophobicContact SD-CG2 3.92Å
440K96.3Very high92.2Very high52 Ų5245.8 Ų45.823%0.22622%0.217CC..THydrogen-bonded Turntrans-100.7-15.9-176.3-62.8176.9-54.1-151.90113.5H436 V437 M438 L474 Y477 Y479H436-K440 PolarHBondContact CD2-NZ 3.45Å; H436-K440 PolarHBondContact CE1-NZ 2.7Å; H436-K440 PolarHBondContact NE2-NZ 2.71Å; H436-K440 WeakPolarHBondContact O-CE 3.17Å; H436-K440 WeakPolarHBondContact O-CG 3.5Å; V437-K440 PolarHBondContact O-N 2.83Å; M438-K440 PolarHBondContact O-N 2.93Å; M438-K440 VanDerWaalsContact O-N 3.12Å; K440-L474 HydrophobicContact CG-CD2 4.27Å; K440-Y477 HydrophobicContact CB-CD1 4.46Å; K440-Y477 HydrophobicContact CD-CD1 3.92Å; K440-Y477 HydrophobicContact CD-CD2 3.97Å; K440-Y477 HydrophobicContact CD-CE1 3.72Å; K440-Y477 HydrophobicContact CD-CE2 3.74Å; K440-Y477 HydrophobicContact CD-CG 4.04Å; K440-Y477 HydrophobicContact CG-CD1 4.15Å; K440-Y477 HydrophobicContact CG-CD2 4.11Å; K440-Y477 HydrophobicContact CG-CE1 4.46Å; K440-Y477 HydrophobicContact CG-CE2 4.4Å; K440-Y477 HydrophobicContact CG-CG 3.97Å; K440-Y479 WeakPolarHBondContact O-CD2 3.38Å
441D98.2Very high93.7Very high28 Ų2837.9 Ų37.915%0.1518%0.182CC..SBendtrans-78.4156.2-180172.1-108.1000112.5Q400 V437 M438 Y443 A444 N445 Y479Q400-D441 HydrophobicContact CG-CB 4.18Å; V437-D441 PolarHBondContact O-N 3.41Å; M438-D441 PolarHBondContact O-N 3.42Å; D441-Y443 PolarHBondContact O-N 3.32Å; D441-Y443 PolarHBondContact OD1-N 3.32Å; D441-A444 HydrophobicContact CB-CB 4.08Å; D441-A444 PolarHBondContact OD1-N 3.38Å; D441-N445 WeakPolarHBondContact O-CB 3.44Å; D441-N445 PolarHBondContact O-ND2 3.49Å; D441-Y479 WeakPolarHBondContact O-CB 3.35Å
442Q97.8Very high95Very high81 Ų8134.4 Ų34.438%0.37916%0.163SC..THydrogen-bonded Turntrans-68.8-26.2-177.477-158.8-76.900114.3N445 Y446 Y479Q442-N445 PolarHBondContact O-ND2 2.88Å; Q442-Y446 WeakPolarHBondContact O-CE2 3.22Å; Q442-Y479 HydrophobicContact CB-CD1 4.15Å; Q442-Y479 HydrophobicContact CB-CD2 4.12Å; Q442-Y479 HydrophobicContact CB-CE1 3.66Å; Q442-Y479 HydrophobicContact CB-CE2 3.65Å; Q442-Y479 HydrophobicContact CB-CG 4.36Å
443Y98.4Very high96.3Very high62 Ų6233.4 Ų33.424%0.24316%0.158CC..THydrogen-bonded Turntrans-110.4-46.5179.5-54-63.3000111.6S399 Q400 K402 D441 N445 Y446S399-Y443 CarbonylContact O-C 3.59Å; Q400-Y443 WeakPolarHBondContact O-CD2 3.3Å; K402-Y443 HydrophobicContact CB-CD1 4.4Å; K402-Y443 HydrophobicContact CB-CD2 4.36Å; K402-Y443 HydrophobicContact CB-CE1 3.88Å; K402-Y443 HydrophobicContact CB-CE2 3.84Å; K402-Y443 HydrophobicContact CD-CE1 4.38Å; K402-Y443 HydrophobicContact CG-CD1 4.45Å; K402-Y443 HydrophobicContact CG-CE1 3.72Å; D441-Y443 PolarHBondContact O-N 3.32Å; D441-Y443 PolarHBondContact OD1-N 3.32Å; Y443-N445 PolarHBondContact O-N 3.07Å; Y443-N445 VanDerWaalsContact O-N 3.1Å; Y443-Y446 WeakPolarHBondContact O-CB 3.44Å; Y443-Y446 WeakPolarHBondContact O-CD2 3.47Å; Y443-Y446 PolarHBondContact O-N 3.42Å
444A98.3Very high96.8Very high0 Ų030.9 Ų30.90%015%0.145CC..Hα-helixtrans-66.8-19.3-173.200000113.6S399 Q400 M438 D441 Y446 V447 V448S399-A444 WeakPolarHBondContact O-CA 3.45Å; S399-A444 WeakPolarHBondContact O-CB 3.5Å; S399-A444 PolarHBondContact O-N 3.46Å; Q400-A444 HydrophobicContact CG-CB 3.97Å; M438-A444 HydrophobicContact CB-CB 3.69Å; M438-A444 HydrophobicContact CG-CB 3.86Å; M438-A444 CarbonylContact O-C 3.35Å; M438-A444 VanDerWaalsContact O-C 3.27Å; D441-A444 HydrophobicContact CB-CB 4.08Å; D441-A444 PolarHBondContact OD1-N 3.38Å; A444-Y446 PolarHBondContact O-N 2.85Å; A444-V447 WeakPolarHBondContact O-CB 3.44Å; A444-V447 PolarHBondContact O-N 3.12Å; A444-V448 WeakPolarHBondContact O-CG2 3.48Å; A444-V448 PolarHBondContact O-N 3.26Å
445N97.9Very high97Very high1 Ų131.6 Ų31.61%0.00515%0.151CC..Hα-helixtrans-63-30.4172.781.488.4000111.8M438 D441 Q442 Y443 Q449 I483M438-N445 WeakPolarHBondContact O-CA 3.4Å; M438-N445 PolarHBondContact O-N 3.29Å; D441-N445 WeakPolarHBondContact O-CB 3.44Å; D441-N445 PolarHBondContact O-ND2 3.49Å; Q442-N445 PolarHBondContact O-ND2 2.88Å; Y443-N445 PolarHBondContact O-N 3.07Å; Y443-N445 VanDerWaalsContact O-N 3.1Å; N445-Q449 WeakPolarHBondContact O-CB 3.18Å; N445-Q449 VanDerWaalsContact O-CG 3.23Å; N445-Q449 WeakPolarHBondContact O-CG 3.43Å; N445-Q449 PolarHBondContact O-N 3.28Å; N445-Q449 PolarHBondContact O-NE2 2.91Å; N445-Q449 PolarHBondContact OD1-NE2 3.06Å; N445-I483 HydrophobicContact CB-CD1 4.01Å; N445-I483 WeakPolarHBondContact O-CD1 3.39Å
446Y98.4Very high97.1Very high115 Ų11533.6 Ų33.645%0.45116%0.16SC..Hα-helixtrans-71.1-40.6174.4-64.9-85.3000111E409 Q442 Y443 A444 V448 Q449 K450E409-Y446 VanDerWaalsContact OE1-CB 3.26Å; E409-Y446 WeakPolarHBondContact OE1-CB 3.47Å; Q442-Y446 WeakPolarHBondContact O-CE2 3.22Å; Y443-Y446 WeakPolarHBondContact O-CB 3.44Å; Y443-Y446 WeakPolarHBondContact O-CD2 3.47Å; Y443-Y446 PolarHBondContact O-N 3.42Å; A444-Y446 PolarHBondContact O-N 2.85Å; Y446-V448 PolarHBondContact O-N 2.78Å; Y446-Q449 CarbonylContact O-C 3.58Å; Y446-Q449 WeakPolarHBondContact O-CA 2.94Å; Y446-Q449 WeakPolarHBondContact O-CB 3.29Å; Y446-Q449 PolarHBondContact O-N 3.04Å; Y446-Q449 VanDerWaalsContact O-N 3.13Å; Y446-K450 PolarHBondContact O-N 3.41Å
447V98.6Very high97.1Very high0 Ų037.1 Ų37.10%019%0.186CC..Hα-helixtrans-59.2-46.2172.1-175.10000111.6V408 E409 M438 A444 Q449 K450 M451V408-V447 HydrophobicContact CB-CG1 4.31Å; V408-V447 HydrophobicContact CB-CG2 4.36Å; V408-V447 HydrophobicContact CG1-CG1 3.58Å; V408-V447 HydrophobicContact CG1-CG2 4.49Å; E409-V447 HydrophobicContact CG-CG2 4.14Å; M438-V447 HydrophobicContact CE-CB 4.28Å; M438-V447 HydrophobicContact CE-CG1 4.05Å; A444-V447 WeakPolarHBondContact O-CB 3.44Å; A444-V447 PolarHBondContact O-N 3.12Å; V447-Q449 VanDerWaalsContact C-N 3.31Å; V447-Q449 PolarHBondContact O-N 3.16Å; V447-K450 WeakPolarHBondContact O-CB 3.46Å; V447-K450 PolarHBondContact O-N 2.73Å; V447-K450 VanDerWaalsContact O-N 3.11Å; V447-M451 HydrophobicContact CG1-CE 4.03Å; V447-M451 HydrophobicContact CG1-CG 4.45Å; V447-M451 HydrophobicContact CG1-SD 4.47Å; V447-M451 WeakPolarHBondContact O-CG 3.35Å; V447-M451 PolarHBondContact O-N 2.99Å
