G4VEW1_SCHMA Loading...

One cut domain family member

AlphaFold DB , UniProt , Accession G4VEW1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 761 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M44.3Very low41.7Very low249 Ų249153.5 Ų153.5100%1.22779%0.793SS**  0111.40-78.2167164.100107.4
2T42.7Very low41Very low122 Ų122146.7 Ų146.775%0.74879%0.788SS**  trans-101.2161.6-172.4360000111.9R4T2-R4 PolarHBondContact O-N 2.7Å
3E38.8Very low40.6Very low182 Ų182147.8 Ų147.885%0.8579%0.791SS**THydrogen-bonded Turntrans-51.2-17.9-167.9-78.7165.490.900117.6S5 F6E3-S5 PolarHBondContact O-N 3.05Å; E3-S5 VanDerWaalsContact O-N 3.09Å; E3-F6 PolarHBondContact O-N 3.28Å
4R45.6Very low40.2Very low227 Ų227145.7 Ų145.786%0.85779%0.794SS**Hα-helixtrans-63.6-17.4-176.6-65.3-173.7-176.1171.92.1114.4T2 F6T2-R4 PolarHBondContact O-N 2.7Å; R4-F6 VanDerWaalsContact C-N 3.3Å; R4-F6 PolarHBondContact O-N 3.45Å
5S44.7Very low39.7Very low92 Ų92144.8 Ų144.864%0.64379%0.787SS**Hα-helixtrans-75-14.1178.4-162.20000114.5E3E3-S5 PolarHBondContact O-N 3.05Å; E3-S5 VanDerWaalsContact O-N 3.09Å
6F41.7Very low39.5Very low169 Ų169147 Ų14774%0.74179%0.79SS**Hα-helixtrans-90.7-28.1-178.3-103.2-91000114.2E3 R4E3-F6 PolarHBondContact O-N 3.28Å; R4-F6 VanDerWaalsContact C-N 3.3Å; R4-F6 PolarHBondContact O-N 3.45Å
7Q41.3Very low39.2Very low158 Ų158146.4 Ų146.474%0.73879%0.786SS**Hα-helixtrans-71.7-29.7176.7-73-166.98.100113L9 I10Q7-L9 PolarHBondContact O-N 3.48Å; Q7-L9 VanDerWaalsContact O-N 3.15Å; Q7-I10 PolarHBondContact O-N 2.77Å
8S38.4Very low38.8Very low100 Ų100146.6 Ų146.670%0.69978%0.781SS**THydrogen-bonded Turntrans-70-9.3-177.7-166.10000115
9L38Very low38.6Very low149 Ų149143.4 Ų143.478%0.7878%0.778SS**THydrogen-bonded Turntrans-92.5-6.8175.6-85.5164.1000113.6Q7Q7-L9 PolarHBondContact O-N 3.48Å; Q7-L9 VanDerWaalsContact O-N 3.15Å
10I44.5Very low38.6Very low133 Ų133140.9 Ų140.968%0.68278%0.777SS**THydrogen-bonded Turntrans-103.4-20.5-176.5-61.5-179.9000111.6Q7 G12Q7-I10 PolarHBondContact O-N 2.77Å; I10-G12 VanDerWaalsContact C-N 3.34Å; I10-G12 PolarHBondContact O-N 3.46Å
11S38.5Very low38.5Very low108 Ų108142 Ų14276%0.75578%0.781SS**SBendtrans-89.620.6-176.9-49.10000115.3
12G33Very low37.9Very low71 Ų71136.9 Ų136.973%0.73276%0.759SS**  trans-97.3-1.7-171.500000116.8I10I10-G12 VanDerWaalsContact C-N 3.34Å; I10-G12 PolarHBondContact O-N 3.46Å
13I36.4Very low37.5Very low162 Ų162137.9 Ų137.983%0.83176%0.759SS**  trans-110.593.6-175.847.5167.5000111.4L15I13-L15 PolarHBondContact O-N 3.46Å
14S34.4Very low37.4Very low118 Ų118136.4 Ų136.483%0.82576%0.756SS**  trans-87.3109.5176.9-173.40000111.7
15L32.8Very low36.7Very low132 Ų132130.1 Ų130.169%0.69175%0.747SS**  trans1.6119.1149.4-73.8141.4000118.1I13 E18I13-L15 PolarHBondContact O-N 3.46Å; L15-E18 HydrophobicContact CD2-CG 4.45Å
16H37.5Very low36Very low180 Ų180133.5 Ų133.583%0.83376%0.757SS**  -162.197.5127-132.7-85.8000111.1
17D34.6Very low35.5Very low136 Ų136134.4 Ų134.473%0.72776%0.761SS**  166.194.8126.3-118.7-83.5000109.4
18E31Very low35Very low150 Ų150131.8 Ų131.870%0.70177%0.766SS**  trans-109.567.7-168-130.3-85.6109.300108.9L15L15-E18 HydrophobicContact CD2-CG 4.45Å
19A35.7Very low34.6Very low87 Ų87130.3 Ų130.372%0.71976%0.759SS**  trans-151.733.9-170.300000115.7
20A37.4Very low34.4Very low92 Ų92130.4 Ų130.476%0.7676%0.76SS**SBendtrans-147.7-16.6177.100000117.6
21L36.4Very low33.9Very low165 Ų165127.6 Ų127.686%0.86475%0.747SS**SBendtrans-110.923.3-169.7-66.3178.2000115
22N33.1Very low33.5Very low142 Ų142129.4 Ų129.476%0.75975%0.747SS**  trans-110.166.3169.2-81.4-42.5000111.2
23N33.4Very low33.6Very low142 Ų142130.3 Ų130.376%0.75973%0.733SS**SBendtrans-152.8132.8157.4-117.2-44.8000111.6
24I38Very low33.3Very low151 Ų151126.8 Ų126.877%0.77472%0.716SS**  trans62.476165.8-44.7158.7000112.8
25S30.4Very low33.4Very low95 Ų95130.4 Ų130.466%0.66472%0.717SS**  50.3111.357.6-161.30000114
26L29Very low33.4Very low164 Ų164129.3 Ų129.386%0.85971%0.712SS**  trans47.9118.1154.9-61168000118.1
27K32.3Very low33.3Very low188 Ų188128.3 Ų128.382%0.81771%0.712SS**  -178.4117.690.3-164.3144.6-177.5169.30112.5
28A30.5Very low33.3Very low102 Ų102129.9 Ų129.984%0.84372%0.72SS**  trans-85.6124.9153.300000108.1
29A30.8Very low33.5Very low69 Ų69125.6 Ų125.657%0.5772%0.716SS**  trans165.2136.7150.300000111.5
30L32.9Very low33.5Very low151 Ų151130.2 Ų130.279%0.79172%0.723SS**  trans69.2141.6161.6-57.2146.5000115
31D33.1Very low33.3Very low75 Ų75130 Ų13040%0.40172%0.716SS.*  cis-152.1155.916.7-163.8-129.7000114.4Q33 I549D31-Q33 PolarHBondContact O-N 3.5Å; D31-Q33 WeakPolarHBondContact OD1-CG 3.39Å; D31-Q33 PolarHBondContact OD1-NE2 3.34Å; D31-I549 HydrophobicContact CB-CD1 3.47Å; D31-I549 VanDerWaalsContact CB-CD1 3.47Å; D31-I549 HydrophobicContact CB-CG1 3.86Å; D31-I549 WeakPolarHBondContact OD1-CG1 3.47Å
32N30.1Very low33.4Very low145 Ų145130.3 Ų130.378%0.77571%0.712SS**  trans-80.384.7175.1-89.3-29.4000111.6N34 S547N32-N34 PolarHBondContact O-N 3.4Å; N32-S547 VanDerWaalsContact O-CB 3.29Å; N32-S547 WeakPolarHBondContact O-CB 3.09Å; N32-S547 PolarHBondContact O-OG 3.09Å
33Q35.2Very low33.7Very low90 Ų90130.1 Ų130.142%0.42171%0.711SS.*  trans-69.456.5170.5-1179.219.800120.9D31 A548D31-Q33 PolarHBondContact O-N 3.5Å; D31-Q33 WeakPolarHBondContact OD1-CG 3.39Å; D31-Q33 PolarHBondContact OD1-NE2 3.34Å; Q33-A548 VanDerWaalsContact NE2-N 3.14Å
34N31.6Very low34Very low88 Ų88130.8 Ų130.847%0.47172%0.715SS.*PPolyproline II helixtrans-71.8123.3170.1-14937.1000110.4N32 H546 S547N32-N34 PolarHBondContact O-N 3.4Å; N34-H546 WeakPolarHBondContact CB-ND1 3.33Å; N34-H546 PolarHBondContact ND2-CE1 3.18Å; N34-H546 PolarHBondContact ND2-ND1 3.24Å; N34-H546 PolarHBondContact ND2-NE2 3.09Å; N34-H546 PolarHBondContact O-ND1 3.42Å; N34-S547 WeakPolarHBondContact CA-OG 3.49Å; N34-S547 WeakPolarHBondContact CB-OG 3.32Å; N34-S547 PolarHBondContact N-OG 3.08Å; N34-S547 WeakPolarHBondContact O-CB 3.07Å; N34-S547 PolarHBondContact O-OG 3.2Å
35F35Very low33.8Very low195 Ų195126.5 Ų126.586%0.85571%0.708SS**PPolyproline II helixtrans-97.5124.7172.2-102-93.2000110.6H546F35-H546 PolarHBondContact O-CE1 3.33Å
36D34.2Very low34.2Very low108 Ų108130.5 Ų130.558%0.57872%0.721SS**PPolyproline II helixtrans-100.8159.1171.5-140.2-24.2000110.9H546D36-H546 VanDerWaalsContact CA-CE1 3.47Å; D36-H546 WeakPolarHBondContact CA-CE1 3.43Å; D36-H546 WeakPolarHBondContact CB-CE1 3.29Å; D36-H546 WeakPolarHBondContact CB-NE2 3.18Å; D36-H546 VanDerWaalsContact CG-NE2 3.3Å; D36-H546 PolarHBondContact N-CE1 2.87Å; D36-H546 PolarHBondContact N-ND1 3.39Å; D36-H546 VanDerWaalsContact N-ND1 3.18Å; D36-H546 IonicContact OD2-CD2 3.79Å; D36-H546 PolarHBondContact OD2-CD2 3.2Å; D36-H546 IonicContact OD2-CE1 2.69Å; D36-H546 IonicContact OD2-NE2 2.95Å; D36-H546 PolarHBondContact OD2-NE2 3.5Å; D36-H546 VanDerWaalsContact OD2-NE2 3.09Å
37L34.7Very low34.5Very low160 Ų160127.9 Ų127.984%0.83872%0.716SS**PPolyproline II helixtrans-97150.3171.5-69.5161.4000109.8
38N34.7Very low34.9Very low169 Ų169124.9 Ų124.990%0.90471%0.713SS**  trans140.8138.6131.5-165.724.4000114.7
39G34.3Very low35.6Very low59 Ų59126 Ų12661%0.60871%0.712SS**  trans82.5143.3167.300000116.9
40Q35.9Very low35.9Very low185 Ų185125.6 Ų125.686%0.86472%0.715SS**  cis-163.8136.8-8.1-146.9172.3-36.600111.6
41S33.9Very low36.3Very low88 Ų88129 Ų12962%0.61572%0.724SS**  trans26.7118.115360.60000122.8
42H39.2Very low36.4Very low171 Ų171128.9 Ų128.979%0.79274%0.739SS**  -172.5110.4112.7-118.6-89.2000108.1
43D37.9Very low36.8Very low137 Ų137128.9 Ų128.973%0.73374%0.744SS**  83.3150.472.3-121.3-42.6000115.2
44D40.5Very low36.5Very low156 Ų156131 Ų13183%0.83476%0.759SS**  trans66.2130.9-171.6-59.7-55.2000117
45G34.6Very low36.7Very low61 Ų61135.1 Ų135.163%0.62978%0.779SS**  cis157.5153.9-3.500000112
46L38.1Very low36.4Very low180 Ų180131.2 Ų131.294%0.94277%0.771SS**  trans75.1146.6173.9-52.2144.1000117.7
47S36Very low36.5Very low109 Ų109132 Ų13276%0.76279%0.785SS**  cis-163.5140-31.1-170.80000110.5
48V39.3Very low36.3Very low125 Ų125133.7 Ų133.776%0.75879%0.785SS**  trans-75.3172.9164.5-152.70000107.1
49P45Very low36.2Very low124 Ų124131.2 Ų131.281%0.80578%0.778SS**  cis-158.7170.927.445.5-22.2000122.9
50G38.2Very low35.9Very low62 Ų62138.9 Ų138.964%0.63979%0.789SS**  114.6154.7109.700000122.4
51K40.4Very low35.5Very low223 Ų223137.7 Ų137.797%0.9779%0.785SS**  trans74.8142.8168.2-50.3165.7-174.7173.40114.8
52G36.6Very low35.4Very low71 Ų71141.1 Ų141.173%0.73280%0.796SS**  cis166168.7-0.200000108.2
53V37.9Very low34.8Very low146 Ų146139 Ų13989%0.88580%0.801SS**  cis-150.8166.11.6179.30000108.6
54N29.1Very low34.7Very low135 Ų135137.8 Ų137.872%0.72280%0.803SS**  trans-58.7158.9174.2-93.1-72.8000116
55I35.9Very low34.1Very low174 Ų174134 Ų13489%0.89280%0.801SS**  -162.9151.7114.7-96154000111.6
56V28.9Very low33.9Very low113 Ų113138.9 Ų138.969%0.68581%0.81SS**  trans-97.7144.6-161.1164.10000113.7
57S35.2Very low33.6Very low124 Ų124135.9 Ų135.987%0.86780%0.802SS**  trans-162.9126.6136.2-82.50000112.8
58K30.3Very low33.3Very low196 Ų196136 Ų13685%0.85281%0.809SS**  trans-89.8166.5171.8-99.2174.6179.9173.10109
59P33.8Very low32.9Very low117 Ų117135.5 Ų135.576%0.7681%0.812SS**  cis-154.1157.842.241.8-19.9000120.9
60R26.8Very low32.3Very low220 Ų220135.9 Ų135.983%0.8382%0.817SS**  trans50.3105.3133-168-171.1-161.1176.45.5119.6
61M28.9Very low32Very low160 Ų160136.5 Ų136.579%0.78882%0.823SS**  trans-149.1136.3139.1-93.4-56116.400112.6
62L30.4Very low31.7Very low160 Ų160131.1 Ų131.184%0.83881%0.813SS**  trans22.5125152.5-59.8164.7000120.9
63S28Very low31.4Very low127 Ų127130.7 Ų130.789%0.88881%0.808SS**  trans-123.2121.2159.5-178.20000109.8
64S33.9Very low31.2Very low111 Ų111128 Ų12878%0.77679%0.792SS**  trans-146.8112.3167.553.60000107.4
65G28Very low31.5Very low77 Ų77128.1 Ų128.179%0.79479%0.792SS**  trans-73.4151.5-170.900000114.1
66I31.9Very low31.6Very low162 Ų162124.8 Ų124.883%0.83178%0.776SS**  trans-117.4129.9171.4-60.9175.2000107.5
67P30.7Very low31.9Very low118 Ų118125.4 Ų125.477%0.76677%0.773SS**  trans-77.7141.4174.232.2-33.3000111
68A29.1Very low32.1Very low111 Ų111123.1 Ų123.192%0.91776%0.762SS**  trans-73.3126.3176.800000111.6
69S31.8Very low32.4Very low115 Ų115118 Ų11880%0.80475%0.748SS**  trans-107.8124.3169.865.70000111.1G71S69-G71 PolarHBondContact O-N 2.79Å