448V97.9Very high97Very high0 Ų039.5 Ų39.50%020%0.2CC..Hα-helixtrans-61.3-41.8175.1177.60000111L435 M438 M439 A444 Y446 K450 M451 I452 I483L435-V448 HydrophobicContact CD1-CG1 4.04Å; L435-V448 HydrophobicContact CD1-CG2 3.81Å; M438-V448 HydrophobicContact CB-CG2 3.61Å; M438-V448 HydrophobicContact CE-CG2 3.95Å; M439-V448 HydrophobicContact CG-CB 4.47Å; M439-V448 HydrophobicContact CG-CG1 3.96Å; M439-V448 HydrophobicContact CG-CG2 4.26Å; A444-V448 WeakPolarHBondContact O-CG2 3.48Å; A444-V448 PolarHBondContact O-N 3.26Å; Y446-V448 PolarHBondContact O-N 2.78Å; V448-K450 VanDerWaalsContact C-N 3.31Å; V448-K450 PolarHBondContact O-N 3.34Å; V448-M451 PolarHBondContact O-N 3.48Å; V448-I452 HydrophobicContact CG1-CD1 4.1Å; V448-I452 WeakPolarHBondContact O-CD1 3.29Å; V448-I452 VanDerWaalsContact O-CG1 3.29Å; V448-I452 WeakPolarHBondContact O-CG1 3.42Å; V448-I452 PolarHBondContact O-N 2.94Å; V448-I452 VanDerWaalsContact O-N 3.11Å; V448-I483 HydrophobicContact CB-CD1 4.2Å; V448-I483 HydrophobicContact CG1-CD1 4.18Å
449Q97.6Very high96.9Very high37 Ų3740.5 Ų40.517%0.17321%0.205CC..Hα-helixtrans-61.2-39174-74178.485.300111.9N445 Y446 V447 I452 D453 I483 K486N445-Q449 WeakPolarHBondContact O-CB 3.18Å; N445-Q449 VanDerWaalsContact O-CG 3.23Å; N445-Q449 WeakPolarHBondContact O-CG 3.43Å; N445-Q449 PolarHBondContact O-N 3.28Å; N445-Q449 PolarHBondContact O-NE2 2.91Å; N445-Q449 PolarHBondContact OD1-NE2 3.06Å; Y446-Q449 CarbonylContact O-C 3.58Å; Y446-Q449 WeakPolarHBondContact O-CA 2.94Å; Y446-Q449 WeakPolarHBondContact O-CB 3.29Å; Y446-Q449 PolarHBondContact O-N 3.04Å; Y446-Q449 VanDerWaalsContact O-N 3.13Å; V447-Q449 VanDerWaalsContact C-N 3.31Å; V447-Q449 PolarHBondContact O-N 3.16Å; Q449-I452 PolarHBondContact O-N 3.32Å; Q449-D453 PolarHBondContact O-N 3.03Å; Q449-I483 HydrophobicContact CG-CD1 3.81Å; Q449-K486 HydrophobicContact CB-CD 3.67Å; Q449-K486 HydrophobicContact CG-CB 4.48Å; Q449-K486 HydrophobicContact CG-CD 3.6Å; Q449-K486 WeakPolarHBondContact O-CE 3.46Å; Q449-K486 PolarHBondContact O-NZ 3.35Å
450K98.3Very high96.7Very high59 Ų5941.4 Ų41.426%0.25721%0.21SC..Hα-helixtrans-67.1-47.5176.5-174.963.163.1174.40111.7E409 V412 T413 Y446 V447 V448 I452 D453 V454E409-K450 HydrophobicContact CB-CB 4.4Å; E409-K450 HydrophobicContact CB-CG 4.1Å; E409-K450 HydrophobicContact CG-CB 3.75Å; E409-K450 HydrophobicContact CG-CG 4.02Å; E409-K450 WeakPolarHBondContact OE2-CE 3.06Å; E409-K450 IonicContact OE2-NZ 3.98Å; V412-K450 HydrophobicContact CG2-CB 4.37Å; V412-K450 HydrophobicContact CG2-CG 3.65Å; T413-K450 WeakPolarHBondContact OG1-CD 3.49Å; Y446-K450 PolarHBondContact O-N 3.41Å; V447-K450 WeakPolarHBondContact O-CB 3.46Å; V447-K450 PolarHBondContact O-N 2.73Å; V447-K450 VanDerWaalsContact O-N 3.11Å; V448-K450 VanDerWaalsContact C-N 3.31Å; V448-K450 PolarHBondContact O-N 3.34Å; K450-I452 PolarHBondContact O-N 2.89Å; K450-D453 WeakPolarHBondContact O-CB 3.18Å; K450-D453 PolarHBondContact O-N 3.33Å; K450-V454 HydrophobicContact CD-CG1 4.12Å; K450-V454 HydrophobicContact CG-CG1 4.48Å; K450-V454 WeakPolarHBondContact O-CG2 3.33Å; K450-V454 PolarHBondContact O-N 2.8Å; K450-V454 VanDerWaalsContact O-N 3.1Å
451M97.8Very high96.6Very high0 Ų046.4 Ų46.40%023%0.231CC..Hα-helixtrans-53.1-37.9175.7-71.9-179.2169.100111.7V395 V412 I424 V427 M438 V447 V448 S455 L463V395-M451 HydrophobicContact CG1-CE 3.79Å; V412-M451 HydrophobicContact CG1-CE 4.11Å; V412-M451 HydrophobicContact CG1-CG 4.31Å; V412-M451 HydrophobicContact CG2-CG 4.42Å; I424-M451 HydrophobicContact CG1-CB 4.32Å; I424-M451 HydrophobicContact CG1-CE 4.39Å; I424-M451 HydrophobicContact CG1-CG 3.97Å; I424-M451 HydrophobicContact CG1-SD 4.23Å; V427-M451 HydrophobicContact CG2-CE 3.9Å; V427-M451 HydrophobicContact CG2-SD 3.77Å; M438-M451 HydrophobicContact CE-CE 4.49Å; V447-M451 HydrophobicContact CG1-CE 4.03Å; V447-M451 HydrophobicContact CG1-CG 4.45Å; V447-M451 HydrophobicContact CG1-SD 4.47Å; V447-M451 WeakPolarHBondContact O-CG 3.35Å; V447-M451 PolarHBondContact O-N 2.99Å; V448-M451 PolarHBondContact O-N 3.48Å; M451-S455 VanDerWaalsContact O-CB 3.23Å; M451-S455 WeakPolarHBondContact O-CB 3.23Å; M451-S455 PolarHBondContact O-N 2.88Å; M451-S455 PolarHBondContact O-OG 3.46Å; M451-L463 HydrophobicContact CB-CD1 4.17Å
452I95.8Very high96.3Very high3 Ų348.5 Ų48.52%0.01524%0.239CC..Hα-helixtrans-65.5-35.9175-68.3163.7000112.7V448 Q449 K450 L460 L463 M464 I467 L487V448-I452 HydrophobicContact CG1-CD1 4.1Å; V448-I452 WeakPolarHBondContact O-CD1 3.29Å; V448-I452 VanDerWaalsContact O-CG1 3.29Å; V448-I452 WeakPolarHBondContact O-CG1 3.42Å; V448-I452 PolarHBondContact O-N 2.94Å; V448-I452 VanDerWaalsContact O-N 3.11Å; Q449-I452 PolarHBondContact O-N 3.32Å; K450-I452 PolarHBondContact O-N 2.89Å; I452-L460 HydrophobicContact CG2-CD1 4.19Å; I452-L463 HydrophobicContact CG1-CD1 4.37Å; I452-M464 HydrophobicContact CD1-CE 4.08Å; I452-M464 HydrophobicContact CG1-CE 3.8Å; I452-M464 HydrophobicContact CG2-CE 4.27Å; I452-I467 HydrophobicContact CD1-CD1 4Å; I452-L487 HydrophobicContact CD1-CD2 4.02Å
453D95.9Very high96.1Very high94 Ų9444.6 Ų44.650%0.50322%0.221SC..Hα-helixtrans-72.6-37.5178.2-65.2-31.7000112.7Q449 K450 K486Q449-D453 PolarHBondContact O-N 3.03Å; K450-D453 WeakPolarHBondContact O-CB 3.18Å; K450-D453 PolarHBondContact O-N 3.33Å; D453-K486 WeakPolarHBondContact OD1-CE 3.49Å; D453-K486 IonicContact OD1-NZ 3.41Å; D453-K486 PolarHBondContact OD1-NZ 2.83Å; D453-K486 IonicContact OD2-NZ 3.92Å; D453-K486 PolarHBondContact OD2-NZ 3.4Å
454V96.6Very high95.8Very high34 Ų3442.1 Ų42.121%0.20621%0.212CC..Hα-helixtrans-98.7-4.9-171.6-54.30000113.9V412 R420 K450V412-V454 HydrophobicContact CB-CG2 4.08Å; V412-V454 HydrophobicContact CG2-CG2 4.03Å; V412-V454 WeakPolarHBondContact O-CG2 3.36Å; R420-V454 VanDerWaalsContact CD-O 3.28Å; R420-V454 WeakPolarHBondContact CD-O 3.29Å; R420-V454 PolarHBondContact NE-O 2.78Å; K450-V454 HydrophobicContact CD-CG1 4.12Å; K450-V454 HydrophobicContact CG-CG1 4.48Å; K450-V454 WeakPolarHBondContact O-CG2 3.33Å; K450-V454 PolarHBondContact O-N 2.8Å; K450-V454 VanDerWaalsContact O-N 3.1Å
455S96.6Very high95.5Very high17 Ų1745.8 Ų45.812%0.11923%0.234CC..  trans-68.9131.2-180-780000112.7M451 L463M451-S455 VanDerWaalsContact O-CB 3.23Å; M451-S455 WeakPolarHBondContact O-CB 3.23Å; M451-S455 PolarHBondContact O-N 2.88Å; M451-S455 PolarHBondContact O-OG 3.46Å; S455-L463 WeakPolarHBondContact OG-CD1 3.24Å
456E94.6Very high95.2Very high46 Ų4649.1 Ų49.122%0.21525%0.249CC..  trans-70.1156.8163.7-63.4177.7-147.800109.8R417 R420 T458 Q459 L460R417-E456 WeakPolarHBondContact CG-OE1 3.42Å; R417-E456 IonicContact CZ-OE1 3.48Å; R417-E456 IonicContact CZ-OE2 2.79Å; R417-E456 VanDerWaalsContact CZ-OE2 3.3Å; R417-E456 IonicContact NE-OE1 3.98Å; R417-E456 PolarHBondContact NE-OE1 2.86Å; R417-E456 IonicContact NE-OE2 2.69Å; R417-E456 PolarHBondContact NE-OE2 3.36Å; R417-E456 VanDerWaalsContact NE-OE2 3.1Å; R417-E456 IonicContact NH2-OE2 2.69Å; R417-E456 PolarHBondContact NH2-OE2 3.32Å; R420-E456 IonicContact CZ-OE1 2.74Å; R420-E456 IonicContact NH2-OE1 3.1Å; R420-E456 PolarHBondContact NH2-OE1 3.4Å; E456-T458 PolarHBondContact O-N 3.48Å; E456-Q459 PolarHBondContact O-N 3.17Å; E456-Q459 VanDerWaalsContact O-N 3.08Å; E456-Q459 PolarHBondContact O-OE1 3.38Å; E456-L460 PolarHBondContact O-N 3.47Å
457P94.4Very high94.9Very high107 Ų10743.7 Ų43.770%0.69523%0.227SC*.Hα-helixtrans-55.7-30.6-165.6-30.336.7000115.6K461P457-K461 WeakPolarHBondContact O-CB 3.48Å; P457-K461 PolarHBondContact O-N 2.88Å
458T94.2Very high94.6Very high93 Ų9349.6 Ų49.657%0.57125%0.25SC*.Hα-helixtrans-67.7-50.3177.7-57.20000111.9E456 K461 K462E456-T458 PolarHBondContact O-N 3.48Å; T458-K461 WeakPolarHBondContact O-CB 3.47Å; T458-K461 PolarHBondContact O-N 2.97Å; T458-K462 PolarHBondContact O-N 3.25Å; T458-K462 VanDerWaalsContact O-N 3.17Å
459Q94.1Very high94.3Very high22 Ų2254.3 Ų54.310%0.10328%0.28CS..Hα-helixtrans-68.3-38.3179.1-68.570.51800110.3T421 I424 E456 K461 K462 L463T421-Q459 HydrophobicContact CG2-CG 4.17Å; T421-Q459 PolarHBondContact OG1-NE2 3.19Å; I424-Q459 HydrophobicContact CG2-CB 4.15Å; E456-Q459 PolarHBondContact O-N 3.17Å; E456-Q459 VanDerWaalsContact O-N 3.08Å; E456-Q459 PolarHBondContact O-OE1 3.38Å; Q459-K461 VanDerWaalsContact C-N 3.33Å; Q459-K461 PolarHBondContact O-N 3.37Å; Q459-K462 WeakPolarHBondContact O-CB 3.35Å; Q459-K462 PolarHBondContact O-N 3.33Å; Q459-K462 VanDerWaalsContact O-N 3.16Å; Q459-L463 PolarHBondContact O-N 3.03Å
460L94.1Very high94Very high19 Ų1955 Ų5510%0.09928%0.283CS..Hα-helixtrans-61-41.6172.9-172.970.8000111.8I452 E456 K462 L463 M464 Y490I452-L460 HydrophobicContact CG2-CD1 4.19Å; E456-L460 PolarHBondContact O-N 3.47Å; L460-K462 VanDerWaalsContact C-N 3.3Å; L460-K462 PolarHBondContact O-N 3.29Å; L460-L463 PolarHBondContact O-N 3.11Å; L460-M464 HydrophobicContact CD1-CE 3.76Å; L460-M464 HydrophobicContact CG-CG 4.37Å; L460-M464 WeakPolarHBondContact O-CG 3.26Å; L460-M464 PolarHBondContact O-N 3.05Å; L460-Y490 HydrophobicContact CD2-CE1 3.81Å; L460-Y490 WeakPolarHBondContact CD2-OH 3.34Å
461K93.1Very high93.6Very high156 Ų15654.3 Ų54.368%0.67828%0.282SS*.Hα-helixtrans-62.9-35.3175.8-172.6177.7179-178.30112P457 T458 Q459 T465P457-K461 WeakPolarHBondContact O-CB 3.48Å; P457-K461 PolarHBondContact O-N 2.88Å; T458-K461 WeakPolarHBondContact O-CB 3.47Å; T458-K461 PolarHBondContact O-N 2.97Å; Q459-K461 VanDerWaalsContact C-N 3.33Å; Q459-K461 PolarHBondContact O-N 3.37Å; K461-T465 WeakPolarHBondContact O-CB 3.47Å; K461-T465 PolarHBondContact O-N 2.91Å; K461-T465 PolarHBondContact O-OG1 2.93Å
462K92.4Very high93.3Very high72 Ų7257.4 Ų57.431%0.31331%0.307SS..Hα-helixtrans-63.7-55.6170.7-65.6-179.4177.8-170.40111.2D425 C428 T458 Q459 L460 M464 T465 K466D425-K462 WeakPolarHBondContact OD1-CD 3.33Å; D425-K462 WeakPolarHBondContact OD1-CE 3.3Å; D425-K462 IonicContact OD1-NZ 3.86Å; D425-K462 PolarHBondContact OD1-NZ 3.42Å; D425-K462 IonicContact OD2-NZ 2.68Å; D425-K462 PolarHBondContact OD2-NZ 3.43Å; C428-K462 HydrophobicContact CB-CB 4.44Å; T458-K462 PolarHBondContact O-N 3.25Å; T458-K462 VanDerWaalsContact O-N 3.17Å; Q459-K462 WeakPolarHBondContact O-CB 3.35Å; Q459-K462 PolarHBondContact O-N 3.33Å; Q459-K462 VanDerWaalsContact O-N 3.16Å; L460-K462 VanDerWaalsContact C-N 3.3Å; L460-K462 PolarHBondContact O-N 3.29Å; K462-M464 PolarHBondContact O-N 3.34Å; K462-T465 PolarHBondContact O-N 3.24Å; K462-K466 PolarHBondContact O-N 3.47Å
463L93.4Very high93.1Very high0 Ų059.3 Ų59.30%032%0.324CS..Hα-helixtrans-49.8-56176.7-80.5165.3000111.5I424 C428 L435 M451 I452 S455 Q459 L460 T465 K466 I467I424-L463 HydrophobicContact CG2-CD1 3.97Å; I424-L463 HydrophobicContact CG2-CD2 4.48Å; I424-L463 HydrophobicContact CG2-CG 4.1Å; C428-L463 WeakPolarHBondContact SG-CD2 3.44Å; L435-L463 HydrophobicContact CD1-CD2 3.65Å; L435-L463 HydrophobicContact CD2-CD2 3.87Å; L435-L463 HydrophobicContact CG-CD2 4.44Å; M451-L463 HydrophobicContact CB-CD1 4.17Å; I452-L463 HydrophobicContact CG1-CD1 4.37Å; S455-L463 WeakPolarHBondContact OG-CD1 3.24Å; Q459-L463 PolarHBondContact O-N 3.03Å; L460-L463 PolarHBondContact O-N 3.11Å; L463-T465 PolarHBondContact O-N 3.28Å; L463-T465 VanDerWaalsContact O-N 3.15Å; L463-K466 PolarHBondContact O-N 3.46Å; L463-K466 VanDerWaalsContact O-N 3.11Å; L463-I467 HydrophobicContact CB-CD1 4.28Å; L463-I467 WeakPolarHBondContact O-CD1 3.46Å; L463-I467 WeakPolarHBondContact O-CG1 3.45Å; L463-I467 PolarHBondContact O-N 3.03Å