70S32Very low32.7Very low131 Ų131115.3 Ų115.392%0.91673%0.73SS**  trans-76101.8176.134.40000111.7
71G31.9Very low33.1Very low75 Ų75108.5 Ų108.577%0.77371%0.714SS**  trans-80.2126.4178.200000113.4S69 G73S69-G71 PolarHBondContact O-N 2.79Å; G71-G73 PolarHBondContact O-N 3.11Å
72C33.5Very low33.4Very low111 Ų111103.7 Ų103.775%0.7569%0.691SS**  trans-82.2105.5172.6179.70000110.5
73G31.1Very low33.6Very low62 Ų6299.6 Ų99.664%0.63969%0.687SS**  trans-93134.9175.700000112.9G71G71-G73 PolarHBondContact O-N 3.11Å
74T34.7Very low34Very low89 Ų8995.4 Ų95.455%0.54666%0.66SS.*  trans-101.9124.2167.6-55.40000109.2T132T74-T132 HydrophobicContact CG2-CG2 3.89Å
75L35.4Very low33.9Very low137 Ų13795.7 Ų95.772%0.71765%0.653SS**EExtended strand (participates in β ladder)trans-94.4111.6172.2-74.3169.1000109.9
76N36.9Very low34Very low105 Ų10595 Ų9556%0.56164%0.639SS**EExtended strand (participates in β ladder)trans-87.6116.1166.4-82.4-25.2000108.8K130N76-K130 PolarHBondContact ND2-NZ 3.03Å; N76-K130 WeakPolarHBondContact OD1-CE 3.13Å; N76-K130 PolarHBondContact OD1-NZ 2.95Å
77M35.8Very low33.9Very low125 Ų12593.8 Ų93.862%0.61664%0.642SS**PPolyproline II helixtrans-82.2157.5167.3-70.3-74.6-108.800110.8
78A39.3Very low33.9Very low76 Ų7692 Ų9263%0.62865%0.645SS**PPolyproline II helixtrans-63.4152172.900000111.6V80A78-V80 PolarHBondContact O-N 3.26Å
79P36.6Very low33.9Very low89 Ų8996 Ų9658%0.57864%0.641SS**PPolyproline II helixtrans-64.5127.7178.126.2-33.9000111.3T128P79-T128 HydrophobicContact CB-CG2 4.25Å
80V39Very low33.8Very low60 Ų6094.8 Ų94.836%0.36463%0.625SS.*EExtended strand (participates in β ladder)trans-96.6133.3-180-176.70000109.6A78 A84 T128A78-V80 PolarHBondContact O-N 3.26Å; V80-A84 HydrophobicContact CG1-CB 4.27Å; V80-T128 WeakPolarHBondContact O-CA 3.46Å
81P35.4Very low33.5Very low77 Ų7792.4 Ų92.450%0.562%0.621SS.*EExtended strand (participates in β ladder)trans-72137176.728.7-34.2000111.6G83 A84 Q127P81-G83 PolarHBondContact O-N 3.38Å; P81-G83 VanDerWaalsContact O-N 3.1Å; P81-A84 WeakPolarHBondContact O-CB 3.44Å; P81-A84 PolarHBondContact O-N 3.43Å; P81-Q127 WeakPolarHBondContact CA-O 3.37Å
82I35.7Very low33.3Very low60 Ų6095.7 Ų95.731%0.30862%0.62SS.*G310 helixtrans-65.3-15.6-178.7-76162.2000113.1A84 L85 V126 Q127 V129I82-A84 PolarHBondContact O-N 3.09Å; I82-L85 HydrophobicContact CG1-CD1 4.18Å; I82-L85 WeakPolarHBondContact O-CB 3.45Å; I82-L85 PolarHBondContact O-N 3.18Å; I82-V126 HydrophobicContact CD1-CB 3.83Å; I82-V126 HydrophobicContact CD1-CG1 3.48Å; I82-V126 VanDerWaalsContact CD1-CG1 3.48Å; I82-V126 WeakPolarHBondContact CD1-O 3.26Å; I82-Q127 PolarHBondContact N-O 2.92Å; I82-V129 HydrophobicContact CD1-CG1 4.38Å; I82-V129 HydrophobicContact CG1-CG2 4.31Å
83G35.6Very low32.9Very low74 Ų7495.4 Ų95.476%0.76362%0.617SS**G310 helixtrans-61.8-19.216700000114.3P81 L85P81-G83 PolarHBondContact O-N 3.38Å; P81-G83 VanDerWaalsContact O-N 3.1Å; G83-L85 VanDerWaalsContact C-N 3.27Å
84A35.6Very low32.7Very low39 Ų3999.8 Ų99.832%0.32263%0.625SS.*G310 helixtrans-89.318.3170.300000113V80 P81 I82 I90V80-A84 HydrophobicContact CG1-CB 4.27Å; P81-A84 WeakPolarHBondContact O-CB 3.44Å; P81-A84 PolarHBondContact O-N 3.43Å; I82-A84 PolarHBondContact O-N 3.09Å; A84-I90 HydrophobicContact CB-CD1 4.11Å; A84-I90 WeakPolarHBondContact O-CD1 3.21Å
85L31.2Very low32.4Very low117 Ų11799.9 Ų99.961%0.61363%0.629SS**  trans-12544.4175-63.5171.4000110.5I82 G83 V129I82-L85 HydrophobicContact CG1-CD1 4.18Å; I82-L85 WeakPolarHBondContact O-CB 3.45Å; I82-L85 PolarHBondContact O-N 3.18Å; G83-L85 VanDerWaalsContact C-N 3.27Å; L85-V129 HydrophobicContact CD1-CG2 4.45Å
86A30.6Very low32.2Very low61 Ų61101.1 Ų101.150%0.50464%0.636SS.*  trans-88.5136.6173.900000111.1G88A86-G88 PolarHBondContact O-N 2.93Å
87P30.6Very low31.8Very low138 Ų138103.3 Ų103.390%0.89665%0.648SS**THydrogen-bonded Turntrans-67.2119.9-179.327.3-33.6000111.1
88G31Very low31.3Very low80 Ų80105.3 Ų105.383%0.82566%0.655SS**THydrogen-bonded Turntrans100.93.1161.400000118.7A86A86-G88 PolarHBondContact O-N 2.93Å
89K27.7Very low30.7Very low194 Ų194107.8 Ų107.884%0.84366%0.658SS**  trans-14768.1176.3-72.6-165.9178.2-178.40115.5
90I29.8Very low30.3Very low91 Ų91111 Ų11147%0.46767%0.668SS.*  trans-136.487.2160.1-59.5-173.1000109.5A84 L92A84-I90 HydrophobicContact CB-CD1 4.11Å; A84-I90 WeakPolarHBondContact O-CD1 3.21Å; I90-L92 HydrophobicContact CG2-CD1 3.63Å; I90-L92 HydrophobicContact CG2-CG 3.57Å
91G25.1Very low29.8Very low80 Ų80113.1 Ų113.183%0.82568%0.684SS**  trans-93.7112.5149.900000106.9
92L28.1Very low29.3Very low145 Ų145116.5 Ų116.576%0.75970%0.696SS**  trans-97.8127.4173.2-76.3165.1000108.9I90 L94I90-L92 HydrophobicContact CG2-CD1 3.63Å; I90-L92 HydrophobicContact CG2-CG 3.57Å; L92-L94 PolarHBondContact O-N 3.25Å
93P26.8Very low28.8Very low105 Ų105122.7 Ų122.768%0.68272%0.721SS**  trans-65.5134177.827.7-33.3000110S95P93-S95 PolarHBondContact O-N 2.88Å
94L26.3Very low28.4Very low153 Ų153125.6 Ų125.680%0.80172%0.719SS**SBendtrans-7589.8178.7-150.676.9000108.4L92L92-L94 PolarHBondContact O-N 3.25Å
95S27.9Very low27.9Very low92 Ų92130.2 Ų130.264%0.64374%0.743SS**  trans-140.3-23.4-174.3-55.80000115.6P93P93-S95 PolarHBondContact O-N 2.88Å
96D31Very low27.6Very low162 Ų162128 Ų12887%0.86675%0.749SS**SBendtrans-113.719.4-177.7-63.9-53.7000113.8
97L29.6Very low27.5Very low152 Ų152132.7 Ų132.780%0.79677%0.766SS**  trans-118.472.7177.2-78.8165.9000110.8
98E24.7Very low27.4Very low167 Ų167131.6 Ų131.678%0.7876%0.761SS**  trans-65.5134.7164-167.3-168.9102.100109.8
99N26.6Very low27.3Very low128 Ų128130.8 Ų130.868%0.68475%0.753SS**SBendtrans70.887.6177.4-51.3-55.9000117.3
100I29Very low27.3Very low155 Ų155127.6 Ų127.680%0.79575%0.752SS**  176.9132.1122.9-87.8151.6000108.2
101P27Very low27.2Very low106 Ų106131.3 Ų131.369%0.68877%0.772SS**  trans-80127.9-169.330.8-35.1000113.4F103P101-F103 HydrophobicContact CB-CD2 4.36Å; P101-F103 HydrophobicContact CB-CE2 4.2Å
102I24.9Very low27.1Very low148 Ų148134.7 Ų134.776%0.75977%0.766SS**  trans-100107.5168.1-56.4173000107.9
103F26.8Very low27.1Very low190 Ų190135 Ų13583%0.83377%0.768SS**  trans-94.1111.8167.4-82.8-77000110P101P101-F103 HydrophobicContact CB-CD2 4.36Å; P101-F103 HydrophobicContact CB-CE2 4.2Å
104N25.3Very low27Very low135 Ų135137.8 Ų137.872%0.72277%0.772SS**  trans-89.6123.3178-178.721000109.9
105T25.8Very low27.1Very low135 Ų135135 Ų13583%0.82877%0.771SS**  trans-143.4112.5168.8540000110.9
106G25.7Very low27.1Very low71 Ų71139 Ų13973%0.73278%0.784SS**SBendtrans109.497.5165.900000114.8
107D27.7Very low26.8Very low160 Ų160141 Ų14186%0.85679%0.788SS**  trans72.4143.3165.1-148.811.3000118.5
108S28.1Very low26.7Very low114 Ų114137.1 Ų137.180%0.79779%0.785SS**  trans-110.499-165.154.80000112
109G29.2Very low26.8Very low63 Ų63132.7 Ų132.765%0.64978%0.784SS**  trans-148.2131.8172.300000112.4
110P28.4Very low26.9Very low128 Ų128131.3 Ų131.383%0.83179%0.791SS**  trans-68.1142.9166.730.6-33.1000109.7E112P110-E112 PolarHBondContact O-N 3.27Å
111L26.4Very low27Very low169 Ų169132.5 Ų132.589%0.88579%0.793SS**  trans-69.5100.1-179.7-152.983.6000110.3L113L111-L113 PolarHBondContact O-N 2.96Å
112E24.7Very low27.3Very low151 Ų151131.7 Ų131.771%0.70680%0.795SS**  trans-75.4102.1179.9-171.8-179.9117.600111P110 Q114P110-E112 PolarHBondContact O-N 3.27Å; E112-Q114 HydrophobicContact CG-CG 4.27Å; E112-Q114 PolarHBondContact O-N 2.82Å; E112-Q114 VanDerWaalsContact O-N 3.13Å; E112-Q114 VanDerWaalsContact OE1-CG 3.24Å; E112-Q114 WeakPolarHBondContact OE1-CG 3.48Å; E112-Q114 PolarHBondContact OE1-NE2 2.84Å
113L27.2Very low27.9Very low150 Ų150130.7 Ų130.779%0.78579%0.79SS**  trans-75.894.4164.1-77.4169.4000109.3L111 A115L111-L113 PolarHBondContact O-N 2.96Å; L113-A115 PolarHBondContact O-N 2.92Å
114Q25.3Very low28.2Very low164 Ų164130.8 Ų130.877%0.76679%0.794SS**  trans-60.5104.9171.8-75.8-173.5-32.300110.8E112 L116E112-Q114 HydrophobicContact CG-CG 4.27Å; E112-Q114 PolarHBondContact O-N 2.82Å; E112-Q114 VanDerWaalsContact O-N 3.13Å; E112-Q114 VanDerWaalsContact OE1-CG 3.24Å; E112-Q114 WeakPolarHBondContact OE1-CG 3.48Å; E112-Q114 PolarHBondContact OE1-NE2 2.84Å; Q114-L116 PolarHBondContact O-N 3.37Å
115A27.9Very low28.8Very low95 Ų95128 Ų12879%0.78580%0.796SS**  trans-70.3121.7170.400000109.5L113 Q117L113-A115 PolarHBondContact O-N 2.92Å; A115-Q117 PolarHBondContact O-N 3.09Å
116L27.3Very low29.4Very low176 Ų176123.5 Ų123.592%0.92177%0.769SS**  trans-55.8124.1177.1-100.5165.2000110.8Q114 G118Q114-L116 PolarHBondContact O-N 3.37Å; L116-G118 PolarHBondContact O-N 3.4Å
117Q25.4Very low30Very low204 Ų204127.8 Ų127.895%0.95377%0.77SS**  trans-76.381.6-173-166.2171.119.500110.8A115A115-Q117 PolarHBondContact O-N 3.09Å
118G27.6Very low30.6Very low70 Ų70122.2 Ų122.272%0.72274%0.742SS**  trans-167.7111.5-179.700000115.6L116L116-G118 PolarHBondContact O-N 3.4Å
119G27.1Very low31.3Very low75 Ų75117.9 Ų117.977%0.77371%0.71SS**  trans76.2104.6157.600000116.7Q121G119-Q121 PolarHBondContact O-N 2.91Å
120A27.3Very low32.4Very low99 Ų99118.4 Ų118.482%0.81869%0.694SS**  trans-68.1102.717200000111.9
121Q31.2Very low33.6Very low180 Ų180115 Ų11584%0.84167%0.669SS**  trans-127.284.8158.5-72.2-65.3-81.900108.1G119 L123G119-Q121 PolarHBondContact O-N 2.91Å; Q121-L123 PolarHBondContact O-N 2.92Å
122A33.2Very low34.9Very low89 Ų89107.5 Ų107.574%0.73663%0.63SS**  trans-65.2130173.900000109.6Q124A122-Q124 PolarHBondContact O-N 3.33Å
123L38.4Very low36.4Very low126 Ų126104.4 Ų104.466%0.6662%0.615SS**  trans-67.576.2176-77.9164.5000111.2Q121 G125 V126Q121-L123 PolarHBondContact O-N 2.92Å; L123-G125 PolarHBondContact O-N 3.44Å; L123-V126 HydrophobicContact CB-CG2 4.21Å; L123-V126 HydrophobicContact CD2-CG2 4.36Å
124Q33.8Very low37.9Very low193 Ų19399 Ų9990%0.90259%0.586SS**THydrogen-bonded Turntrans-63.9117.9169.2-74.5-172.6-39.500109.5A122A122-Q124 PolarHBondContact O-N 3.33Å
125G37.5Very low39Very low75 Ų7596 Ų9677%0.77358%0.575SS**THydrogen-bonded Turntrans117.3-17.8173.400000115.5L123L123-G125 PolarHBondContact O-N 3.44Å
126V37.4Very low39.8Very low41 Ų4192.9 Ų92.925%0.24855%0.548CS..  trans-88.2115.2175.4-166.60000109I82 L123 T128 T146I82-V126 HydrophobicContact CD1-CB 3.83Å; I82-V126 HydrophobicContact CD1-CG1 3.48Å; I82-V126 VanDerWaalsContact CD1-CG1 3.48Å; I82-V126 WeakPolarHBondContact CD1-O 3.26Å; L123-V126 HydrophobicContact CB-CG2 4.21Å; L123-V126 HydrophobicContact CD2-CG2 4.36Å; V126-T128 WeakPolarHBondContact CG1-O 3.33Å; V126-T146 HydrophobicContact CG1-CG2 3.56Å; V126-T146 HydrophobicContact CG2-CG2 4.45Å