464M92Very high93Very high9 Ų954.9 Ų54.94%0.04430%0.3CS..Hα-helixtrans-59.3-31.7-178.9-67.6-50.9110.500112.9I452 L460 K462 I467 R468 L487I452-M464 HydrophobicContact CD1-CE 4.08Å; I452-M464 HydrophobicContact CG1-CE 3.8Å; I452-M464 HydrophobicContact CG2-CE 4.27Å; L460-M464 HydrophobicContact CD1-CE 3.76Å; L460-M464 HydrophobicContact CG-CG 4.37Å; L460-M464 WeakPolarHBondContact O-CG 3.26Å; L460-M464 PolarHBondContact O-N 3.05Å; K462-M464 PolarHBondContact O-N 3.34Å; M464-I467 HydrophobicContact CE-CD1 3.84Å; M464-R468 WeakPolarHBondContact O-CB 3.3Å; M464-R468 VanDerWaalsContact O-CG 3.29Å; M464-R468 WeakPolarHBondContact O-CG 3.34Å; M464-R468 PolarHBondContact O-N 3.25Å; M464-R468 PolarHBondContact O-NH1 3.04Å; M464-L487 HydrophobicContact CE-CD2 3.65Å; M464-L487 HydrophobicContact SD-CD1 4.22Å; M464-L487 HydrophobicContact SD-CD2 3.51Å; M464-L487 VanDerWaalsContact SD-CD2 3.51Å
465T92.1Very high92.8Very high77 Ų7761.6 Ų61.647%0.47232%0.321SS..Hα-helixtrans-75.5-34179.6-56.50000112.2K461 K462 L463 R468 P469K461-T465 WeakPolarHBondContact O-CB 3.47Å; K461-T465 PolarHBondContact O-N 2.91Å; K461-T465 PolarHBondContact O-OG1 2.93Å; K462-T465 PolarHBondContact O-N 3.24Å; L463-T465 PolarHBondContact O-N 3.28Å; L463-T465 VanDerWaalsContact O-N 3.15Å; T465-R468 PolarHBondContact OG1-NH1 3Å; T465-P469 WeakPolarHBondContact O-CD 3.39Å
466K91.3Very high92.6Very high72 Ų7269.7 Ų69.731%0.31335%0.354SS..Hα-helixtrans-75-30.9169.3-69.2-64.9-164.5179.40113.3C428 D432 L435 K462 L463 H470C428-K466 WeakPolarHBondContact O-CE 3.35Å; D432-K466 IonicContact OD1-NZ 2.65Å; D432-K466 PolarHBondContact OD1-NZ 3.42Å; L435-K466 HydrophobicContact CD2-CB 3.64Å; K462-K466 PolarHBondContact O-N 3.47Å; L463-K466 PolarHBondContact O-N 3.46Å; L463-K466 VanDerWaalsContact O-N 3.11Å; K466-H470 PolarHBondContact O-CD2 3.18Å
467I92.8Very high92.6Very high0 Ų072.5 Ų72.50%036%0.364CS..Hα-helixtrans-79.2-41.2-177.7-60.8162.5000112.7L435 M439 I452 L463 M464 H470 M471 L474 I483 L487L435-I467 HydrophobicContact CD2-CD1 4.33Å; L435-I467 HydrophobicContact CD2-CG1 3.71Å; M439-I467 HydrophobicContact CE-CG1 4.22Å; M439-I467 HydrophobicContact CE-CG2 4.42Å; M439-I467 HydrophobicContact SD-CB 4.18Å; M439-I467 HydrophobicContact SD-CD1 4.47Å; M439-I467 HydrophobicContact SD-CG1 3.71Å; M439-I467 HydrophobicContact SD-CG2 3.68Å; I452-I467 HydrophobicContact CD1-CD1 4Å; L463-I467 HydrophobicContact CB-CD1 4.28Å; L463-I467 WeakPolarHBondContact O-CD1 3.46Å; L463-I467 WeakPolarHBondContact O-CG1 3.45Å; L463-I467 PolarHBondContact O-N 3.03Å; M464-I467 HydrophobicContact CE-CD1 3.84Å; I467-H470 PolarHBondContact O-N 3.41Å; I467-M471 HydrophobicContact CG2-CG 4.16Å; I467-M471 PolarHBondContact O-N 3.25Å; I467-L474 HydrophobicContact CG2-CD1 4.24Å; I467-I483 HydrophobicContact CG2-CG2 4.22Å; I467-L487 HydrophobicContact CG2-CD1 3.67Å
468R91.3Very high92.6Very high125 Ų12571.7 Ų71.747%0.47236%0.357SS..G310 helixtrans-47.6-48.4-174.6-86.4-177.1-140.6102.70.4114.8M464 T465 H470 M471M464-R468 WeakPolarHBondContact O-CB 3.3Å; M464-R468 VanDerWaalsContact O-CG 3.29Å; M464-R468 WeakPolarHBondContact O-CG 3.34Å; M464-R468 PolarHBondContact O-N 3.25Å; M464-R468 PolarHBondContact O-NH1 3.04Å; T465-R468 PolarHBondContact OG1-NH1 3Å; R468-H470 PolarHBondContact O-N 3.31Å; R468-H470 VanDerWaalsContact O-N 3.14Å; R468-M471 HydrophobicContact CG-SD 4.39Å; R468-M471 PolarHBondContact O-N 2.69Å
469P92.4Very high92.7Very high98 Ų9871.4 Ų71.464%0.63635%0.346SS*.G310 helixtrans-57.6-28.7179.8-26.235.8000114.1T465T465-P469 WeakPolarHBondContact O-CD 3.39Å
470H91.2Very high92.7Very high51 Ų5170.3 Ų70.324%0.23634%0.341CS..G310 helixtrans-92.2-14.2-176.2-58-62.7000113.7H436 M439 K466 I467 R468 A472 A473 L474H436-H470 AromaticContact CD2-CE1 3.95Å; H436-H470 AromaticContact CD2-CG 3.84Å; H436-H470 AromaticContact CD2-ND1 3.71Å; H436-H470 AromaticContact CE1-CE1 3.92Å; H436-H470 AromaticContact CE1-ND1 3.99Å; H436-H470 AromaticContact CG-CE1 3.77Å; H436-H470 AromaticContact CG-NE2 3.85Å; H436-H470 AromaticContact ND1-CE1 3.78Å; H436-H470 AromaticContact NE2-ND1 3.75Å; M439-H470 HydrophobicContact CE-CB 4.29Å; K466-H470 PolarHBondContact O-CD2 3.18Å; I467-H470 PolarHBondContact O-N 3.41Å; R468-H470 PolarHBondContact O-N 3.31Å; R468-H470 VanDerWaalsContact O-N 3.14Å; H470-A472 VanDerWaalsContact C-N 3.29Å; H470-A472 PolarHBondContact O-N 3.45Å; H470-A472 VanDerWaalsContact O-N 3.13Å; H470-A473 CarbonylContact O-C 3.06Å; H470-A473 WeakPolarHBondContact O-CA 3.44Å; H470-A473 PolarHBondContact O-N 2.93Å; H470-L474 HydrophobicContact CB-CD1 4.14Å; H470-L474 HydrophobicContact CB-CG 4.1Å; H470-L474 WeakPolarHBondContact O-CG 3.42Å; H470-L474 PolarHBondContact O-N 3.3Å
471M90.2Very high92.6Very high46 Ų4673.9 Ų73.923%0.22736%0.356CS..Hα-helixtrans-52.8-41.1-172.6-71.8-173.471.300114I467 R468 A473 L474 N484 L487I467-M471 HydrophobicContact CG2-CG 4.16Å; I467-M471 PolarHBondContact O-N 3.25Å; R468-M471 HydrophobicContact CG-SD 4.39Å; R468-M471 PolarHBondContact O-N 2.69Å; M471-A473 VanDerWaalsContact C-N 3.31Å; M471-A473 PolarHBondContact O-N 2.87Å; M471-L474 PolarHBondContact O-N 2.89Å; M471-N484 PolarHBondContact O-ND2 3.39Å; M471-L487 HydrophobicContact CE-CB 4.27Å; M471-L487 HydrophobicContact CE-CD1 3.95Å; M471-L487 HydrophobicContact CG-CD1 4.43Å; M471-L487 HydrophobicContact SD-CD1 3.91Å
472A91.5Very high92.6Very high64 Ų6470.2 Ų70.253%0.52934%0.341SS..Hα-helixtrans-63-3717800000112.8H470H470-A472 VanDerWaalsContact C-N 3.29Å; H470-A472 PolarHBondContact O-N 3.45Å; H470-A472 VanDerWaalsContact O-N 3.13Å
473A91.4Very high92.7Very high44 Ų4466.8 Ų66.836%0.36433%0.326SS..Hα-helixtrans-81.8-35.317900000112.8H470 M471 R475 K476 Y477H470-A473 CarbonylContact O-C 3.06Å; H470-A473 WeakPolarHBondContact O-CA 3.44Å; H470-A473 PolarHBondContact O-N 2.93Å; M471-A473 VanDerWaalsContact C-N 3.31Å; M471-A473 PolarHBondContact O-N 2.87Å; A473-R475 PolarHBondContact O-N 2.98Å; A473-R475 VanDerWaalsContact O-N 3.11Å; A473-K476 WeakPolarHBondContact O-CB 3.4Å; A473-K476 PolarHBondContact O-N 3.13Å; A473-Y477 WeakPolarHBondContact O-CD2 3.35Å
474L92.9Very high92.6Very high1 Ų167 Ų671%0.00533%0.327CS..Hα-helixtrans-54.5-32.2179.7-75.2172.2000112.8M439 K440 I467 H470 M471 K476 Y477 G480 K481 I483M439-L474 HydrophobicContact CB-CD2 3.86Å; M439-L474 HydrophobicContact CE-CD1 4.16Å; M439-L474 HydrophobicContact SD-CD1 3.6Å; M439-L474 VanDerWaalsContact SD-CD1 3.6Å; M439-L474 HydrophobicContact SD-CD2 4.32Å; K440-L474 HydrophobicContact CG-CD2 4.27Å; I467-L474 HydrophobicContact CG2-CD1 4.24Å; H470-L474 HydrophobicContact CB-CD1 4.14Å; H470-L474 HydrophobicContact CB-CG 4.1Å; H470-L474 WeakPolarHBondContact O-CG 3.42Å; H470-L474 PolarHBondContact O-N 3.3Å; M471-L474 PolarHBondContact O-N 2.89Å; L474-K476 PolarHBondContact O-N 3.45Å; L474-K476 VanDerWaalsContact O-N 3.14Å; L474-Y477 PolarHBondContact O-N 2.95Å; L474-Y477 VanDerWaalsContact O-N 3.08Å; L474-G480 CarbonylContact O-C 3.57Å; L474-G480 VanDerWaalsContact O-C 3.3Å; L474-K481 PolarHBondContact O-N 3.06Å; L474-I483 HydrophobicContact CD1-CB 4.46Å; L474-I483 HydrophobicContact CD1-CG2 4.49Å
475R92.6Very high92.6Very high174 Ų17468.4 Ų68.466%0.65734%0.34SS*.THydrogen-bonded Turntrans-56.7-25.1173.1-64.7-170.1-72.9-161.4-0.8114.3A473 N484A473-R475 PolarHBondContact O-N 2.98Å; A473-R475 VanDerWaalsContact O-N 3.11Å; R475-N484 WeakPolarHBondContact CG-ND2 3.14Å
476K93.5Very high92.6Very high187 Ų18766.5 Ų66.581%0.81333%0.325SS*.THydrogen-bonded Turntrans-88.4-13.5179.8-58.3-173.3178.5-174.90113.5A473 L474A473-K476 WeakPolarHBondContact O-CB 3.4Å; A473-K476 PolarHBondContact O-N 3.13Å; L474-K476 PolarHBondContact O-N 3.45Å; L474-K476 VanDerWaalsContact O-N 3.14Å
477Y93.8Very high92.4Very high105 Ų10563.1 Ų63.141%0.41231%0.31SS..SBendtrans-94.4137.7-178.7-70.4-80.1000111.4K440 A473 L474 Y479 G480 K481K440-Y477 HydrophobicContact CB-CD1 4.46Å; K440-Y477 HydrophobicContact CD-CD1 3.92Å; K440-Y477 HydrophobicContact CD-CD2 3.97Å; K440-Y477 HydrophobicContact CD-CE1 3.72Å; K440-Y477 HydrophobicContact CD-CE2 3.74Å; K440-Y477 HydrophobicContact CD-CG 4.04Å; K440-Y477 HydrophobicContact CG-CD1 4.15Å; K440-Y477 HydrophobicContact CG-CD2 4.11Å; K440-Y477 HydrophobicContact CG-CE1 4.46Å; K440-Y477 HydrophobicContact CG-CE2 4.4Å; K440-Y477 HydrophobicContact CG-CG 3.97Å; A473-Y477 WeakPolarHBondContact O-CD2 3.35Å; L474-Y477 PolarHBondContact O-N 2.95Å; L474-Y477 VanDerWaalsContact O-N 3.08Å; Y477-Y479 PolarHBondContact O-N 2.8Å; Y477-Y479 VanDerWaalsContact O-N 3.15Å; Y477-G480 PolarHBondContact O-N 3.39Å; Y477-K481 PolarHBondContact O-N 2.74Å
478T94.8Very high92.2Very high91 Ų9168.3 Ų68.356%0.55834%0.335SS*.THydrogen-bonded Turntrans-49.4-44.3-177-54.40000112.8K481T478-K481 WeakPolarHBondContact O-CD 3.49Å; T478-K481 WeakPolarHBondContact O-CE 3.23Å; T478-K481 PolarHBondContact O-NZ 3.21Å
479Y95.4Very high91.9Very high86 Ų8669.5 Ų69.534%0.33734%0.343SS..THydrogen-bonded Turntrans-99.4-36.7-179.1-52.1-75.8000112.7K440 D441 Q442 Y477 K481 H482K440-Y479 WeakPolarHBondContact O-CD2 3.38Å; D441-Y479 WeakPolarHBondContact O-CB 3.35Å; Q442-Y479 HydrophobicContact CB-CD1 4.15Å; Q442-Y479 HydrophobicContact CB-CD2 4.12Å; Q442-Y479 HydrophobicContact CB-CE1 3.66Å; Q442-Y479 HydrophobicContact CB-CE2 3.65Å; Q442-Y479 HydrophobicContact CB-CG 4.36Å; Y477-Y479 PolarHBondContact O-N 2.8Å; Y477-Y479 VanDerWaalsContact O-N 3.15Å; Y479-K481 PolarHBondContact O-N 3.32Å; Y479-K481 VanDerWaalsContact O-N 3.09Å; Y479-H482 WeakPolarHBondContact O-CB 3.4Å; Y479-H482 PolarHBondContact O-CD2 3.48Å; Y479-H482 VanDerWaalsContact O-CD2 3.26Å; Y479-H482 PolarHBondContact O-N 3.03Å
480G93.6Very high91.4Very high0 Ų068 Ų680%033%0.325CS..Hα-helixtrans-56.5-29.3-178.600000115.2M439 L474 Y477 H482 I483M439-G480 WeakPolarHBondContact O-CA 3.31Å; M439-G480 PolarHBondContact O-N 3.3Å; L474-G480 CarbonylContact O-C 3.57Å; L474-G480 VanDerWaalsContact O-C 3.3Å; Y477-G480 PolarHBondContact O-N 3.39Å; G480-H482 PolarHBondContact O-N 2.82Å; G480-I483 WeakPolarHBondContact O-CB 3.45Å; G480-I483 PolarHBondContact O-N 2.64Å; G480-I483 VanDerWaalsContact O-N 3.12Å
481K92.8Very high90.8Very high94 Ų9469.6 Ų69.641%0.40933%0.33SS..Hα-helixtrans-57.6-28.317474.6-164.3-170.4-137.40113.4L474 Y477 T478 Y479 N484 A485L474-K481 PolarHBondContact O-N 3.06Å; Y477-K481 PolarHBondContact O-N 2.74Å; T478-K481 WeakPolarHBondContact O-CD 3.49Å; T478-K481 WeakPolarHBondContact O-CE 3.23Å; T478-K481 PolarHBondContact O-NZ 3.21Å; Y479-K481 PolarHBondContact O-N 3.32Å; Y479-K481 VanDerWaalsContact O-N 3.09Å; K481-N484 PolarHBondContact O-N 3.17Å; K481-A485 PolarHBondContact O-N 2.74Å; K481-A485 VanDerWaalsContact O-N 3.15Å
482H93.9Very high90Very high79 Ų7973 Ų7337%0.36635%0.347SS..Hα-helixtrans-71.9-31.1178.9-60.9-63.5000112.4Y479 G480 A485 K486Y479-H482 WeakPolarHBondContact O-CB 3.4Å; Y479-H482 PolarHBondContact O-CD2 3.48Å; Y479-H482 VanDerWaalsContact O-CD2 3.26Å; Y479-H482 PolarHBondContact O-N 3.03Å; G480-H482 PolarHBondContact O-N 2.82Å; H482-A485 PolarHBondContact O-N 3.43Å; H482-K486 PolarHBondContact O-N 2.85Å
483I94.6Very high89.1Confident0 Ų078 Ų780%036%0.356CS..Hα-helixtrans-61.1-49.2173-51.3-58.6000110.1M439 N445 V448 Q449 I467 L474 G480 A485 K486 L487M439-I483 HydrophobicContact CB-CG1 4.01Å; M439-I483 HydrophobicContact CG-CD1 4.3Å; M439-I483 HydrophobicContact CG-CG1 3.89Å; M439-I483 HydrophobicContact CG-CG2 4.34Å; M439-I483 HydrophobicContact SD-CG1 4.4Å; M439-I483 HydrophobicContact SD-CG2 3.92Å; N445-I483 HydrophobicContact CB-CD1 4.01Å; N445-I483 WeakPolarHBondContact O-CD1 3.39Å; V448-I483 HydrophobicContact CB-CD1 4.2Å; V448-I483 HydrophobicContact CG1-CD1 4.18Å; Q449-I483 HydrophobicContact CG-CD1 3.81Å; I467-I483 HydrophobicContact CG2-CG2 4.22Å; L474-I483 HydrophobicContact CD1-CB 4.46Å; L474-I483 HydrophobicContact CD1-CG2 4.49Å; G480-I483 WeakPolarHBondContact O-CB 3.45Å; G480-I483 PolarHBondContact O-N 2.64Å; G480-I483 VanDerWaalsContact O-N 3.12Å; I483-A485 PolarHBondContact O-N 3.38Å; I483-K486 WeakPolarHBondContact O-CB 3.17Å; I483-K486 PolarHBondContact O-N 2.82Å; I483-K486 VanDerWaalsContact O-N 3.12Å; I483-L487 WeakPolarHBondContact O-CG 3.45Å; I483-L487 PolarHBondContact O-N 3.04Å