127Q39.3Very low41.4Very low162 Ų16287.3 Ų87.376%0.75753%0.533SS*.  trans-97.1-27.3177.2-78.5-173.76.700114P81 I82P81-Q127 WeakPolarHBondContact CA-O 3.37Å; I82-Q127 PolarHBondContact N-O 2.92Å
128T40.3Very low42.6Very low43 Ų4386 Ų8626%0.26453%0.532SS..EExtended strand (participates in β ladder)trans-139.2150.1-176.949.90000111.3P79 V80 V126 P147P79-T128 HydrophobicContact CB-CG2 4.25Å; V80-T128 WeakPolarHBondContact O-CA 3.46Å; V126-T128 WeakPolarHBondContact CG1-O 3.33Å; T128-P147 VanDerWaalsContact O-CD 3.25Å; T128-P147 WeakPolarHBondContact O-CD 3.35Å; T128-P147 VanDerWaalsContact OG1-CG 3.27Å; T128-P147 WeakPolarHBondContact OG1-CG 3.19Å
129V41.4Very low43.2Very low22 Ų2288.3 Ų88.313%0.13352%0.524CS..EExtended strand (participates in β ladder)trans-127.9137.9168.7-84.90000109.1I82 L85 T146I82-V129 HydrophobicContact CD1-CG1 4.38Å; I82-V129 HydrophobicContact CG1-CG2 4.31Å; L85-V129 HydrophobicContact CD1-CG2 4.45Å; V129-T146 HydrophobicContact CG1-CG2 4Å
130K52.7Low44.2Very low74 Ų7492.3 Ų92.332%0.32252%0.523SS..EExtended strand (participates in β ladder)trans-93.2116.1170.2178.1-175.6177.9-173.60108.8N76 T132 T145N76-K130 PolarHBondContact ND2-NZ 3.03Å; N76-K130 WeakPolarHBondContact OD1-CE 3.13Å; N76-K130 PolarHBondContact OD1-NZ 2.95Å; K130-T132 WeakPolarHBondContact CE-OG1 3.47Å; K130-T145 PolarHBondContact N-O 2.94Å; K130-T145 PolarHBondContact O-N 3.31Å; K130-T145 PolarHBondContact O-OG1 2.9Å
131L54.3Low45.3Very low57 Ų5789.2 Ų89.230%0.29849%0.494SS..EExtended strand (participates in β ladder)trans-86.1126.3168.9-68.4161.9000108.9I142 L144L131-I142 HydrophobicContact CD2-CG2 3.84Å; L131-L144 HydrophobicContact CD2-CD1 3.97Å; L131-L144 HydrophobicContact CD2-CG 3.86Å
132T54.2Low46.2Very low12 Ų1284.4 Ų84.47%0.07447%0.473CS..EExtended strand (participates in β ladder)trans-123116.5174.1-47.60000109T74 K130 I134 L143T74-T132 HydrophobicContact CG2-CG2 3.89Å; K130-T132 WeakPolarHBondContact CE-OG1 3.47Å; T132-I134 HydrophobicContact CG2-CG1 4.1Å; T132-L143 PolarHBondContact N-O 3.4Å; T132-L143 PolarHBondContact O-N 3.47Å
133F55.7Low47.3Very low86 Ų8682.8 Ų82.838%0.37745%0.452SS..EExtended strand (participates in β ladder)trans-85.2121.6173.2-69.2-93.6000108.9I142F133-I142 HydrophobicContact CD1-CD1 4.35Å; F133-I142 HydrophobicContact CD1-CG1 3.89Å; F133-I142 HydrophobicContact CE1-CD1 3.61Å; F133-I142 HydrophobicContact CE1-CG1 3.66Å; F133-I142 HydrophobicContact CZ-CD1 4.2Å; F133-I142 HydrophobicContact CZ-CG1 4.45Å
134I58.1Low48.1Very low37 Ų3780.4 Ų80.419%0.1944%0.439CS..EExtended strand (participates in β ladder)trans-117.8109.3-179.6-48.3178.3000107.4T132 C136 T141 L143T132-I134 HydrophobicContact CG2-CG1 4.1Å; I134-C136 PolarHBondContact O-SG 2.99Å; I134-T141 PolarHBondContact N-O 2.98Å; I134-T141 PolarHBondContact O-N 2.96Å; I134-L143 HydrophobicContact CD1-CB 4.21Å; I134-L143 HydrophobicContact CD1-CD2 4.29Å
135N49.8Very low48.8Very low99 Ų9973.7 Ų73.753%0.52941%0.412SS..EExtended strand (participates in β ladder)trans-76.2126.3173.3-167.2-2.5000109.6G137N135-G137 PolarHBondContact OD1-O 3.37Å; N135-G137 VanDerWaalsContact OD1-O 3.08Å
136C43.7Very low49.5Very low31 Ų3173.4 Ų73.421%0.20940%0.395CS..  trans-127.149.1-166.2-58.30000111.8I134 Q139 R432I134-C136 PolarHBondContact O-SG 2.99Å; C136-Q139 WeakPolarHBondContact CA-O 3.33Å; C136-Q139 VanDerWaalsContact CB-O 3.31Å; C136-Q139 WeakPolarHBondContact CB-O 3.31Å; C136-Q139 PolarHBondContact N-O 3.48Å; C136-R432 PolarHBondContact SG-NH1 3.27Å
137G61.8Low49.7Very low59 Ų5974.7 Ų74.761%0.60840%0.404SS*.SBendtrans82.2-119.7-170.300000109.1N135 Q139N135-G137 PolarHBondContact OD1-O 3.37Å; N135-G137 VanDerWaalsContact OD1-O 3.08Å; G137-Q139 VanDerWaalsContact C-N 3.26Å; G137-Q139 PolarHBondContact O-N 3.43Å
138D49.9Very low49.8Very low175 Ų17572.5 Ų72.594%0.93641%0.406SS*.SBendtrans-83.6-3.2-179-42.8-43.3000112.7
139Q40.7Very low49.9Very low120 Ų12075.7 Ų75.756%0.56143%0.426SS*.  trans-115.1133.1-177.2-63.4-176.8-0.800111.8C136 G137C136-Q139 WeakPolarHBondContact CA-O 3.33Å; C136-Q139 VanDerWaalsContact CB-O 3.31Å; C136-Q139 WeakPolarHBondContact CB-O 3.31Å; C136-Q139 PolarHBondContact N-O 3.48Å; G137-Q139 VanDerWaalsContact C-N 3.26Å; G137-Q139 PolarHBondContact O-N 3.43Å
140Q47.9Very low49.5Very low158 Ų15883.5 Ų83.574%0.73846%0.461SS*.EExtended strand (participates in β ladder)trans-94.7127168.5-60.4-173.82000109.8
141T50Low48.5Very low35 Ų3588.9 Ų88.922%0.21548%0.484CS..EExtended strand (participates in β ladder)trans-112.6133.6175.7-50.40000110.3I134I134-T141 PolarHBondContact N-O 2.98Å; I134-T141 PolarHBondContact O-N 2.96Å
142I51.3Low47.3Very low79 Ų7992.2 Ų92.241%0.40551%0.508SS..EExtended strand (participates in β ladder)trans-101.5118.9172.4-49-179.1000108.5L131 F133 L144L131-I142 HydrophobicContact CD2-CG2 3.84Å; F133-I142 HydrophobicContact CD1-CD1 4.35Å; F133-I142 HydrophobicContact CD1-CG1 3.89Å; F133-I142 HydrophobicContact CE1-CD1 3.61Å; F133-I142 HydrophobicContact CE1-CG1 3.66Å; F133-I142 HydrophobicContact CZ-CD1 4.2Å; F133-I142 HydrophobicContact CZ-CG1 4.45Å; I142-L144 HydrophobicContact CG2-CD1 4.08Å
143L56.1Low46.2Very low54 Ų5499.7 Ų99.728%0.28354%0.544SS..EExtended strand (participates in β ladder)trans-100123.6173.1177.266.9000109.8T132 I134 T145T132-L143 PolarHBondContact N-O 3.4Å; T132-L143 PolarHBondContact O-N 3.47Å; I134-L143 HydrophobicContact CD1-CB 4.21Å; I134-L143 HydrophobicContact CD1-CD2 4.29Å; L143-T145 HydrophobicContact CD1-CG2 4.49Å; L143-T145 HydrophobicContact CD2-CG2 4.1Å; L143-T145 HydrophobicContact CG-CG2 4.07Å
144L54.3Low45Very low76 Ų76101 Ų10140%0.39856%0.561SS.*EExtended strand (participates in β ladder)trans-95.2124.4169.8-76.576.6000108.8L131 I142L131-L144 HydrophobicContact CD2-CD1 3.97Å; L131-L144 HydrophobicContact CD2-CG 3.86Å; I142-L144 HydrophobicContact CG2-CD1 4.08Å
145T49.4Very low43.7Very low53 Ų53106.5 Ų106.533%0.32559%0.591SS.*EExtended strand (participates in β ladder)trans-127131172.543.80000110K130 L143K130-T145 PolarHBondContact N-O 2.94Å; K130-T145 PolarHBondContact O-N 3.31Å; K130-T145 PolarHBondContact O-OG1 2.9Å; L143-T145 HydrophobicContact CD1-CG2 4.49Å; L143-T145 HydrophobicContact CD2-CG2 4.1Å; L143-T145 HydrophobicContact CG-CG2 4.07Å
146T50.3Low43Very low68 Ų68110.7 Ų110.742%0.41761%0.607SS.*  trans-81.3136.9167.147.10000108.9V126 V129 S148V126-T146 HydrophobicContact CG1-CG2 3.56Å; V126-T146 HydrophobicContact CG2-CG2 4.45Å; V129-T146 HydrophobicContact CG1-CG2 4Å; T146-S148 PolarHBondContact O-N 3.19Å
147P43.5Very low42.5Very low68 Ų68114.6 Ų114.644%0.44264%0.635SS.*  trans-73.2118.5171.828-28.9000109.1T128 T149T128-P147 VanDerWaalsContact O-CD 3.25Å; T128-P147 WeakPolarHBondContact O-CD 3.35Å; T128-P147 VanDerWaalsContact OG1-CG 3.27Å; T128-P147 WeakPolarHBondContact OG1-CG 3.19Å; P147-T149 PolarHBondContact O-N 2.58Å
148S41.3Very low41.5Very low116 Ų116118 Ų11881%0.81164%0.638SS**  trans-65.993.2-179.9-45.10000111.3T146T146-S148 PolarHBondContact O-N 3.19Å
149T41.5Very low40.8Very low110 Ų110116.6 Ų116.668%0.67563%0.631SS**  trans-79.9130.3166.946.90000109.7P147 F151P147-T149 PolarHBondContact O-N 2.58Å; T149-F151 PolarHBondContact O-N 2.88Å
150H33.2Very low40.7Very low187 Ų187113.6 Ų113.687%0.86663%0.632SS**  trans-78.679.9-168.9-149.9-81.3000111.3
151F31Very low40.1Very low186 Ų186113 Ų11382%0.81663%0.631SS**  trans-109.4125.8173-96.8-85.3000111.6T149 M153T149-F151 PolarHBondContact O-N 2.88Å; F151-M153 PolarHBondContact O-N 3.48Å
152T29.3Very low39.5Very low128 Ų128115.7 Ų115.779%0.78565%0.647SS**  trans-77.199.9-177.849.10000111.6
153M31.7Very low38.4Very low168 Ų168117.9 Ų117.983%0.82866%0.659SS**  trans-134.6141.2160.3-77.1-68.1-78.500108.6F151F151-M153 PolarHBondContact O-N 3.48Å
154P31.1Very low37.3Very low114 Ų114121.1 Ų121.174%0.7468%0.681SS**SBendtrans-76.5142.2177.631.8-33.1000111.1
155D29.5Very low36.1Very low153 Ų153124.2 Ų124.282%0.81870%0.698SS**SBendtrans65.277.9160.1-151.731.2000118
156Q34.9Very low35.1Very low186 Ų186126.3 Ų126.387%0.86971%0.712SS**  trans-172.1100.5141.7-107164.7105.400111L158Q156-L158 PolarHBondContact O-N 3.06Å
157S34.1Very low34.4Very low114 Ų114129.5 Ų129.580%0.79773%0.726SS**  trans-8394.6177.257.90000111.5D159S157-D159 VanDerWaalsContact C-N 3.28Å; S157-D159 PolarHBondContact O-N 3.23Å
158L40.4Very low34.1Very low129 Ų129133.3 Ų133.368%0.67574%0.743SS**  trans-89.550.6177.6-155.285.3000112.6Q156 G160Q156-L158 PolarHBondContact O-N 3.06Å; L158-G160 PolarHBondContact O-N 3.33Å
159D35.8Very low33.8Very low147 Ų147134.7 Ų134.779%0.78674%0.741SS**  trans-81.2111.3-179.6-85.9-55.4000112.4S157S157-D159 VanDerWaalsContact C-N 3.28Å; S157-D159 PolarHBondContact O-N 3.23Å
160G38.9Very low33.4Very low56 Ų56136.7 Ų136.758%0.57775%0.747SS**  trans80.156.7155.300000117.8L158 T162L158-G160 PolarHBondContact O-N 3.33Å; G160-T162 PolarHBondContact O-N 2.92Å; G160-T162 VanDerWaalsContact O-N 3.11Å
161M34.6Very low33.2Very low147 Ų147132.2 Ų132.272%0.72474%0.741SS**  trans-65.7108.5169.4-155.475.4-172.400110.9
162T37.1Very low33.2Very low90 Ų90129.1 Ų129.155%0.55274%0.738SS**  trans-96.9118.8174.5-57.80000109.5G160 T164G160-T162 PolarHBondContact O-N 2.92Å; G160-T162 VanDerWaalsContact O-N 3.11Å; T162-T164 HydrophobicContact CG2-CG2 4.37Å
163L29Very low33.2Very low126 Ų126130.7 Ų130.766%0.6674%0.742SS**  trans-99.1112.6171.9-69.6174.5000109.7
164T31.6Very low33.1Very low121 Ų121129.6 Ų129.674%0.74274%0.739SS**PPolyproline II helixtrans-97.7121.3168.850.30000109.3T162T162-T164 HydrophobicContact CG2-CG2 4.37Å
165L30.5Very low32.9Very low142 Ų142130.4 Ų130.474%0.74374%0.737SS**PPolyproline II helixtrans-75.4143172-73.1164.8000110.2
166P28.4Very low33Very low96 Ų96131.7 Ų131.762%0.62374%0.735SS**PPolyproline II helixtrans-68149.8177.9-18.532000113N168P166-N168 PolarHBondContact O-N 3.2Å
167D35.8Very low32.6Very low135 Ų135127.3 Ų127.372%0.72273%0.731SS**G310 helixtrans-61.7-7.7-172-57.9-75.8000116.2L169D167-L169 PolarHBondContact O-N 2.92Å
168N35.6Very low32.3Very low149 Ų149124.8 Ų124.880%0.79772%0.723SS**G310 helixtrans-85.15.2-170-72.5-17.4000115.9P166P166-N168 PolarHBondContact O-N 3.2Å
169L35.9Very low31.7Very low144 Ų144126.9 Ų126.975%0.75473%0.734SS**G310 helixtrans-112.97.1178.8-69.4176.7000114.4D167D167-L169 PolarHBondContact O-N 2.92Å