484N91.1Very high87.9Confident5 Ų580.3 Ų80.33%0.02736%0.362CS..Hα-helixtrans-59.5-47.7177.3-72.4-9.4000111.9M471 R475 K481 K486 L487 E488M471-N484 PolarHBondContact O-ND2 3.39Å; R475-N484 WeakPolarHBondContact CG-ND2 3.14Å; K481-N484 PolarHBondContact O-N 3.17Å; N484-K486 PolarHBondContact O-N 3.33Å; N484-L487 PolarHBondContact O-N 3.45Å; N484-E488 WeakPolarHBondContact O-CG 3.44Å; N484-E488 PolarHBondContact O-N 2.94Å
485A91.6Very high86.2Confident37 Ų3784.8 Ų84.831%0.30639%0.39SS..Hα-helixtrans-62.5-24.1177.800000113.3K481 H482 I483 K489K481-A485 PolarHBondContact O-N 2.74Å; K481-A485 VanDerWaalsContact O-N 3.15Å; H482-A485 PolarHBondContact O-N 3.43Å; I483-A485 PolarHBondContact O-N 3.38Å; A485-K489 WeakPolarHBondContact O-CD 3.43Å; A485-K489 WeakPolarHBondContact O-CG 3.29Å
486K91.4Very high84.2Confident37 Ų3781.9 Ų81.916%0.16139%0.387CS..Hα-helixtrans-77.2-44.2169-173.8167.2-168.4160.20112Q449 D453 H482 I483 N484 E488 K489 Y490Q449-K486 HydrophobicContact CB-CD 3.67Å; Q449-K486 HydrophobicContact CG-CB 4.48Å; Q449-K486 HydrophobicContact CG-CD 3.6Å; Q449-K486 WeakPolarHBondContact O-CE 3.46Å; Q449-K486 PolarHBondContact O-NZ 3.35Å; D453-K486 WeakPolarHBondContact OD1-CE 3.49Å; D453-K486 IonicContact OD1-NZ 3.41Å; D453-K486 PolarHBondContact OD1-NZ 2.83Å; D453-K486 IonicContact OD2-NZ 3.92Å; D453-K486 PolarHBondContact OD2-NZ 3.4Å; H482-K486 PolarHBondContact O-N 2.85Å; I483-K486 WeakPolarHBondContact O-CB 3.17Å; I483-K486 PolarHBondContact O-N 2.82Å; I483-K486 VanDerWaalsContact O-N 3.12Å; N484-K486 PolarHBondContact O-N 3.33Å; K486-E488 PolarHBondContact O-N 3.3Å; K486-K489 PolarHBondContact O-N 3.37Å; K486-Y490 WeakPolarHBondContact O-CB 3.26Å; K486-Y490 PolarHBondContact O-N 3.1Å
487L88.5Confident81.9Confident1 Ų177.8 Ų77.81%0.00538%0.38CS..Hα-helixtrans-63-40.4178.1-66.9-170.2000112.6I452 M464 I467 M471 I483 N484 K489 Y490 Y491I452-L487 HydrophobicContact CD1-CD2 4.02Å; M464-L487 HydrophobicContact CE-CD2 3.65Å; M464-L487 HydrophobicContact SD-CD1 4.22Å; M464-L487 HydrophobicContact SD-CD2 3.51Å; M464-L487 VanDerWaalsContact SD-CD2 3.51Å; I467-L487 HydrophobicContact CG2-CD1 3.67Å; M471-L487 HydrophobicContact CE-CB 4.27Å; M471-L487 HydrophobicContact CE-CD1 3.95Å; M471-L487 HydrophobicContact CG-CD1 4.43Å; M471-L487 HydrophobicContact SD-CD1 3.91Å; I483-L487 WeakPolarHBondContact O-CG 3.45Å; I483-L487 PolarHBondContact O-N 3.04Å; N484-L487 PolarHBondContact O-N 3.45Å; L487-K489 VanDerWaalsContact C-N 3.34Å; L487-K489 PolarHBondContact O-N 2.91Å; L487-Y490 WeakPolarHBondContact O-CB 3.23Å; L487-Y490 PolarHBondContact O-N 2.89Å; L487-Y490 VanDerWaalsContact O-N 3.08Å; L487-Y491 HydrophobicContact CB-CD2 4.41Å; L487-Y491 HydrophobicContact CB-CE2 4.22Å; L487-Y491 WeakPolarHBondContact O-CD2 3.41Å; L487-Y491 PolarHBondContact O-N 2.77Å
488E87.6Confident79.5Confident110 Ų11080.1 Ų80.151%0.51440%0.398SS..Hα-helixtrans-56.9-47.2174.3-72.3160.3-166.500110.9N484 K486 Y490 M492N484-E488 WeakPolarHBondContact O-CG 3.44Å; N484-E488 PolarHBondContact O-N 2.94Å; K486-E488 PolarHBondContact O-N 3.3Å; E488-Y490 VanDerWaalsContact C-N 3.32Å; E488-Y490 PolarHBondContact O-N 3.32Å; E488-M492 WeakPolarHBondContact O-CB 3.4Å; E488-M492 WeakPolarHBondContact O-CG 3.49Å; E488-M492 PolarHBondContact O-N 2.94Å
489K85.6Confident76.9Confident149 Ų14982.1 Ų82.165%0.64841%0.41SS*.Hα-helixtrans-64.5-34.2173.7-68.5172.7-176.2178.50113A485 K486 L487 K493A485-K489 WeakPolarHBondContact O-CD 3.43Å; A485-K489 WeakPolarHBondContact O-CG 3.29Å; K486-K489 PolarHBondContact O-N 3.37Å; L487-K489 VanDerWaalsContact C-N 3.34Å; L487-K489 PolarHBondContact O-N 2.91Å; K489-K493 WeakPolarHBondContact O-CG 3.23Å; K489-K493 PolarHBondContact O-N 3.49Å; K489-K493 VanDerWaalsContact O-N 3.14Å
490Y80.8Confident74Confident67 Ų6784.5 Ų84.526%0.26343%0.433SS..Hα-helixtrans-69.4-47.8179.2-172.5-103.3000111.6L460 K486 L487 E488 K493 I494L460-Y490 HydrophobicContact CD2-CE1 3.81Å; L460-Y490 WeakPolarHBondContact CD2-OH 3.34Å; K486-Y490 WeakPolarHBondContact O-CB 3.26Å; K486-Y490 PolarHBondContact O-N 3.1Å; L487-Y490 WeakPolarHBondContact O-CB 3.23Å; L487-Y490 PolarHBondContact O-N 2.89Å; L487-Y490 VanDerWaalsContact O-N 3.08Å; E488-Y490 VanDerWaalsContact C-N 3.32Å; E488-Y490 PolarHBondContact O-N 3.32Å; Y490-K493 PolarHBondContact O-N 3.45Å; Y490-I494 HydrophobicContact CD1-CD1 3.79Å; Y490-I494 HydrophobicContact CE1-CD1 3.22Å; Y490-I494 HydrophobicContact CE1-CG1 4.32Å; Y490-I494 PolarHBondContact O-N 2.97Å; Y490-I494 VanDerWaalsContact O-N 3.17Å
491Y79Confident71.1Confident84 Ų8487.6 Ų87.633%0.32947%0.465SS..Hα-helixtrans-63.1-42.5173.9-70.2-63.3000111.7L487 K493 I494 T495L487-Y491 HydrophobicContact CB-CD2 4.41Å; L487-Y491 HydrophobicContact CB-CE2 4.22Å; L487-Y491 WeakPolarHBondContact O-CD2 3.41Å; L487-Y491 PolarHBondContact O-N 2.77Å; Y491-K493 PolarHBondContact O-N 3.4Å; Y491-I494 PolarHBondContact O-N 3.13Å; Y491-T495 PolarHBondContact O-N 3.25Å; Y491-T495 PolarHBondContact O-OG1 3.29Å; Y491-T495 VanDerWaalsContact O-OG1 3.12Å
492M73.3Confident68.3Low119 Ų11989.8 Ų89.859%0.58649%0.486SS*.Hα-helixtrans-57.8-33.1174.6-70.6-88.587.600113.4E488E488-M492 WeakPolarHBondContact O-CB 3.4Å; E488-M492 WeakPolarHBondContact O-CG 3.49Å; E488-M492 PolarHBondContact O-N 2.94Å
493K72.2Confident65.4Low167 Ų16790.1 Ų90.173%0.72651%0.511SS*.Hα-helixtrans-73.1-33.1173.5-78.7-176.1174.2-170.30113.5K489 Y490 Y491K489-K493 WeakPolarHBondContact O-CG 3.23Å; K489-K493 PolarHBondContact O-N 3.49Å; K489-K493 VanDerWaalsContact O-N 3.14Å; Y490-K493 PolarHBondContact O-N 3.45Å; Y491-K493 PolarHBondContact O-N 3.4Å