170L33.4Very low31.3Very low153 Ų153126.4 Ų126.480%0.80174%0.736SS**  trans-12735.1-177.6-65.8174.5000112.6
171A29.3Very low30.7Very low92 Ų92129.6 Ų129.676%0.7675%0.75SS**  trans-103.415.8-176.300000114.6
172T31Very low30.5Very low121 Ų121130.9 Ų130.974%0.74276%0.756SS**SBendtrans-108.7129176.314.20000111.3L174T172-L174 PolarHBondContact O-N 2.81Å; T172-L174 VanDerWaalsContact O-N 3.16Å
173D27.9Very low30Very low162 Ų162135.1 Ų135.187%0.86677%0.77SS**  trans-55.7109.2-169.3-64.5-82.4000115.1N175D173-N175 PolarHBondContact O-N 3.46Å
174L30.5Very low29.9Very low145 Ų145137.6 Ų137.676%0.75978%0.783SS**  trans-91.477.8167.6-71.3-179.8000111T172 F176T172-L174 PolarHBondContact O-N 2.81Å; T172-L174 VanDerWaalsContact O-N 3.16Å; L174-F176 HydrophobicContact CB-CD2 4.32Å; L174-F176 HydrophobicContact CB-CE2 4.07Å; L174-F176 HydrophobicContact CD2-CE2 4.36Å; L174-F176 PolarHBondContact O-N 3.39Å
175N27.7Very low29.9Very low131 Ų131134.4 Ų134.470%0.70177%0.774SS**  trans-76108.5175.3-179.114.8000111.6D173 A177D173-N175 PolarHBondContact O-N 3.46Å; N175-A177 PolarHBondContact OD1-N 2.8Å
176F30.8Very low30Very low180 Ų180136.4 Ų136.479%0.78978%0.779SS**  trans-111.947.6174.7-75.9-77.1000113.1L174 G178L174-F176 HydrophobicContact CB-CD2 4.32Å; L174-F176 HydrophobicContact CB-CE2 4.07Å; L174-F176 HydrophobicContact CD2-CE2 4.36Å; L174-F176 PolarHBondContact O-N 3.39Å; F176-G178 PolarHBondContact O-N 3.42Å
177A26.8Very low29.9Very low93 Ų93141 Ų14177%0.76980%0.795SS**  trans-92.177166.900000111.2N175N175-A177 PolarHBondContact OD1-N 2.8Å
178G27.3Very low29.9Very low62 Ų62140.8 Ų140.864%0.63980%0.799SS**  trans176.9157176.100000114.2F176F176-G178 PolarHBondContact O-N 3.42Å
179L27.5Very low29.7Very low172 Ų172140 Ų14090%0.90181%0.805SS**  trans76.176.2176.8-48.9-175.3000116.4S181L179-S181 PolarHBondContact O-N 3.33Å
180T27.6Very low29.6Very low137 Ų137136.7 Ų136.784%0.8481%0.806SS**PPolyproline II helixtrans-50.9119.1145.9490000110.6
181S27.5Very low29.6Very low124 Ų124136.1 Ų136.187%0.86780%0.803SS**PPolyproline II helixtrans-72.5137.6173.7-167.30000111L179L179-S181 PolarHBondContact O-N 3.33Å
182M30Very low30Very low173 Ų173137.7 Ų137.785%0.85280%0.799SS**PPolyproline II helixtrans-82.9144.2-175-66.7-155.873.300113
183Q25.5Very low30.3Very low179 Ų179141.1 Ų141.184%0.83680%0.803SS**PPolyproline II helixtrans-63.4126.5169.7-171.286.810.900110.5
184L28.3Very low30.9Very low179 Ų179138 Ų13894%0.93779%0.792SS**  trans-127.9108.4157-156.177.5000108.8
185G31.1Very low31.1Very low53 Ų53138.3 Ų138.355%0.54679%0.794SS.*  trans-105.4150.1-17800000112.8
186E31.6Very low31.6Very low185 Ų185136.5 Ų136.586%0.86479%0.792SS**  trans43.1109.5158-86.4164.584.100120.2
187M27.8Very low32Very low193 Ų193133.2 Ų133.295%0.95179%0.791SS**  trans-81.6131.5156.6-61.9178.1-78.300109.9
188T34.6Very low32.6Very low130 Ų130138.2 Ų138.280%0.79880%0.799SS**  trans-115.4144170.255.90000112.2
189S31Very low32.9Very low132 Ų132138.4 Ų138.492%0.92380%0.801SS**  trans-71.4160.6-162.3-49.30000118.6
190G34.8Very low33.4Very low75 Ų75135.6 Ų135.677%0.77380%0.796SS**  trans123.5140.5149.300000114.6
191N32Very low33.9Very low141 Ų141139.3 Ų139.375%0.75480%0.8SS**  cis-162.3173.9-14.4-165.135.7000108.8
192D37.7Very low34.1Very low124 Ų124138.2 Ų138.266%0.66379%0.793SS**  trans77.791.3158.4-60.8-57.1000122.8
193K37.3Very low34.3Very low194 Ų194136.8 Ų136.884%0.84379%0.794SS**  52.7159.4109.4-113.7-160.3170.6176.90122.7
194P40.9Very low34.4Very low95 Ų95134.4 Ų134.462%0.61779%0.786SS**  -136.7-156.3-71.643.8-25000114.2
195N34.6Very low34.5Very low153 Ų153136.4 Ų136.482%0.81878%0.783SS**  trans96.8141.7166.5-71.1-10.6000116.7
196S39.3Very low34.6Very low93 Ų93139.3 Ų139.365%0.6579%0.79SS**  cis-164.5153.90.640.80000112.8
197S38.7Very low34.6Very low111 Ų111137.4 Ų137.478%0.77679%0.786SS**  trans57.7140.3156.951.60000118.6
198E38.6Very low34.9Very low197 Ų197136.6 Ų136.692%0.92178%0.782SS**  cis-136.6164.729.5-64.9175.5112.300113.7
199G33.9Very low35Very low66 Ų66137.2 Ų137.268%0.6878%0.781SS**  trans-127.5-176166.100000110.2
200S37.7Very low35.1Very low114 Ų114136.8 Ų136.880%0.79778%0.778SS**  cis-163.8146.77.5-64.90000109.7
201K38.6Very low35.1Very low215 Ų215141 Ų14194%0.93578%0.782SS**  trans-175.7113.9133-105164.4-175177.20111.2
202S31.8Very low35.5Very low101 Ų101139.2 Ų139.271%0.70678%0.778SS**  trans-98154-171.6-470000113
203T33.4Very low35.8Very low143 Ų143138.9 Ų138.988%0.87778%0.783SS**  trans-134.3116.2145.2-56.20000106.9
204N28.1Very low35.7Very low128 Ų128138 Ų13868%0.68479%0.785SS**  trans-78.8149.2-178.6-73-43.4000110.9
205Y30Very low35.8Very low221 Ų221137.4 Ų137.487%0.86778%0.78SS**  -158.798.1124.5-87.4-60.6000111.5
206T34.7Very low36.1Very low114 Ų114133 Ų13370%0.69976%0.761SS**  trans39.995141.1520000120.6
207N30Very low36.2Very low145 Ų145132.8 Ų132.878%0.77576%0.756SS**  18.3117.9123-161.67.7000118.1
208M34.3Very low36.7Very low176 Ų176131.4 Ų131.487%0.86775%0.746SS**  trans-96.1110.8174.9-66.1-77.7-8800110.1
209N38.3Very low36.9Very low143 Ų143125.7 Ų125.777%0.76572%0.722SS**PPolyproline II helixtrans-61.6142.2175.8-88.318.1000112L211N209-L211 PolarHBondContact O-N 3.4Å
210S33.3Very low37.7Very low124 Ų124129.9 Ų129.987%0.86772%0.721SS**PPolyproline II helixtrans-56.7133.7177.7-57.10000112.9
211L34.4Very low38.3Very low162 Ų162129.3 Ų129.385%0.84871%0.709SS**PPolyproline II helixtrans-77.4147.8173.2-72.7163.1000111N209N209-L211 PolarHBondContact O-N 3.4Å
212P40.9Very low38.7Very low105 Ų105128.1 Ų128.168%0.68270%0.7SS**PPolyproline II helixtrans-70.2156.5178.330.1-35.5000112.2
213P43.1Very low39.6Very low117 Ų117126.4 Ų126.476%0.7669%0.688SS**PPolyproline II helixtrans-64.6146.9-178.826.9-34.7000112.6T215P213-T215 PolarHBondContact O-N 3.33Å
214I35.8Very low40.4Very low176 Ų176125.6 Ų125.690%0.90367%0.674SS**  trans-76.6109.1-174.1-51.5171.9000109.2
215T42.5Very low41.4Very low81 Ų81126.4 Ų126.450%0.49768%0.677SS.*  trans-82.1159.1179.957.20000113P213P213-T215 PolarHBondContact O-N 3.33Å
216S41.5Very low42.5Very low60 Ų60119 Ų11942%0.4266%0.661SS.*  trans-64.5153.1179.1-178.60000111.1S218 D219S216-S218 PolarHBondContact O-N 2.91Å; S216-S218 VanDerWaalsContact O-N 3.09Å; S216-S218 PolarHBondContact OG-N 3.13Å; S216-D219 WeakPolarHBondContact CA-OD2 3.3Å; S216-D219 WeakPolarHBondContact CB-OD2 3.34Å; S216-D219 PolarHBondContact N-OD2 2.88Å; S216-D219 WeakPolarHBondContact O-CB 3.41Å; S216-D219 PolarHBondContact O-N 3.03Å
217V41.1Very low43.1Very low89 Ų89119.4 Ų119.454%0.53966%0.659SS.*Hα-helixtrans-60-17.8171.3-76.80000113
218S48.7Very low43.8Very low82 Ų82118.8 Ų118.857%0.57366%0.656SS**Hα-helixtrans-70.8-38.9169.1-550000113.1S216 L221 Y222S216-S218 PolarHBondContact O-N 2.91Å; S216-S218 VanDerWaalsContact O-N 3.09Å; S216-S218 PolarHBondContact OG-N 3.13Å; S218-L221 PolarHBondContact O-N 3.35Å; S218-Y222 PolarHBondContact O-N 3.1Å
219D43.9Very low44.1Very low78 Ų78117.5 Ų117.542%0.41765%0.652SS.*Hα-helixtrans-72-34.8-173.3-58.1-46.2000112.1S216 S223S216-D219 WeakPolarHBondContact CA-OD2 3.3Å; S216-D219 WeakPolarHBondContact CB-OD2 3.34Å; S216-D219 PolarHBondContact N-OD2 2.88Å; S216-D219 WeakPolarHBondContact O-CB 3.41Å; S216-D219 PolarHBondContact O-N 3.03Å; D219-S223 WeakPolarHBondContact O-CB 3.5Å; D219-S223 PolarHBondContact O-N 3.38Å; D219-S223 VanDerWaalsContact O-N 3.11Å; D219-S223 PolarHBondContact O-OG 3.33Å
220K49.8Very low43.9Very low153 Ų153119.5 Ų119.567%0.66566%0.657SS**Hα-helixtrans-66.3-35.2175.6-82.6-167.9170.5-171.20113.2Q224K220-Q224 PolarHBondContact O-N 3.09Å
221L50.5Low43.9Very low103 Ų103119.5 Ų119.554%0.53966%0.657SS.*Hα-helixtrans-76.8-36.4178.4-78.3167.8000112.4S218 Q224 I225S218-L221 PolarHBondContact O-N 3.35Å; L221-Q224 PolarHBondContact O-N 3.47Å; L221-I225 PolarHBondContact O-N 2.86Å
222Y46.7Very low44.1Very low190 Ų190119.9 Ų119.975%0.74566%0.658SS**Hα-helixtrans-68.5-37.8177.1-154.4-98.4000112S218 Q224 A226S218-Y222 PolarHBondContact O-N 3.1Å; Y222-Q224 VanDerWaalsContact C-N 3.34Å; Y222-Q224 PolarHBondContact O-N 2.86Å; Y222-A226 WeakPolarHBondContact O-CB 3.31Å; Y222-A226 PolarHBondContact O-N 2.87Å
223S51.3Low43.8Very low65 Ų65123.9 Ų123.946%0.45567%0.668SS.*Hα-helixtrans-72.3-23.7178.3-53.80000113.7D219 N227D219-S223 WeakPolarHBondContact O-CB 3.5Å; D219-S223 PolarHBondContact O-N 3.38Å; D219-S223 VanDerWaalsContact O-N 3.11Å; D219-S223 PolarHBondContact O-OG 3.33Å; S223-N227 PolarHBondContact O-ND2 2.81Å
224Q49Very low43.4Very low126 Ų126127.6 Ų127.659%0.58968%0.675SS**Hα-helixtrans-73.8-42.1175.8-161.378.248.600111K220 L221 Y222 A226K220-Q224 PolarHBondContact O-N 3.09Å; L221-Q224 PolarHBondContact O-N 3.47Å; Y222-Q224 VanDerWaalsContact C-N 3.34Å; Y222-Q224 PolarHBondContact O-N 2.86Å; Q224-A226 VanDerWaalsContact C-N 3.32Å; Q224-A226 PolarHBondContact O-N 3.27Å
225I50.2Low43.4Very low144 Ų144123.4 Ų123.474%0.73866%0.662SS**Hα-helixtrans-74.8-23.2-177.2-61.3167.2000112L221L221-I225 PolarHBondContact O-N 2.86Å
226A53.8Low43.2Very low66 Ų66127.7 Ų127.755%0.54568%0.676SS.*Hα-helixtrans-87-15.5-179.100000115.1Y222 Q224Y222-A226 WeakPolarHBondContact O-CB 3.31Å; Y222-A226 PolarHBondContact O-N 2.87Å; Q224-A226 VanDerWaalsContact C-N 3.32Å; Q224-A226 PolarHBondContact O-N 3.27Å
227N46.9Very low42.7Very low122 Ų122129 Ų12965%0.65269%0.685SS**Hα-helixtrans-109.9-6-170.3-75.4-56.9000115.5S223 N229S223-N227 PolarHBondContact O-ND2 2.81Å; N227-N229 PolarHBondContact O-N 3.37Å
228D44.6Very low42.4Very low133 Ų133135 Ų13571%0.71170%0.699SS**THydrogen-bonded Turntrans-79.827177.4-73.7-26.7000113.3
229N39.5Very low41.8Very low148 Ų148134.6 Ų134.679%0.79170%0.701SS**THydrogen-bonded Turntrans-141.625.4-167.2-145.720.9000116.2N227N227-N229 PolarHBondContact O-N 3.37Å
230E35.1Very low41.5Very low186 Ų186137.9 Ų137.987%0.86972%0.717SS**  trans-157.499.6165.4-139.2-179.410600112.9
231S33.3Very low41.2Very low123 Ų123139.3 Ų139.386%0.8673%0.726SS**  trans169.383152.8-81.70000112.3
232I38.4Very low40.6Very low170 Ų170141.1 Ų141.187%0.87274%0.736SS**  trans-129.3114155.2-64.7-175.7000108
233Q35.1Very low40.2Very low189 Ų189139.5 Ų139.588%0.88374%0.739SS**  trans-67.6137.1175.5-74.2174-69.100111
234Q32.9Very low39.5Very low196 Ų196145.8 Ų145.892%0.91676%0.758SS**  trans-79.1119167.2-69.2173.3-2500110.5
235S37.6Very low39Very low88 Ų88144.9 Ų144.962%0.61576%0.764SS**  trans-169.3148148.950.90000112
236H36.7Very low38.2Very low171 Ų171143.9 Ų143.979%0.79276%0.764SS**  trans67101.4177-47.4-74.7000114.9
237S31.2Very low37.2Very low87 Ų87147.8 Ų147.861%0.60877%0.773SS**  cis80134.945.7-165.10000114.5
238Y35.6Very low36.8Very low215 Ų215151.3 Ų151.384%0.84379%0.785SS**  trans72.1143.4-179.3-42.3-72.8000116.3
239A36.6Very low36.6Very low73 Ų73152.7 Ų152.760%0.60379%0.785SS**  cis176.3139.5-37.900000107.1
240I37.1Very low36.4Very low148 Ų148153 Ų15376%0.75979%0.787SS**  trans69.5142.3157.4-61160000113
241E44.1Very low36.4Very low182 Ų182150.1 Ų150.185%0.8578%0.777SS**  cis-146.6177.813.4-143.5138.1-14900112.2
242D36.2Very low36.6Very low141 Ų141150.6 Ų150.675%0.75477%0.766SS**  trans-63.1161.3174-145.5-47.6000114.1
243L38.2Very low36.7Very low156 Ų156150.1 Ų150.182%0.81776%0.758SS**  trans164.1121.1141.6-90.6158.4000114
244K37.9Very low36.8Very low197 Ų197147.7 Ų147.786%0.85775%0.75SS**  trans-103.7133.5154.2-77.3177.8177172.10110.1
245P37.7Very low37.2Very low108 Ų108146.6 Ų146.670%0.70174%0.744SS**  trans-137.4146.2130.120.7-0.4000111.5
246V33.5Very low37.5Very low123 Ų123148.7 Ų148.775%0.74575%0.749SS**  cis84109431780000114.1
247M33.6Very low37.7Very low148 Ų148144 Ų14473%0.72975%0.746SS**  trans73.6123.4153.8-71.6179.276.100123.5
248Q37.5Very low38.1Very low196 Ų196147.2 Ų147.292%0.91676%0.757SS**  -170.5123.5126.8-96.2153.112.900106.5
249K40.2Very low38.3Very low162 Ų162141.8 Ų141.870%0.70475%0.75SS**  cis97.3112.827.3-166.6-179.1-175.1-178.10113.5
250N36Very low38.4Very low154 Ų154141.3 Ų141.382%0.82475%0.746SS**  trans-178.8110.8153.4-82.2-21.8000104.2
251N35.4Very low38.4Very low126 Ų126145.2 Ų145.267%0.67475%0.753SS**  58.3137.158.9-130.254.9000112.3
252E37.5Very low38.1Very low132 Ų132140 Ų14062%0.61774%0.741SS**  cis-120.1-157.717.2-46.4-14694.200112.2
253K40.1Very low38.4Very low161 Ų161142 Ų14270%0.775%0.745SS**  cis-155.8170.22.5-147.5151.7-171.81460113.7
254L37.8Very low38.4Very low138 Ų138139.9 Ų139.972%0.72374%0.739SS**  trans-24143.7168.7-58.6167000118.5
255H41.1Very low38.3Very low173 Ų173136.8 Ų136.880%0.80173%0.732SS**  -158.5159.965.8-150.9-84000115.2
256D43.6Very low38.4Very low132 Ų132140.3 Ų140.371%0.70674%0.739SS**  trans-65.4163.1-179.3-47.7-99.6000115
257G40.3Very low38.7Very low72 Ų72140.1 Ų140.174%0.74274%0.743SS**  cis162.2176.1-3.400000113.8
258N39.1Very low39Very low154 Ų154137 Ų13782%0.82475%0.749SS**  trans84.7120.8156.7-153.927.1000122.9
259S40.5Very low39.1Very low102 Ų102134.8 Ų134.871%0.71374%0.743SS**  trans47.9158.4143.6-67.40000124
260A38.6Very low39Very low62 Ų62134.4 Ų134.451%0.51275%0.748SS.*  cis-179.5159.5-28.600000109.2
261Y37.1Very low39Very low231 Ų231134.6 Ų134.691%0.90675%0.749SS**  trans68.5153.9169.4-45.4-77.7000118.5
262A38.8Very low39.2Very low71 Ų71132.9 Ų132.959%0.58775%0.753SS**  cis-171.4151-3400000110.8
263H40.8Very low39.2Very low183 Ų183132.1 Ų132.185%0.84776%0.762SS**  trans64.4153.3162.3-57-59.3000118.3
264T38.3Very low39.3Very low112 Ų112130.1 Ų130.169%0.68777%0.765SS**  cis-160153.81.6-115.40000113.8
265N36Very low39.1Very low132 Ų132130 Ų13071%0.70677%0.77SS**  trans-0.9140163.3-49.1-22.1000125.3
266Q41Very low38.7Very low183 Ų183127.5 Ų127.586%0.85577%0.767SS**  170.4125.1114.9-91.9165.496.500110.3
267S39.9Very low38.4Very low119 Ų119127.9 Ų127.983%0.83277%0.773SS**  91.8118.763.3-670000114.7
268G40.3Very low38.3Very low83 Ų83129.5 Ų129.586%0.85677%0.769SS**  trans148.287160.500000121.1
269N38.4Very low38.3Very low149 Ų149127.8 Ų127.880%0.79777%0.769SS**  trans12.4131.1155.5-77.70.6000126.1
270L39.3Very low38.1Very low153 Ų153130.6 Ų130.680%0.80177%0.771SS**  35129.7117.4-49.5172.4000118.9
271N35.8Very low38Very low158 Ų158135.7 Ų135.785%0.84579%0.79SS**  178.4176.653.7-164.87.5000110.5
272A39Very low37.8Very low91 Ų91128.5 Ų128.575%0.75277%0.77SS**  trans90135.6168.800000119.4
273S38.2Very low37.6Very low116 Ų116134.7 Ų134.781%0.81178%0.784SS**  trans-88.2-167.4-159.5-44.80000114.9
274P41.6Very low37.2Very low119 Ų119131.8 Ų131.877%0.77378%0.775SS**  -121.2167.1-95.537.5-21000113.5
275V34.4Very low37.3Very low136 Ų136135.7 Ų135.782%0.82479%0.785SS**  trans172.2145.1150140.70000112.1
276V32.6Very low37.2Very low119 Ų119134 Ų13472%0.72178%0.784SS**  trans57.4118165.71690000119.6
277V36.3Very low37.3Very low140 Ų140132.2 Ų132.285%0.84879%0.785SS**  trans-136.8117.8133.9178.90000109.4
278T37.8Very low37Very low107 Ų107132.7 Ų132.766%0.65678%0.778SS**  trans-82.1128166.5-67.30000109.1Q280T278-Q280 PolarHBondContact O-N 2.94Å
279S38.8Very low36.8Very low118 Ų118135.4 Ų135.483%0.82578%0.778SS**  trans-82.7107.6165.2-66.40000109.6
280Q37.1Very low36.9Very low160 Ų160136.9 Ų136.975%0.74878%0.777SS**  trans-75149.6171.5-63.9175.3-16.900110.1T278T278-Q280 PolarHBondContact O-N 2.94Å
281N35.8Very low36.9Very low170 Ų170135.3 Ų135.391%0.90978%0.776SS**  trans-129.5122.5148.1-1625.2000107.7
282T34.3Very low36.7Very low80 Ų80133.7 Ų133.749%0.49177%0.772SS.*  trans-111.1133.1-163.1-64.90000109.6
283F34.6Very low37.1Very low200 Ų200139.3 Ų139.388%0.87778%0.779SS**  trans-119.6108160.8-157.7-95000108.8
284N32.6Very low36.8Very low123 Ų123140.2 Ų140.266%0.65877%0.774SS**  trans-83.9147.6-178.7-88.4-22.3000111.3
285Q38.7Very low37Very low193 Ų193141.7 Ų141.790%0.90277%0.774SS**  trans-140126149.7-161.716992.700108.5
286S35.3Very low37.1Very low97 Ų97142.1 Ų142.168%0.67877%0.772SS**  trans-127.2136.7-167.9-54.40000111.7
287V41.6Very low37.5Very low146 Ų146142.1 Ų142.189%0.88577%0.774SS**  trans-163.8154155.1-82.60000107.9
288N34.8Very low37.9Very low128 Ų128139.2 Ų139.268%0.68477%0.772SS**  cis-168.2126.9-33179-7.6000105
289V36.8Very low38Very low140 Ų140140.9 Ų140.985%0.84878%0.777SS**  trans-116.4134.6179-178.10000109.6
290K39.9Very low38.3Very low180 Ų180140.9 Ų140.978%0.78377%0.772SS**  trans-112156.1178.2-76.7-174.1177.7179.20112.4
291P37.9Very low38.7Very low120 Ų120138.4 Ų138.478%0.77977%0.773SS**  trans-115.8162.4-149.540.4-30.9000117.2
292V33.6Very low39.1Very low124 Ų124135.8 Ų135.875%0.75277%0.765SS**  trans1.3139.3154.1-176.50000119.9
293K45.5Very low39.5Very low210 Ų210140 Ų14091%0.91378%0.783SS**  trans-134.9158.7145.3-152.6171.6-177.2-177.10111.2
294L33Very low39.8Very low135 Ų135135.2 Ų135.271%0.70777%0.772SS**  trans-110173.6-155.9-144.782.2000113.5
295I44.6Very low40.1Very low149 Ų149138.1 Ų138.176%0.76478%0.781SS**  trans82.2132.8164.9-55.3139.5000113.3
296D38.2Very low40.4Very low145 Ų145136 Ų13678%0.77578%0.781SS**  cis-151153.228.3-163.741.7000113.4
297P40.4Very low40.5Very low120 Ų120139.1 Ų139.178%0.77979%0.79SS**  trans-126.5140.3173.138.4-24.6000116.8
298G45Very low40.3Very low78 Ų78135.4 Ų135.480%0.80478%0.781SS**  trans170153.4167.700000110.3
299N40.3Very low40.5Very low142 Ų142134.6 Ų134.676%0.75979%0.786SS**  cis-165.2158.88.6-179.726.6000109.2
300V45.2Very low40.8Very low118 Ų118135.3 Ų135.372%0.71579%0.785SS**  trans51.2142.9166.2-71.80000120.5
301S45.2Very low40.8Very low109 Ų109136.2 Ų136.276%0.76279%0.792SS**  cis-161.5160.1-6.2-106.90000112.1
302P42.5Very low40.9Very low115 Ų115139.9 Ų139.975%0.74780%0.799SS**  trans-120.9155.9-172.141.1-29.1000116.2
303I43.1Very low41.2Very low169 Ų169137.5 Ų137.587%0.86780%0.8SS**  trans-155.2159.2158.612.2178.6000110.1
304P42.2Very low40.9Very low99 Ų99133.9 Ų133.964%0.64379%0.79SS**  -136.1173-117.638.6-18.4000117.7
305Q38.1Very low41.4Very low183 Ų183135 Ų13586%0.85580%0.797SS**  trans49.1109.9148-70.6173.2-67.300120.3
306V45.1Very low41.2Very low150 Ų150135.6 Ų135.691%0.90980%0.796SS**  -131.9140.5128.5-163.40000107.7
307D37Very low41.3Very low161 Ų161133.7 Ų133.786%0.86179%0.794SS**  trans-75.8146.2-176.1-167.620.6000111.9
308G38.7Very low41.5Very low68 Ų68134.9 Ų134.970%0.70179%0.794SS**  trans-179.688.8-17000000112.1D310G308-D310 PolarHBondContact O-N 2.64Å
309S38.7Very low41.5Very low112 Ų112134.9 Ų134.978%0.78378%0.779SS**  trans-83.4100-178.356.50000112.1
310D42Very low41.7Very low155 Ų155134.5 Ų134.583%0.82978%0.777SS**  trans-135.1124.7161.9-85-55000110.3G308G308-D310 PolarHBondContact O-N 2.64Å
311Q40.8Very low41.9Very low199 Ų199136 Ų13693%0.9378%0.781SS**  trans-110.771.4-175.5-166.61691700109.1G313Q311-G313 PolarHBondContact O-N 3.38Å; Q311-G313 VanDerWaalsContact O-N 3.11Å
312E40.6Very low42.4Very low196 Ų196134.3 Ų134.392%0.91676%0.762SS**  trans-69106177.8-74.3-164.5111.100111.5
313G38.5Very low43.3Very low75 Ų75132 Ų13277%0.77375%0.749SS**  trans-87.6135.1161.700000110.7Q311Q311-G313 PolarHBondContact O-N 3.38Å; Q311-G313 VanDerWaalsContact O-N 3.11Å
314N38.9Very low45Very low133 Ų133131.8 Ų131.871%0.71174%0.744SS**  trans-147.564.1165.2-164.93.1000110.6Q316N314-Q316 WeakPolarHBondContact OD1-CG 3.38Å
315D43.6Very low47.1Very low158 Ų158127.9 Ų127.985%0.84572%0.718SS**  trans-84.1115.9157.9-163.72.8000106.6S317D315-S317 PolarHBondContact O-N 3.18Å
316Q40.5Very low49.7Very low162 Ų162124.1 Ų124.176%0.75770%0.704SS**  trans-75.976.3-170.2-72.9-175.1-1.300111.4N314 L318N314-Q316 WeakPolarHBondContact OD1-CG 3.38Å; Q316-L318 PolarHBondContact O-N 3.07Å
317S40.9Very low52Low105 Ų105117.2 Ų117.273%0.73466%0.662SS**  trans-58.5119.6167.757.90000110.1D315D315-S317 PolarHBondContact O-N 3.18Å
318L44.4Very low54.8Low146 Ų146116 Ų11676%0.76465%0.649SS**  trans-45.6130.3169.2-66.3149.7000109.7Q316 D320 M322Q316-L318 PolarHBondContact O-N 3.07Å; L318-D320 PolarHBondContact O-N 3.05Å; L318-M322 HydrophobicContact CB-CE 4.35Å
319P44.8Very low57.5Low78 Ų78115.2 Ų115.251%0.50663%0.629SS.*  trans-64.3122.3-172.523.3-32.5000111.1D321 M322P319-D321 PolarHBondContact O-N 2.93Å; P319-D321 VanDerWaalsContact O-N 3.1Å; P319-M322 HydrophobicContact CG-CE 4.09Å; P319-M322 PolarHBondContact O-N 3.4Å
320D45.7Very low60.2Low134 Ų134110.2 Ų110.272%0.71759%0.593SS**G310 helixtrans-67.5-6.8-179.7-154.915.8000112.3L318 M322 S323L318-D320 PolarHBondContact O-N 3.05Å; D320-M322 PolarHBondContact O-N 3.26Å; D320-M322 VanDerWaalsContact O-N 3.13Å; D320-S323 WeakPolarHBondContact O-CB 3.47Å; D320-S323 PolarHBondContact O-N 3.19Å; D320-S323 PolarHBondContact O-OG 3.24Å
321D48.3Very low62.8Low149 Ų149102.9 Ų102.980%0.79755%0.554SS**G310 helixtrans-59-17166.9-70.4-37.6000113.7P319 S323P319-D321 PolarHBondContact O-N 2.93Å; P319-D321 VanDerWaalsContact O-N 3.1Å; D321-S323 PolarHBondContact O-N 2.84Å