494I67.3Low62.4Low93 Ų9394.9 Ų94.948%0.47755%0.55SS.*Hα-helixtrans-77.1-40.7178.1-67.9166.8000111.5Y490 Y491 N496 P497Y490-I494 HydrophobicContact CD1-CD1 3.79Å; Y490-I494 HydrophobicContact CE1-CD1 3.22Å; Y490-I494 HydrophobicContact CE1-CG1 4.32Å; Y490-I494 PolarHBondContact O-N 2.97Å; Y490-I494 VanDerWaalsContact O-N 3.17Å; Y491-I494 PolarHBondContact O-N 3.13Å; I494-N496 VanDerWaalsContact C-N 3.27Å; I494-N496 PolarHBondContact O-N 3.45Å; I494-P497 WeakPolarHBondContact O-CD 3.37Å
495T57.2Low59.5Low96 Ų9698.8 Ų98.859%0.58959%0.592SS**Hα-helixtrans-72.5-21.3-175.7-54.10000112.8Y491 P497Y491-T495 PolarHBondContact O-N 3.25Å; Y491-T495 PolarHBondContact O-OG1 3.29Å; Y491-T495 VanDerWaalsContact O-OG1 3.12Å; T495-P497 VanDerWaalsContact O-CD 3.23Å; T495-P497 WeakPolarHBondContact O-CD 3.31Å
496N49.8Very low56.5Low113 Ų113100.5 Ų100.560%0.60461%0.614SS**  trans-115.268.3176-68.6-15.6000112.2I494 I498I494-N496 VanDerWaalsContact C-N 3.27Å; I494-N496 PolarHBondContact O-N 3.45Å; N496-I498 PolarHBondContact O-N 2.8Å
497P46.4Very low53.9Low101 Ų101105.7 Ų105.766%0.65665%0.648SS**  trans-70.5111.6166.631.3-29.2000107.9I494 T495 T499I494-P497 WeakPolarHBondContact O-CD 3.37Å; T495-P497 VanDerWaalsContact O-CD 3.23Å; T495-P497 WeakPolarHBondContact O-CD 3.31Å; P497-T499 PolarHBondContact O-N 2.76Å
498I43.2Very low51.4Low154 Ų154111.2 Ų111.279%0.7968%0.684SS**  trans-64120.5-179.9-65.2176.9000109N496 V500N496-I498 PolarHBondContact O-N 2.8Å; I498-V500 PolarHBondContact O-N 3.09Å
499T39.4Very low48.6Very low133 Ų133110.7 Ų110.782%0.81670%0.699SS**  trans-59.2109.2172.8-37.90000109.4P497 G501P497-T499 PolarHBondContact O-N 2.76Å; T499-G501 PolarHBondContact O-N 3.05Å
500V35.2Very low46Very low136 Ų136108.3 Ų108.382%0.82471%0.707SS**  trans-70.698.3173.1178.90000107.6I498 T502I498-V500 PolarHBondContact O-N 3.09Å; V500-T502 PolarHBondContact O-N 2.92Å
501G32.9Very low43.7Very low65 Ų65111.2 Ų111.267%0.6774%0.737SS**  trans-67.6112.1-175.600000112.2T499 G503T499-G501 PolarHBondContact O-N 3.05Å; G501-G503 PolarHBondContact O-N 3.09Å
502T33.9Very low41.4Very low139 Ų139113.2 Ų113.285%0.85376%0.763SS**  trans-62.6115.8160.247.20000108.9V500 A504V500-T502 PolarHBondContact O-N 2.92Å; T502-A504 PolarHBondContact O-N 3.37Å
503G32.1Very low39.4Very low87 Ų87112.6 Ų112.690%0.89778%0.777SS**  trans-69.7121.2-177.400000112.8G501G501-G503 PolarHBondContact O-N 3.09Å
504A31.4Very low37.4Very low99 Ų99109.2 Ų109.282%0.81878%0.78SS**  trans-133.8136.9160.800000108T502T502-A504 PolarHBondContact O-N 3.37Å
505G30.7Very low35.6Very low87 Ų87109.5 Ų109.590%0.89780%0.796SS**  trans-78.9152.9-167.600000114.6
506G28Very low34.3Very low74 Ų74111.3 Ų111.376%0.76381%0.807SS**  trans-165.4102172.100000111
507V37.1Very low33.4Very low145 Ų145110.7 Ų110.788%0.87981%0.811SS**  trans-89136.2175.4-1670000109.2
508P35.5Very low32.8Very low118 Ų118111.2 Ų111.277%0.76682%0.817SS**  trans-114.2143.7150.73.617.6000111.3
509A29Very low32.1Very low99 Ų99107.2 Ų107.282%0.81881%0.814SS**  trans-78.3167.1175.800000112.3
510A31.5Very low31.7Very low99 Ų99105.3 Ų105.382%0.81881%0.812SS**  trans-73.6151.5176.600000112.7
511S31.7Very low31.4Very low128 Ų128104.9 Ų104.990%0.89581%0.81SS**  trans-142.1120.9159.1-73.20000109
512S31.1Very low31.3Very low126 Ų126107 Ų10788%0.88181%0.814SS**  trans-98.8135.9-179.254.80000112.1
513A31.9Very low31.2Very low106 Ų106105.2 Ų105.288%0.87681%0.813SS**  trans-145139.3158.700000108.7
514A29.8Very low31.1Very low96 Ų96106.1 Ų106.179%0.79381%0.806SS**  trans-141.3141.3-172.300000112.4
515A30.8Very low31.1Very low98 Ų98107.8 Ų107.881%0.8181%0.806SS**  trans63.2167.7169.500000115.1
516V28.9Very low31.1Very low135 Ų135109.9 Ų109.982%0.81880%0.801SS**  cis-133161.19.3-166.30000110.5
517S31.5Very low31.3Very low99 Ų99110.3 Ų110.369%0.69280%0.798SS**  trans-66.5175.3167.555.90000112.1
518S33.4Very low30.9Very low112 Ų112108.6 Ų108.678%0.78379%0.791SS**  -175.316752.4-45.10000113
519G27.4Very low30.7Very low70 Ų70108.5 Ų108.572%0.72279%0.789SS**  trans106.3122172.400000112.6
520A31Very low30.8Very low94 Ų94109.6 Ų109.678%0.77779%0.79SS**  cis69.7127.837.100000112.6
521T30.6Very low30.7Very low126 Ų126108.4 Ų108.477%0.77379%0.788SS**  cis-159.5155.219.2-12.90000113.8
522S30.8Very low30.8Very low109 Ų109108 Ų10876%0.76279%0.785SS**  trans73.6143.3143.9-60.90000123.8
523A31.3Very low30.9Very low102 Ų102106.8 Ų106.884%0.84378%0.776SS**  trans63.8144.3156.200000119.6
524S29.1Very low31Very low107 Ų107107.4 Ų107.475%0.74877%0.769SS**  cis134.794.8-8168.80000110.8
525V32Very low31Very low133 Ų133108.6 Ų108.681%0.80677%0.767SS**  trans-169138.8147.9-96.20000107.3
526T31.1Very low31Very low131 Ų131110.7 Ų110.780%0.80477%0.77SS**  65.5122.969.4-41.60000110.6
527A32.2Very low31.1Very low83 Ų83110.1 Ų110.169%0.68677%0.767SS**  cis-154-167.920.800000115.6
528C27.7Very low31.1Very low110 Ų110110.2 Ų110.274%0.74377%0.767SS**  trans-42.3178.9166.457.60000118.2
529T31Very low31Very low116 Ų116111.4 Ų111.471%0.71277%0.77SS**  cis-165.3169.424-20.40000112.4
530S32.4Very low31.4Very low121 Ų121113.3 Ų113.385%0.84677%0.768SS**  trans72.8148.2155.4-55.60000118.4
531G29.5Very low31.6Very low75 Ų75116.2 Ų116.277%0.77377%0.771SS**  cis-172.1166.4-3.200000113.6
532S33.6Very low31.7Very low119 Ų119114.6 Ų114.683%0.83276%0.764SS**  trans-86169.1178.4-41.60000111.3
533S33.5Very low31.7Very low101 Ų101117.7 Ų117.771%0.70677%0.772SS**  cis-171.9175.41.525.50000112.1
534T33Very low31.6Very low118 Ų118117.4 Ų117.472%0.72477%0.769SS**  trans84.8119.7141.824.50000123.9
535T31Very low31.7Very low121 Ų121117.9 Ų117.974%0.74277%0.772SS**  trans60.2132.2142.434.70000124.3
536T29.6Very low32.4Very low143 Ų143117.7 Ų117.788%0.87777%0.774SS**  -165.9177.5120.812.60000111.4
537T31.6Very low32.5Very low123 Ų123117 Ų11776%0.75577%0.769SS**  trans-137.5166-16245.90000116
538S32.2Very low32.3Very low100 Ų100120.1 Ų120.170%0.69977%0.773SS**  trans72.2126143.8560000122.4
539T30.8Very low32.2Very low138 Ų138120.2 Ų120.285%0.84777%0.774SS**  trans-176.4173.2142.518.70000108.8