322M55.2Low65.5Low74 Ų7499 Ų9937%0.36554%0.536SS..G310 helixtrans-70.9-5.9169.2-77.1-174.4-81.400113.8L318 P319 D320L318-M322 HydrophobicContact CB-CE 4.35Å; P319-M322 HydrophobicContact CG-CE 4.09Å; P319-M322 PolarHBondContact O-N 3.4Å; D320-M322 PolarHBondContact O-N 3.26Å; D320-M322 VanDerWaalsContact O-N 3.13Å
323S61.6Low68.2Low67 Ų6796.1 Ų96.147%0.46952%0.517SS..G310 helixtrans-73.2-25.3-173.263.90000114.7D320 D321 W370D320-S323 WeakPolarHBondContact O-CB 3.47Å; D320-S323 PolarHBondContact O-N 3.19Å; D320-S323 PolarHBondContact O-OG 3.24Å; D321-S323 PolarHBondContact O-N 2.84Å; S323-W370 PolarHBondContact O-NE1 3.44Å
324E79.8Confident71Confident163 Ų16392.5 Ų92.576%0.76248%0.48SS*.  trans-136.974.1-177.9-166.3162.3-154.700114.6N326E324-N326 PolarHBondContact O-N 3.04Å
325L85.7Confident73.8Confident18 Ų1888 Ų889%0.09446%0.458CS..  trans-74121.5170.5-70.1179.6000112T327 L330 W370 W384L325-T327 PolarHBondContact O-N 2.74Å; L325-L330 HydrophobicContact CD1-CD2 4.46Å; L325-W370 HydrophobicContact CB-CD2 4.18Å; L325-W370 HydrophobicContact CB-CE3 3.98Å; L325-W370 HydrophobicContact CB-CH2 4.28Å; L325-W370 HydrophobicContact CB-CZ2 4.47Å; L325-W370 HydrophobicContact CB-CZ3 4.04Å; L325-W370 HydrophobicContact CD1-CH2 3.81Å; L325-W370 HydrophobicContact CD1-CZ2 4.49Å; L325-W370 HydrophobicContact CD1-CZ3 3.93Å; L325-W370 HydrophobicContact CG-CH2 4.25Å; L325-W370 HydrophobicContact CG-CZ2 4.49Å; L325-W370 HydrophobicContact CG-CZ3 4.41Å; L325-W370 VanDerWaalsContact O-CB 3.3Å; L325-W370 WeakPolarHBondContact O-CB 3.32Å; L325-W384 HydrophobicContact CD1-CB 4.1Å; L325-W384 HydrophobicContact CD1-CG 4.17Å; L325-W384 VanDerWaalsContact CD2-CD1 3.46Å; L325-W384 HydrophobicContact CD2-CD2 4.09Å; L325-W384 HydrophobicContact CD2-CG 3.81Å
326N92.9Very high76.3Confident103 Ų10383.1 Ų83.155%0.55144%0.44SS*.  trans-68.6100.7168.7-174.4-25.9000110.7E324 K328 D329 L330E324-N326 PolarHBondContact O-N 3.04Å; N326-K328 VanDerWaalsContact C-N 3.3Å; N326-K328 PolarHBondContact O-N 3.24Å; N326-K328 PolarHBondContact OD1-N 3.02Å; N326-K328 VanDerWaalsContact OD1-N 3.08Å; N326-D329 HydrophobicContact CB-CB 4.2Å; N326-D329 PolarHBondContact OD1-N 3.34Å; N326-D329 VanDerWaalsContact OD1-N 3.15Å; N326-L330 VanDerWaalsContact O-CB 3.25Å; N326-L330 WeakPolarHBondContact O-CB 3.49Å; N326-L330 PolarHBondContact O-N 3.42Å
327T94.6Very high79Confident5 Ų576.7 Ų76.73%0.03141%0.41CS..Hα-helixtrans-68.2-24.5-17651.10000114.1L325 A331 P367 K368 W370 L373 F380L325-T327 PolarHBondContact O-N 2.74Å; T327-A331 WeakPolarHBondContact O-CB 3.12Å; T327-A331 PolarHBondContact O-N 2.93Å; T327-A331 VanDerWaalsContact O-N 3.1Å; T327-P367 WeakPolarHBondContact O-CB 3.24Å; T327-K368 WeakPolarHBondContact CB-O 3.48Å; T327-K368 PolarHBondContact OG1-O 2.74Å; T327-W370 HydrophobicContact CG2-CB 4.06Å; T327-W370 HydrophobicContact CG2-CE3 3.84Å; T327-L373 HydrophobicContact CG2-CD1 3.82Å; T327-F380 HydrophobicContact CG2-CD1 3.98Å; T327-F380 HydrophobicContact CG2-CD2 4.23Å; T327-F380 HydrophobicContact CG2-CE1 4.1Å; T327-F380 HydrophobicContact CG2-CE2 4.34Å; T327-F380 HydrophobicContact CG2-CG 4.04Å; T327-F380 HydrophobicContact CG2-CZ 4.27Å
328K93.8Very high81.6Confident135 Ų13572.3 Ų72.359%0.58738%0.378SS*.Hα-helixtrans-74.9-50.9178.6-174.5-179.5178.1-176.30110.5N326 A331 Q332 P367N326-K328 VanDerWaalsContact C-N 3.3Å; N326-K328 PolarHBondContact O-N 3.24Å; N326-K328 PolarHBondContact OD1-N 3.02Å; N326-K328 VanDerWaalsContact OD1-N 3.08Å; K328-A331 PolarHBondContact O-N 3.29Å; K328-Q332 WeakPolarHBondContact O-CG 3.41Å; K328-Q332 PolarHBondContact O-N 3.29Å; K328-P367 HydrophobicContact CB-CG 4.3Å; K328-P367 HydrophobicContact CG-CG 4.48Å
329D95.5Very high84.1Confident53 Ų5373.3 Ų73.328%0.28338%0.376SS..Hα-helixtrans-62.6-47.7175.3173.440.8000111.3N326 A331 Q332 R333N326-D329 HydrophobicContact CB-CB 4.2Å; N326-D329 PolarHBondContact OD1-N 3.34Å; N326-D329 VanDerWaalsContact OD1-N 3.15Å; D329-A331 VanDerWaalsContact C-N 3.31Å; D329-A331 PolarHBondContact O-N 3.07Å; D329-Q332 WeakPolarHBondContact O-CA 3.4Å; D329-Q332 WeakPolarHBondContact O-CB 3.36Å; D329-Q332 PolarHBondContact O-N 3.17Å; D329-R333 VanDerWaalsContact CG-NE 3.29Å; D329-R333 WeakPolarHBondContact O-CG 3.31Å; D329-R333 PolarHBondContact O-N 3.02Å; D329-R333 IonicContact OD1-CZ 2.77Å; D329-R333 IonicContact OD1-NE 3.91Å; D329-R333 PolarHBondContact OD1-NE 3.23Å; D329-R333 IonicContact OD1-NH2 3.46Å; D329-R333 IonicContact OD2-CZ 3.88Å; D329-R333 IonicContact OD2-NE 3.2Å; D329-R333 PolarHBondContact OD2-NE 3Å; D329-R333 IonicContact OD2-NH2 3.09Å; D329-R333 PolarHBondContact OD2-NH2 3.41Å
330L96.7Very high86.5Confident7 Ų778 Ų784%0.03738%0.384CS..Hα-helixtrans-56.3-42.9175.3176.658000112.7L325 N326 Q332 R333 I334 F380 M383 W384L325-L330 HydrophobicContact CD1-CD2 4.46Å; N326-L330 VanDerWaalsContact O-CB 3.25Å; N326-L330 WeakPolarHBondContact O-CB 3.49Å; N326-L330 PolarHBondContact O-N 3.42Å; L330-Q332 VanDerWaalsContact C-N 3.33Å; L330-Q332 PolarHBondContact O-N 2.8Å; L330-R333 PolarHBondContact O-N 2.96Å; L330-I334 HydrophobicContact CD1-CG1 4.08Å; L330-I334 WeakPolarHBondContact O-CB 3.46Å; L330-I334 WeakPolarHBondContact O-CG1 3.33Å; L330-I334 PolarHBondContact O-N 2.9Å; L330-F380 HydrophobicContact CD2-CB 4.1Å; L330-F380 HydrophobicContact CD2-CD1 3.99Å; L330-M383 HydrophobicContact CD1-CB 4.36Å; L330-M383 HydrophobicContact CD2-CB 4.44Å; L330-M383 HydrophobicContact CG-CB 4.47Å; L330-W384 HydrophobicContact CD1-CB 4.07Å; L330-W384 HydrophobicContact CD2-CB 3.93Å
331A96.9Very high88.8Confident1 Ų174.4 Ų74.41%0.00836%0.361CS..Hα-helixtrans-64.7-36.3175.700000112.7T327 K328 D329 S335 L364 P367T327-A331 WeakPolarHBondContact O-CB 3.12Å; T327-A331 PolarHBondContact O-N 2.93Å; T327-A331 VanDerWaalsContact O-N 3.1Å; K328-A331 PolarHBondContact O-N 3.29Å; D329-A331 VanDerWaalsContact C-N 3.31Å; D329-A331 PolarHBondContact O-N 3.07Å; A331-S335 VanDerWaalsContact O-CB 3.32Å; A331-S335 WeakPolarHBondContact O-CB 3.45Å; A331-S335 PolarHBondContact O-N 3.3Å; A331-S335 PolarHBondContact O-OG 3.11Å; A331-L364 HydrophobicContact CB-CD2 3.89Å; A331-P367 HydrophobicContact CB-CB 4.02Å; A331-P367 HydrophobicContact CB-CG 3.92Å
332Q96.9Very high91.1Very high118 Ų11872.2 Ų72.255%0.55136%0.357SS*.Hα-helixtrans-67.5-47.5174.7-73.1174.7-4000111.5K328 D329 L330 I334 S335 A336K328-Q332 WeakPolarHBondContact O-CG 3.41Å; K328-Q332 PolarHBondContact O-N 3.29Å; D329-Q332 WeakPolarHBondContact O-CA 3.4Å; D329-Q332 WeakPolarHBondContact O-CB 3.36Å; D329-Q332 PolarHBondContact O-N 3.17Å; L330-Q332 VanDerWaalsContact C-N 3.33Å; L330-Q332 PolarHBondContact O-N 2.8Å; Q332-I334 PolarHBondContact O-N 3.39Å; Q332-S335 CarbonylContact O-C 3.58Å; Q332-S335 WeakPolarHBondContact O-CB 3.2Å; Q332-S335 PolarHBondContact O-N 2.97Å; Q332-S335 VanDerWaalsContact O-N 3.11Å; Q332-A336 PolarHBondContact O-N 3.06Å
333R97.1Very high92.9Very high134 Ų13469.6 Ų69.651%0.50635%0.345SS..Hα-helixtrans-59.1-46.1176.8-64.4-178.1-166.5-156.68.2112D329 L330 S335 A336 E337 L387D329-R333 VanDerWaalsContact CG-NE 3.29Å; D329-R333 WeakPolarHBondContact O-CG 3.31Å; D329-R333 PolarHBondContact O-N 3.02Å; D329-R333 IonicContact OD1-CZ 2.77Å; D329-R333 IonicContact OD1-NE 3.91Å; D329-R333 PolarHBondContact OD1-NE 3.23Å; D329-R333 IonicContact OD1-NH2 3.46Å; D329-R333 IonicContact OD2-CZ 3.88Å; D329-R333 IonicContact OD2-NE 3.2Å; D329-R333 PolarHBondContact OD2-NE 3Å; D329-R333 IonicContact OD2-NH2 3.09Å; D329-R333 PolarHBondContact OD2-NH2 3.41Å; L330-R333 PolarHBondContact O-N 2.96Å; R333-S335 VanDerWaalsContact C-N 3.33Å; R333-S335 PolarHBondContact O-N 3.47Å; R333-A336 PolarHBondContact O-N 3.5Å; R333-E337 WeakPolarHBondContact O-CB 3.27Å; R333-E337 PolarHBondContact O-N 2.74Å; R333-L387 HydrophobicContact CB-CD1 3.67Å
334I97.6Very high94.5Very high0 Ų070.1 Ų70.10%035%0.347CS..Hα-helixtrans-60.1-42.7173.7-68-74.6000111.3L330 Q332 A336 E337 L338 F348 L364 M383 W386 L387L330-I334 HydrophobicContact CD1-CG1 4.08Å; L330-I334 WeakPolarHBondContact O-CB 3.46Å; L330-I334 WeakPolarHBondContact O-CG1 3.33Å; L330-I334 PolarHBondContact O-N 2.9Å; Q332-I334 PolarHBondContact O-N 3.39Å; I334-A336 VanDerWaalsContact C-N 3.32Å; I334-A336 PolarHBondContact O-N 3.23Å; I334-E337 PolarHBondContact O-N 3.04Å; I334-L338 HydrophobicContact CG2-CD1 3.9Å; I334-L338 HydrophobicContact CG2-CG 4.3Å; I334-L338 WeakPolarHBondContact O-CB 3.21Å; I334-L338 VanDerWaalsContact O-CG 3.23Å; I334-L338 WeakPolarHBondContact O-CG 3.13Å; I334-L338 PolarHBondContact O-N 3.48Å; I334-F348 HydrophobicContact CD1-CZ 4.12Å; I334-F348 HydrophobicContact CG2-CE1 3.92Å; I334-F348 HydrophobicContact CG2-CZ 4.44Å; I334-L364 HydrophobicContact CB-CD2 4.21Å; I334-L364 HydrophobicContact CG2-CD1 4.11Å; I334-L364 HydrophobicContact CG2-CD2 3.89Å; I334-M383 HydrophobicContact CD1-CB 3.82Å; I334-M383 HydrophobicContact CD1-CG 4.36Å; I334-M383 HydrophobicContact CG1-CB 3.94Å; I334-M383 HydrophobicContact CG1-CG 4.35Å; I334-W386 HydrophobicContact CD1-CE3 3.95Å; I334-W386 HydrophobicContact CD1-CZ3 4.21Å; I334-L387 HydrophobicContact CD1-CB 4.24Å; I334-L387 HydrophobicContact CD1-CD1 3.93Å; I334-L387 HydrophobicContact CG1-CD1 4.23Å
335S97Very high95.3Very high37 Ų3764.6 Ų64.626%0.25932%0.321SS..Hα-helixtrans-65.5-34.8178-60.30000112.8A331 Q332 R333 K339A331-S335 VanDerWaalsContact O-CB 3.32Å; A331-S335 WeakPolarHBondContact O-CB 3.45Å; A331-S335 PolarHBondContact O-N 3.3Å; A331-S335 PolarHBondContact O-OG 3.11Å; Q332-S335 CarbonylContact O-C 3.58Å; Q332-S335 WeakPolarHBondContact O-CB 3.2Å; Q332-S335 PolarHBondContact O-N 2.97Å; Q332-S335 VanDerWaalsContact O-N 3.11Å; R333-S335 VanDerWaalsContact C-N 3.33Å; R333-S335 PolarHBondContact O-N 3.47Å; S335-K339 VanDerWaalsContact O-CG 3.28Å; S335-K339 WeakPolarHBondContact O-CG 3.47Å; S335-K339 PolarHBondContact O-N 2.95Å
336A97.2Very high95.7Very high56 Ų5665.5 Ų65.546%0.46333%0.33SS..Hα-helixtrans-69.8-45.9174.200000111.3Q332 R333 I334 K339 R340Q332-A336 PolarHBondContact O-N 3.06Å; R333-A336 PolarHBondContact O-N 3.5Å; I334-A336 VanDerWaalsContact C-N 3.32Å; I334-A336 PolarHBondContact O-N 3.23Å; A336-K339 WeakPolarHBondContact O-CB 3.24Å; A336-K339 PolarHBondContact O-N 2.87Å; A336-K339 VanDerWaalsContact O-N 3.15Å; A336-R340 WeakPolarHBondContact O-CB 3.25Å; A336-R340 PolarHBondContact O-N 3.3Å
337E96.4Very high95.8Very high28 Ų2863 Ų6313%0.13132%0.319CS..Hα-helixtrans-68.7-38.6-176.3-155.273.4154.900112.5R333 I334 K339 R340 Y341 W386 R394R333-E337 WeakPolarHBondContact O-CB 3.27Å; R333-E337 PolarHBondContact O-N 2.74Å; I334-E337 PolarHBondContact O-N 3.04Å; E337-K339 VanDerWaalsContact C-N 3.29Å; E337-K339 PolarHBondContact O-N 3.44Å; E337-R340 PolarHBondContact O-N 2.85Å; E337-R340 WeakPolarHBondContact OE2-CD 3.39Å; E337-R340 IonicContact OE2-NH1 3.16Å; E337-Y341 HydrophobicContact CG-CD2 4.08Å; E337-Y341 HydrophobicContact CG-CE2 3.89Å; E337-Y341 WeakPolarHBondContact O-CD2 3.5Å; E337-Y341 PolarHBondContact O-N 3.39Å; E337-Y341 WeakPolarHBondContact OE1-CE2 3.49Å; E337-W386 HydrophobicContact CB-CZ3 4.44Å; E337-W386 HydrophobicContact CG-CH2 4.3Å; E337-W386 HydrophobicContact CG-CZ3 4.25Å; E337-R394 IonicContact OE1-CZ 2.76Å; E337-R394 IonicContact OE1-NH1 3.24Å; E337-R394 PolarHBondContact OE1-NH1 2.05Å; E337-R394 IonicContact OE1-NH2 2.83Å; E337-R394 PolarHBondContact OE1-NH2 2.95Å
338L96.3Very high95.9Very high12 Ų1262.8 Ų62.86%0.06332%0.318CS..Hα-helixtrans-62.7-35.5172.2-67.6176.2000112.2I334 S342 I343 F348 L364 W386I334-L338 HydrophobicContact CG2-CD1 3.9Å; I334-L338 HydrophobicContact CG2-CG 4.3Å; I334-L338 WeakPolarHBondContact O-CB 3.21Å; I334-L338 VanDerWaalsContact O-CG 3.23Å; I334-L338 WeakPolarHBondContact O-CG 3.13Å; I334-L338 PolarHBondContact O-N 3.48Å; L338-S342 CarbonylContact O-C 3.34Å; L338-S342 PolarHBondContact O-N 3.06Å; L338-I343 HydrophobicContact CD2-CB 3.7Å; L338-I343 HydrophobicContact CD2-CD1 4.13Å; L338-I343 HydrophobicContact CD2-CG2 3.62Å; L338-I343 PolarHBondContact O-N 2.94Å; L338-F348 HydrophobicContact CD1-CB 4.37Å; L338-F348 HydrophobicContact CD1-CD1 3.95Å; L338-F348 HydrophobicContact CD1-CG 4.31Å; L338-F348 HydrophobicContact CD2-CB 3.6Å; L338-F348 HydrophobicContact CD2-CD1 4.16Å; L338-F348 HydrophobicContact CD2-CD2 4.11Å; L338-F348 HydrophobicContact CD2-CG 3.7Å; L338-L364 HydrophobicContact CD1-CD1 4.38Å; L338-W386 HydrophobicContact CD2-CH2 4.41Å
339K95.6Very high96Very high167 Ų16756.4 Ų56.473%0.72629%0.29SS*.Hα-helixtrans-70.6-43.8173.2-73.5174178.7-174.40111.8S335 A336 E337 Y341 S342S335-K339 VanDerWaalsContact O-CG 3.28Å; S335-K339 WeakPolarHBondContact O-CG 3.47Å; S335-K339 PolarHBondContact O-N 2.95Å; A336-K339 WeakPolarHBondContact O-CB 3.24Å; A336-K339 PolarHBondContact O-N 2.87Å; A336-K339 VanDerWaalsContact O-N 3.15Å; E337-K339 VanDerWaalsContact C-N 3.29Å; E337-K339 PolarHBondContact O-N 3.44Å; K339-Y341 VanDerWaalsContact C-N 3.33Å; K339-Y341 PolarHBondContact O-N 3.2Å; K339-S342 PolarHBondContact O-N 3.35Å; K339-S342 VanDerWaalsContact O-N 3.08Å
340R96Very high95.9Very high177 Ų17759 Ų5967%0.66830%0.3SS*.Hα-helixtrans-56.4-43.8-176.7-176.8-177.6-177.9176.70.8112.8A336 E337A336-R340 WeakPolarHBondContact O-CB 3.25Å; A336-R340 PolarHBondContact O-N 3.3Å; E337-R340 PolarHBondContact O-N 2.85Å; E337-R340 WeakPolarHBondContact OE2-CD 3.39Å; E337-R340 IonicContact OE2-NH1 3.16Å
341Y94.6Very high95.7Very high58 Ų5862.6 Ų62.623%0.22731%0.314CS..THydrogen-bonded Turntrans-99.513178.1-60-77.9000113.4E337 K339 I343 E391 R394 M395E337-Y341 HydrophobicContact CG-CD2 4.08Å; E337-Y341 HydrophobicContact CG-CE2 3.89Å; E337-Y341 WeakPolarHBondContact O-CD2 3.5Å; E337-Y341 PolarHBondContact O-N 3.39Å; E337-Y341 WeakPolarHBondContact OE1-CE2 3.49Å; K339-Y341 VanDerWaalsContact C-N 3.33Å; K339-Y341 PolarHBondContact O-N 3.2Å; Y341-I343 HydrophobicContact CD2-CD1 4.37Å; Y341-I343 HydrophobicContact CG-CD1 4.45Å; Y341-I343 PolarHBondContact O-N 3.32Å; Y341-I343 VanDerWaalsContact O-N 3.11Å; Y341-E391 HydrophobicContact CE1-CG 4.4Å; Y341-E391 WeakPolarHBondContact CE1-OE1 3.41Å; Y341-E391 PolarHBondContact OH-OE2 3.46Å; Y341-R394 PolarHBondContact OH-NH2 2.84Å; Y341-M395 HydrophobicContact CD1-CE 4.44Å
342S94.6Very high95.6Very high104 Ų10463.9 Ų63.973%0.72732%0.321SS*.THydrogen-bonded Turntrans51.133.4-177.5-63.10000114.5L338 K339 P344L338-S342 CarbonylContact O-C 3.34Å; L338-S342 PolarHBondContact O-N 3.06Å; K339-S342 PolarHBondContact O-N 3.35Å; K339-S342 VanDerWaalsContact O-N 3.08Å; S342-P344 VanDerWaalsContact O-CD 3.29Å; S342-P344 WeakPolarHBondContact O-CD 3.21Å
343I94.3Very high95.4Very high18 Ų1858.3 Ų58.39%0.09230%0.295CS..  trans-77.2116.7-178.2-60.1157.4000108.9L338 Y341 Q345 F348 W386 L398L338-I343 HydrophobicContact CD2-CB 3.7Å; L338-I343 HydrophobicContact CD2-CD1 4.13Å; L338-I343 HydrophobicContact CD2-CG2 3.62Å; L338-I343 PolarHBondContact O-N 2.94Å; Y341-I343 HydrophobicContact CD2-CD1 4.37Å; Y341-I343 HydrophobicContact CG-CD1 4.45Å; Y341-I343 PolarHBondContact O-N 3.32Å; Y341-I343 VanDerWaalsContact O-N 3.11Å; I343-Q345 PolarHBondContact O-N 2.89Å; I343-F348 HydrophobicContact CG2-CB 4.25Å; I343-W386 HydrophobicContact CD1-CH2 3.97Å; I343-W386 HydrophobicContact CD1-CZ2 4.08Å; I343-L398 HydrophobicContact CD1-CD1 3.71Å; I343-L398 HydrophobicContact CG1-CD1 3.95Å; I343-L398 HydrophobicContact CG2-CD1 4.05Å; I343-L398 HydrophobicContact CG2-CD2 4Å
344P95.1Very high95.2Very high79 Ų7954.6 Ų54.651%0.51329%0.289SS..  trans-64.2133.3179.7-20.432.9000111S342 A346 V347 F348S342-P344 VanDerWaalsContact O-CD 3.29Å; S342-P344 WeakPolarHBondContact O-CD 3.21Å; P344-A346 PolarHBondContact O-N 3.47Å; P344-V347 HydrophobicContact CB-CG2 4.12Å; P344-V347 HydrophobicContact CG-CG2 4.18Å; P344-V347 WeakPolarHBondContact O-CB 3.49Å; P344-V347 PolarHBondContact O-N 3.36Å; P344-F348 PolarHBondContact O-N 3.11Å
345Q95.5Very high95Very high47 Ų4760 Ų6022%0.2231%0.309CS..Hα-helixtrans-52.1-33-178.6-171.6176.245.700112.9I343 A349 Q357 L360 S361I343-Q345 PolarHBondContact O-N 2.89Å; Q345-A349 WeakPolarHBondContact O-CB 3.05Å; Q345-A349 PolarHBondContact O-N 2.91Å; Q345-Q357 HydrophobicContact CB-CG 4.3Å; Q345-Q357 HydrophobicContact CG-CG 4.27Å; Q345-L360 HydrophobicContact CG-CB 4.23Å; Q345-L360 HydrophobicContact CG-CD2 3.46Å; Q345-L360 VanDerWaalsContact CG-CD2 3.46Å; Q345-L360 HydrophobicContact CG-CG 3.83Å; Q345-S361 PolarHBondContact OE1-OG 2.9Å
346A95.5Very high95Very high36 Ų3661.3 Ų61.330%0.29832%0.319SS..Hα-helixtrans-64.8-38.6175.600000113.4P344 Q350 Q357P344-A346 PolarHBondContact O-N 3.47Å; A346-Q350 WeakPolarHBondContact O-CB 3.46Å; A346-Q350 WeakPolarHBondContact O-CG 3.47Å; A346-Q350 PolarHBondContact O-N 3.22Å; A346-Q357 HydrophobicContact CB-CB 3.95Å; A346-Q357 HydrophobicContact CB-CG 4.06Å
347V94.4Very high94.8Very high52 Ų5262.7 Ų62.732%0.31532%0.316SS..Hα-helixtrans-66.6-52.7177.9-178.90000109.2P344 A349 Q350 R351 L398P344-V347 HydrophobicContact CB-CG2 4.12Å; P344-V347 HydrophobicContact CG-CG2 4.18Å; P344-V347 WeakPolarHBondContact O-CB 3.49Å; P344-V347 PolarHBondContact O-N 3.36Å; V347-A349 PolarHBondContact O-N 2.96Å; V347-Q350 PolarHBondContact O-N 3.23Å; V347-R351 HydrophobicContact CG1-CG 3.86Å; V347-R351 VanDerWaalsContact O-CB 3.27Å; V347-R351 WeakPolarHBondContact O-CB 3.38Å; V347-R351 WeakPolarHBondContact O-CG 3.3Å; V347-R351 PolarHBondContact O-N 2.78Å; V347-L398 HydrophobicContact CG1-CD2 4.19Å
348F96.1Very high94.7Very high0 Ų063.2 Ų63.20%033%0.328CS..Hα-helixtrans-61.2-43.7179-179.3-107.5000112.8I334 L338 I343 P344 Q350 V352 L353 L360 M383 W386 L398I334-F348 HydrophobicContact CD1-CZ 4.12Å; I334-F348 HydrophobicContact CG2-CE1 3.92Å; I334-F348 HydrophobicContact CG2-CZ 4.44Å; L338-F348 HydrophobicContact CD1-CB 4.37Å; L338-F348 HydrophobicContact CD1-CD1 3.95Å; L338-F348 HydrophobicContact CD1-CG 4.31Å; L338-F348 HydrophobicContact CD2-CB 3.6Å; L338-F348 HydrophobicContact CD2-CD1 4.16Å; L338-F348 HydrophobicContact CD2-CD2 4.11Å; L338-F348 HydrophobicContact CD2-CG 3.7Å; I343-F348 HydrophobicContact CG2-CB 4.25Å; P344-F348 PolarHBondContact O-N 3.11Å; F348-Q350 VanDerWaalsContact C-N 3.34Å; F348-Q350 PolarHBondContact O-N 3.42Å; F348-V352 HydrophobicContact CD2-CB 3.77Å; F348-V352 HydrophobicContact CD2-CG1 4.38Å; F348-V352 HydrophobicContact CD2-CG2 3.51Å; F348-V352 HydrophobicContact CE2-CB 3.56Å; F348-V352 HydrophobicContact CE2-CG1 3.67Å; F348-V352 HydrophobicContact CE2-CG2 3.58Å; F348-V352 HydrophobicContact CZ-CB 4.23Å; F348-V352 HydrophobicContact CZ-CG1 4.11Å; F348-V352 PolarHBondContact O-N 3.1Å; F348-L353 HydrophobicContact CD1-CD1 4.23Å; F348-L353 HydrophobicContact CE1-CD1 3.79Å; F348-L353 HydrophobicContact CE1-CG 4.15Å; F348-L353 HydrophobicContact CZ-CD1 4.49Å; F348-L353 HydrophobicContact CZ-CD2 4.45Å; F348-L353 HydrophobicContact CZ-CG 4.44Å; F348-L360 HydrophobicContact CD1-CD2 3.6Å; F348-L360 HydrophobicContact CE1-CD2 4.32Å; F348-M383 HydrophobicContact CE1-CG 4.24Å; F348-M383 HydrophobicContact CZ-CG 4.29Å; F348-W386 HydrophobicContact CD2-CD2 4.2Å; F348-W386 HydrophobicContact CD2-CE3 4.39Å; F348-W386 HydrophobicContact CD2-CZ2 4.32Å; F348-W386 HydrophobicContact CE2-CB 4.34Å; F348-W386 AromaticContact CE2-CD2 3.41Å; F348-W386 HydrophobicContact CE2-CD2 3.41Å; F348-W386 VanDerWaalsContact CE2-CD2 3.41Å; F348-W386 AromaticContact CE2-CE2 3.82Å; F348-W386 AromaticContact CE2-CE3 3.54Å; F348-W386 HydrophobicContact CE2-CE3 3.54Å; F348-W386 AromaticContact CE2-CG 3.77Å; F348-W386 HydrophobicContact CE2-CG 3.77Å; F348-W386 HydrophobicContact CE2-CH2 4.41Å; F348-W386 HydrophobicContact CE2-CZ2 4.31Å; F348-W386 HydrophobicContact CE2-CZ3 4.05Å; F348-W386 HydrophobicContact CZ-CD2 4.22Å; F348-W386 HydrophobicContact CZ-CE3 4Å; F348-L398 HydrophobicContact CB-CD2 4.38Å; F348-L398 HydrophobicContact CD2-CD2 4.24Å
349A95.9Very high94.7Very high0 Ų065.4 Ų65.40%034%0.342CS..Hα-helixtrans-58.3-44.5176.500000112.6Q345 V347 L353 C354 R355 L360Q345-A349 WeakPolarHBondContact O-CB 3.05Å; Q345-A349 PolarHBondContact O-N 2.91Å; V347-A349 PolarHBondContact O-N 2.96Å; A349-L353 CarbonylContact O-C 3.54Å; A349-C354 PolarHBondContact O-N 3.23Å; A349-C354 VanDerWaalsContact O-N 3.11Å; A349-R355 CarbonylContact C-O 3.52Å; A349-R355 PolarHBondContact O-N 3.08Å; A349-L360 HydrophobicContact CB-CB 3.85Å; A349-L360 HydrophobicContact CB-CD2 3.74Å; A349-L360 HydrophobicContact CB-CG 4.44Å
350Q94.6Very high94.7Very high108 Ų10857.5 Ų57.551%0.50531%0.308SS..Hα-helixtrans-71.6-56.4179-70.6173.519.400110.5A346 V347 F348 C354 C403A346-Q350 WeakPolarHBondContact O-CB 3.46Å; A346-Q350 WeakPolarHBondContact O-CG 3.47Å; A346-Q350 PolarHBondContact O-N 3.22Å; V347-Q350 PolarHBondContact O-N 3.23Å; F348-Q350 VanDerWaalsContact C-N 3.34Å; F348-Q350 PolarHBondContact O-N 3.42Å; Q350-C354 VanDerWaalsContact O-CA 3.29Å; Q350-C354 WeakPolarHBondContact O-CA 3.47Å; Q350-C354 PolarHBondContact O-N 3.36Å; Q350-C354 VanDerWaalsContact O-N 3.13Å; Q350-C403 PolarHBondContact O-SG 3.1Å