540T35.8Very low32.1Very low110 Ų110119.3 Ų119.368%0.67577%0.772SS**  -158.8144.8-99.630.90000111.5
541N34.3Very low31.8Very low155 Ų155119.8 Ų119.883%0.82977%0.77SS**  trans64.2162.1159.2-65.5-3.5000118.6
542S33.3Very low31.7Very low92 Ų92123.7 Ų123.764%0.64377%0.768SS**  cis-175.5175.8-34.458.10000110.6
543L30.5Very low31.5Very low174 Ų174124.7 Ų124.791%0.91176%0.759SS**  trans97.5151.5157.6-66.2157.8000121.8
544A29.8Very low31.3Very low96 Ų96127.1 Ų127.179%0.79377%0.765SS**  trans104.3127.515600000119.9
545S31Very low31Very low117 Ų117124.4 Ų124.482%0.81876%0.76SS**  trans-148.7147.8168-57.70000109.9
546P46.7Very low31Very low128 Ų128124.8 Ų124.883%0.83177%0.767SS**  trans-147.5175.4140.434.3-16.4000114.8
547T32.3Very low30.9Very low116 Ų116122.2 Ų122.271%0.71276%0.761SS**  cis-176.3135-49.5-95.20000110.5
548I29.6Very low30.8Very low149 Ų149125.1 Ų125.176%0.76477%0.768SS**  trans70.6125.9161.4-79164.7000121.4
549C24.5Very low30.7Very low113 Ų113127.8 Ų127.876%0.76477%0.773SS**  trans147.7113.3135.9-91.40000109.4
550S28.9Very low30.6Very low96 Ų96128.2 Ų128.267%0.67178%0.775SS**  cis86.8156.430.286.40000115.4
551V27.3Very low30.4Very low132 Ų132131.3 Ų131.380%0.878%0.782SS**  trans81.9111-167.9-175.10000111.7
552Q27.3Very low31.4Very low156 Ų156128.8 Ų128.873%0.72977%0.774SS**  cis71.5142.726.6-109.8173-52.300113.2
553E29.2Very low31.2Very low140 Ų140130.2 Ų130.265%0.65478%0.784SS**  cis-163.3-175.87.4-162.8154.7-126.300110.8
554N28.9Very low31.6Very low153 Ų153127.7 Ų127.782%0.81878%0.781SS**  trans76.4147.6164.6-64.4-42.8000119.5
555G27.6Very low32.4Very low61 Ų61128.9 Ų128.963%0.62978%0.78SS**  cis166.5167.1-7.300000114.7
556S29.2Very low32.4Very low128 Ų128131 Ų13190%0.89578%0.783SS**  trans71.7125.6176.9-52.30000116.7
557A29.1Very low31.7Very low89 Ų89128.9 Ų128.974%0.73678%0.776SS**  cis104103.84.400000118.6
558M28.6Very low31.6Very low184 Ų184128.8 Ų128.891%0.90678%0.78SS**  trans-155.4133.5145.7-68-167-178.300105
559I30.8Very low31.7Very low157 Ų157130.2 Ų130.281%0.80578%0.783SS**  cis73.389.630.2-45.9175.7000114.2
560V29Very low32Very low147 Ų147128.6 Ų128.689%0.89177%0.773SS**  trans-151.7133.8138.1-179.60000109
561E29.9Very low32.1Very low174 Ų174128.7 Ų128.781%0.81377%0.774SS**  trans-159.1172.9164.8-142.5-159.9-143.800107.5
562P55.8Low32.3Very low102 Ų102127.8 Ų127.866%0.66277%0.774SS**  -101.6171.8-63.934-24.2000112.5
563S30.2Very low32.6Very low122 Ų122125.5 Ų125.585%0.85378%0.775SS**  trans-154.3124.3168.4-740000115.5
564S37.5Very low32.7Very low121 Ų121125 Ų12585%0.84678%0.781SS**  trans-134.5148.4146.8-61.80000106
565P47.9Very low33Very low122 Ų122124 Ų12479%0.79278%0.78SS**  -153.5-178.7111.239.3-20.7000116.8
566D31.1Very low33.4Very low161 Ų161126.4 Ų126.486%0.86179%0.787SS**  trans-34.1154178.3-57-66.3000123.2
567A31.4Very low33.5Very low84 Ų84124 Ų12469%0.69478%0.782SS**  179115.9129.600000110
568S30.8Very low33.9Very low113 Ų113123.8 Ų123.879%0.7978%0.781SS**  43121.88967.90000114.1
569E29.7Very low34.4Very low179 Ų179121.6 Ų121.684%0.83678%0.777SS**  cis-165.3-179.542-96.3-154.2-11600110.5
570S31.1Very low34.6Very low80 Ų80120.8 Ų120.856%0.55978%0.775SS**  cis-175.2-156.5-27.568.80000110.7
571S31.2Very low35Very low98 Ų98118.3 Ų118.369%0.68576%0.764SS**  trans68.482.8152.9-58.30000123.2
572S32Very low35.4Very low113 Ų113113.4 Ų113.479%0.7976%0.76SS**  43.3122123.464.60000125
573S33.3Very low34.4Very low108 Ų108117.5 Ų117.576%0.75578%0.776SS**  -175.2124.6118.448.60000110.1
574V31.9Very low34.6Very low129 Ų129115 Ų11578%0.78277%0.768SS**  52.7115.285.9-174.60000110.9
575V35.5Very low36Very low132 Ų132115.4 Ų115.480%0.877%0.768SS**  -136.9143.560.5-176.40000114.1
576S35Very low35.6Very low112 Ų112118.1 Ų118.178%0.78377%0.774SS**  trans-32162.5156.5-440000117.4
577G32.1Very low35.7Very low76 Ų76113.4 Ų113.478%0.78476%0.764SS**  cis174.3-154.96.300000108.5
578A37.1Very low37Very low86 Ų86115.4 Ų115.471%0.71177%0.77SS**  cis-167.3132.5-20.600000108.7
579V38.3Very low37.9Very low137 Ų137115.3 Ų115.383%0.8377%0.766SS**  trans54.8156.8161.5-65.40000119
580N36.1Very low38.4Very low141 Ų141112.5 Ų112.575%0.75476%0.762SS**  cis-145174.210.5-147.74.5000114.6
581S36.5Very low38.7Very low94 Ų94116.6 Ų116.666%0.65778%0.777SS**  trans-54.6161.816353.90000113.6
582G37.9Very low38.8Very low71 Ų71115.1 Ų115.173%0.73278%0.778SS**  cis109.9101.57.200000112.4
583L36Very low39.3Very low189 Ų189117.5 Ų117.599%0.9978%0.782SS**  trans-153156.4172-102.6171.4000109.7
584G34.6Very low39.7Very low68 Ų68118.5 Ų118.570%0.70178%0.783SS**  trans-105.3-140.6-167.400000116.5
585P66.6Low40.2Very low130 Ų130118.3 Ų118.384%0.84478%0.781SS**  -128151.3-113.937.1-22.5000115.9
586I38.4Very low40.6Very low179 Ų179123.2 Ų123.292%0.91880%0.802SS**  trans-138.9151.7171-59.4-177.1000110
587G34.7Very low40.8Very low63 Ų63123.8 Ų123.865%0.64980%0.803SS**  trans-88.4-166.3-173.800000117.4
588P57.9Low41.3Very low126 Ų126126.3 Ų126.382%0.81880%0.804SS**  trans-96.3173.6-163.743.5-40.7000113
589P49.7Very low41.5Very low110 Ų110128.6 Ų128.671%0.71481%0.809SS**  -153.9165.383.342.7-23.6000118.4
590T40.4Very low41.7Very low121 Ų121128.1 Ų128.174%0.74281%0.808SS**  trans37.8122145.457.30000123.1
591N36.7Very low42.1Very low165 Ų165127.3 Ų127.388%0.88281%0.812SS**  -162.5151.4112-91.9-23.9000109
592G34.7Very low42.5Very low67 Ų67129.5 Ų129.569%0.69182%0.822SS**  cis124.376.9-1.500000112.9
593N41.1Very low42.8Very low164 Ų164133.6 Ų133.688%0.87783%0.828SS**  trans-157.5148.7160.4-134.71.8000112.6
594V42.1Very low43.3Very low128 Ų128129.4 Ų129.478%0.77682%0.816SS**  trans-147161.2-177.5-1670000108.4
595V43.2Very low44Very low125 Ų125134.5 Ų134.576%0.75883%0.825SS**  trans75.7102.1171.6-167.40000115.3
596L42.8Very low42Very low236 Ų236134.9 Ų134.9100%1.23682%0.824SS**  -140.6091.8-104168.6000110.1

Retrieved 596 of 596 residues in 597.2 ms (Link to these results)