351R92.4Very high94.7Very high83 Ų8350 Ų5031%0.31328%0.282SS..Hα-helixtrans-70.5-50.9-168.3-58.5-61.6178.6102.2-14.3112.8V347 L398 R399 A401V347-R351 HydrophobicContact CG1-CG 3.86Å; V347-R351 VanDerWaalsContact O-CB 3.27Å; V347-R351 WeakPolarHBondContact O-CB 3.38Å; V347-R351 WeakPolarHBondContact O-CG 3.3Å; V347-R351 PolarHBondContact O-N 2.78Å; R351-L398 WeakPolarHBondContact CG-O 3.34Å; R351-L398 PolarHBondContact NH1-O 3.31Å; R351-R399 PolarHBondContact NH1-O 3.11Å; R351-A401 HydrophobicContact CB-CB 4.07Å; R351-A401 WeakPolarHBondContact CD-O 3.45Å; R351-A401 WeakPolarHBondContact O-CB 3.35Å
352V93.8Very high94.7Very high27 Ų2750.3 Ų50.316%0.16429%0.288CS..THydrogen-bonded Turntrans-88.7-35.2-173-177.40000112.1F348 W386 A397 L398F348-V352 HydrophobicContact CD2-CB 3.77Å; F348-V352 HydrophobicContact CD2-CG1 4.38Å; F348-V352 HydrophobicContact CD2-CG2 3.51Å; F348-V352 HydrophobicContact CE2-CB 3.56Å; F348-V352 HydrophobicContact CE2-CG1 3.67Å; F348-V352 HydrophobicContact CE2-CG2 3.58Å; F348-V352 HydrophobicContact CZ-CB 4.23Å; F348-V352 HydrophobicContact CZ-CG1 4.11Å; F348-V352 PolarHBondContact O-N 3.1Å; V352-W386 HydrophobicContact CG1-CB 3.84Å; V352-W386 HydrophobicContact CG1-CG 3.98Å; V352-W386 HydrophobicContact CG2-CG 4.31Å; V352-A397 HydrophobicContact CG2-CB 4.5Å; V352-L398 HydrophobicContact CG2-CD2 4.2Å
353L93.5Very high94.7Very high1 Ų147.2 Ų47.21%0.00526%0.263CS..THydrogen-bonded Turntrans-105.4-16.3-171.5-52.5178.5000114.2F348 A349 R355 L360 T379 R382 M383F348-L353 HydrophobicContact CD1-CD1 4.23Å; F348-L353 HydrophobicContact CE1-CD1 3.79Å; F348-L353 HydrophobicContact CE1-CG 4.15Å; F348-L353 HydrophobicContact CZ-CD1 4.49Å; F348-L353 HydrophobicContact CZ-CD2 4.45Å; F348-L353 HydrophobicContact CZ-CG 4.44Å; A349-L353 CarbonylContact O-C 3.54Å; L353-R355 VanDerWaalsContact C-N 3.32Å; L353-R355 HydrophobicContact CB-CB 4.29Å; L353-R355 HydrophobicContact CB-CG 4.02Å; L353-R355 PolarHBondContact O-N 3.44Å; L353-L360 HydrophobicContact CD1-CD1 3.74Å; L353-L360 HydrophobicContact CD1-CD2 4.41Å; L353-T379 HydrophobicContact CD1-CG2 4.25Å; L353-T379 HydrophobicContact CD2-CG2 4.44Å; L353-R382 HydrophobicContact CD2-CB 3.62Å; L353-M383 HydrophobicContact CD1-CE 3.57Å; L353-M383 HydrophobicContact CD1-CG 4.23Å; L353-M383 HydrophobicContact CD2-CG 3.98Å
354C93Very high94.7Very high56 Ų5647.4 Ų47.438%0.37826%0.264SS..  trans4555.4-165.1-63.20000112.1A349 Q350 C403A349-C354 PolarHBondContact O-N 3.23Å; A349-C354 VanDerWaalsContact O-N 3.11Å; Q350-C354 VanDerWaalsContact O-CA 3.29Å; Q350-C354 WeakPolarHBondContact O-CA 3.47Å; Q350-C354 PolarHBondContact O-N 3.36Å; Q350-C354 VanDerWaalsContact O-N 3.13Å; C354-C403 VanDerWaalsContact CA-SG 3.54Å; C354-C403 HydrophobicContact CB-CB 4.22Å; C354-C403 WeakPolarHBondContact CB-SG 3.45Å; C354-C403 WeakPolarHBondContact SG-CB 3.43Å; C354-C403 CovalentContact SG-SG 2.05Å; C354-C403 PolarHBondContact SG-SG 2.98Å
355R93.8Very high94.6Very high113 Ų11352.6 Ų52.643%0.42627%0.274SS..  trans-129.8167.1177.1-64.5-63174.4-111.49111.2A349 L353 T359 T379A349-R355 CarbonylContact C-O 3.52Å; A349-R355 PolarHBondContact O-N 3.08Å; L353-R355 VanDerWaalsContact C-N 3.32Å; L353-R355 HydrophobicContact CB-CB 4.29Å; L353-R355 HydrophobicContact CB-CG 4.02Å; L353-R355 PolarHBondContact O-N 3.44Å; R355-T359 HydrophobicContact CB-CG2 4.42Å; R355-T379 HydrophobicContact CG-CG2 4.48Å
356S95.7Very high94.3Very high66 Ų6655.2 Ų55.246%0.46229%0.289SS..  trans-76.8153.6171.783.90000111.1G358 T359 L360S356-G358 VanDerWaalsContact C-N 3.28Å; S356-G358 PolarHBondContact O-N 2.88Å; S356-T359 WeakPolarHBondContact O-CB 3.41Å; S356-T359 PolarHBondContact O-N 3.33Å; S356-T359 VanDerWaalsContact O-N 3.16Å; S356-T359 PolarHBondContact OG-N 3.03Å; S356-T359 VanDerWaalsContact OG-N 3.08Å; S356-T359 PolarHBondContact OG-OG1 2.92Å; S356-L360 PolarHBondContact O-N 3.13Å; S356-L360 VanDerWaalsContact O-N 3.15Å
357Q94.2Very high94.2Very high85 Ų8554.8 Ų54.840%0.39728%0.283SS..Hα-helixtrans-55.6-43.4173.8178.4-82.4-26.200111.6Q345 A346 T359 L360 S361Q345-Q357 HydrophobicContact CB-CG 4.3Å; Q345-Q357 HydrophobicContact CG-CG 4.27Å; A346-Q357 HydrophobicContact CB-CB 3.95Å; A346-Q357 HydrophobicContact CB-CG 4.06Å; Q357-T359 VanDerWaalsContact C-N 3.32Å; Q357-T359 PolarHBondContact O-N 3.49Å; Q357-L360 PolarHBondContact O-N 2.79Å; Q357-L360 VanDerWaalsContact O-N 3.15Å; Q357-S361 PolarHBondContact O-N 3.44Å
358G94.6Very high94.1Very high38 Ų3855.9 Ų55.939%0.39228%0.284SS..Hα-helixtrans-63.3-36.4178.800000113S356 S361 D362S356-G358 VanDerWaalsContact C-N 3.28Å; S356-G358 PolarHBondContact O-N 2.88Å; G358-S361 PolarHBondContact O-N 2.85Å; G358-D362 PolarHBondContact O-N 3.32Å
359T94.7Very high93.9Very high59 Ų5957.2 Ų57.236%0.36229%0.292SS..Hα-helixtrans-61.6-45.1173-50.90000111R355 S356 Q357 S361 D362 L363R355-T359 HydrophobicContact CB-CG2 4.42Å; S356-T359 WeakPolarHBondContact O-CB 3.41Å; S356-T359 PolarHBondContact O-N 3.33Å; S356-T359 VanDerWaalsContact O-N 3.16Å; S356-T359 PolarHBondContact OG-N 3.03Å; S356-T359 VanDerWaalsContact OG-N 3.08Å; S356-T359 PolarHBondContact OG-OG1 2.92Å; Q357-T359 VanDerWaalsContact C-N 3.32Å; Q357-T359 PolarHBondContact O-N 3.49Å; T359-S361 VanDerWaalsContact C-N 3.32Å; T359-S361 PolarHBondContact O-N 2.81Å; T359-D362 PolarHBondContact O-N 2.84Å; T359-L363 HydrophobicContact CG2-CD1 4.22Å; T359-L363 VanDerWaalsContact O-CG 3.29Å; T359-L363 WeakPolarHBondContact O-CG 3.34Å; T359-L363 PolarHBondContact O-N 2.77Å; T359-L363 VanDerWaalsContact O-N 3.12Å
360L96.9Very high93.7Very high0 Ų058.1 Ų58.10%030%0.296CS..Hα-helixtrans-66.7-35.1177.4-178.459.4000112Q345 F348 A349 L353 S356 Q357 L363 L364 M383Q345-L360 HydrophobicContact CG-CB 4.23Å; Q345-L360 HydrophobicContact CG-CD2 3.46Å; Q345-L360 VanDerWaalsContact CG-CD2 3.46Å; Q345-L360 HydrophobicContact CG-CG 3.83Å; F348-L360 HydrophobicContact CD1-CD2 3.6Å; F348-L360 HydrophobicContact CE1-CD2 4.32Å; A349-L360 HydrophobicContact CB-CB 3.85Å; A349-L360 HydrophobicContact CB-CD2 3.74Å; A349-L360 HydrophobicContact CB-CG 4.44Å; L353-L360 HydrophobicContact CD1-CD1 3.74Å; L353-L360 HydrophobicContact CD1-CD2 4.41Å; S356-L360 PolarHBondContact O-N 3.13Å; S356-L360 VanDerWaalsContact O-N 3.15Å; Q357-L360 PolarHBondContact O-N 2.79Å; Q357-L360 VanDerWaalsContact O-N 3.15Å; L360-L363 PolarHBondContact O-N 3.04Å; L360-L364 HydrophobicContact CD1-CD1 3.9Å; L360-L364 HydrophobicContact CD1-CD2 4.15Å; L360-L364 HydrophobicContact CD1-CG 3.75Å; L360-L364 HydrophobicContact CD2-CD1 4.5Å; L360-L364 HydrophobicContact CG-CD1 3.98Å; L360-L364 HydrophobicContact CG-CG 4.2Å; L360-L364 WeakPolarHBondContact O-CG 3.48Å; L360-L364 PolarHBondContact O-N 3.37Å; L360-M383 HydrophobicContact CD1-CE 3.32Å
361S96.5Very high93.4Very high19 Ų1956.8 Ų56.813%0.13330%0.298CS..Hα-helixtrans-65.8-40.8176-1300000112.9Q345 Q357 G358 T359 R365Q345-S361 PolarHBondContact OE1-OG 2.9Å; Q357-S361 PolarHBondContact O-N 3.44Å; G358-S361 PolarHBondContact O-N 2.85Å; T359-S361 VanDerWaalsContact C-N 3.32Å; T359-S361 PolarHBondContact O-N 2.81Å; S361-R365 WeakPolarHBondContact O-CB 3.39Å; S361-R365 WeakPolarHBondContact O-CD 3.38Å; S361-R365 VanDerWaalsContact O-CG 3.24Å; S361-R365 WeakPolarHBondContact O-CG 3.36Å; S361-R365 PolarHBondContact O-N 3.16Å
362D93.3Very high93.3Very high65 Ų6558.5 Ų58.535%0.34831%0.308SS..Hα-helixtrans-62.9-43.1174-151.157.7000110.4G358 T359 N366 R472G358-D362 PolarHBondContact O-N 3.32Å; T359-D362 PolarHBondContact O-N 2.84Å; D362-N366 PolarHBondContact O-N 2.96Å; D362-R472 IonicContact OD2-CZ 2.98Å; D362-R472 IonicContact OD2-NH1 2.72Å; D362-R472 PolarHBondContact OD2-NH1 3.08Å; D362-R472 IonicContact OD2-NH2 3.18Å; D362-R472 PolarHBondContact OD2-NH2 3.44Å
363L94.8Very high93.1Very high40 Ų4058 Ų5821%0.20930%0.304CS..Hα-helixtrans-65.8-42.4-179.6-73.1171.1000114.2T359 L360 P367 T379 F380 M383T359-L363 HydrophobicContact CG2-CD1 4.22Å; T359-L363 VanDerWaalsContact O-CG 3.29Å; T359-L363 WeakPolarHBondContact O-CG 3.34Å; T359-L363 PolarHBondContact O-N 2.77Å; T359-L363 VanDerWaalsContact O-N 3.12Å; L360-L363 PolarHBondContact O-N 3.04Å; L363-P367 VanDerWaalsContact O-CA 3.32Å; L363-P367 WeakPolarHBondContact O-CA 3.27Å; L363-P367 WeakPolarHBondContact O-CB 3.44Å; L363-T379 HydrophobicContact CD1-CG2 3.82Å; L363-F380 HydrophobicContact CD2-CE2 4Å; L363-F380 HydrophobicContact CD2-CZ 4.2Å; L363-M383 HydrophobicContact CD1-CE 4.35Å
364L95.4Very high92.7Very high21 Ų2167.3 Ų67.311%0.1135%0.345CS..Hα-helixtrans-79.5-27-177.6-64.2-177.8000113.2A331 I334 L338 L360 M383A331-L364 HydrophobicContact CB-CD2 3.89Å; I334-L364 HydrophobicContact CB-CD2 4.21Å; I334-L364 HydrophobicContact CG2-CD1 4.11Å; I334-L364 HydrophobicContact CG2-CD2 3.89Å; L338-L364 HydrophobicContact CD1-CD1 4.38Å; L360-L364 HydrophobicContact CD1-CD1 3.9Å; L360-L364 HydrophobicContact CD1-CD2 4.15Å; L360-L364 HydrophobicContact CD1-CG 3.75Å; L360-L364 HydrophobicContact CD2-CD1 4.5Å; L360-L364 HydrophobicContact CG-CD1 3.98Å; L360-L364 HydrophobicContact CG-CG 4.2Å; L360-L364 WeakPolarHBondContact O-CG 3.48Å; L360-L364 PolarHBondContact O-N 3.37Å; L364-M383 HydrophobicContact CD2-CE 4.28Å; L364-M383 HydrophobicContact CD2-SD 4.37Å
365R92.5Very high92.4Very high189 Ų18970.2 Ų70.271%0.71337%0.366SS*.Hα-helixtrans-80.8-41.6-179.7-70.7173.7-178.8-883.5112.9S361S361-R365 WeakPolarHBondContact O-CB 3.39Å; S361-R365 WeakPolarHBondContact O-CD 3.38Å; S361-R365 VanDerWaalsContact O-CG 3.24Å; S361-R365 WeakPolarHBondContact O-CG 3.36Å; S361-R365 PolarHBondContact O-N 3.16Å
366N90Very high92.2Very high101 Ų10166 Ų6654%0.5436%0.357SS..SBendtrans-132.465.7-178.6-64.8-71.8000110.1D362 K368D362-N366 PolarHBondContact O-N 2.96Å; N366-K368 PolarHBondContact O-N 2.86Å
367P92.7Very high92.1Very high27 Ų2766.6 Ų66.618%0.17535%0.349CS..PPolyproline II helixtrans-61.8124.2179.625.5-33.3000110.1T327 K328 A331 L363 F380T327-P367 WeakPolarHBondContact O-CB 3.24Å; K328-P367 HydrophobicContact CB-CG 4.3Å; K328-P367 HydrophobicContact CG-CG 4.48Å; A331-P367 HydrophobicContact CB-CB 4.02Å; A331-P367 HydrophobicContact CB-CG 3.92Å; L363-P367 VanDerWaalsContact O-CA 3.32Å; L363-P367 WeakPolarHBondContact O-CA 3.27Å; L363-P367 WeakPolarHBondContact O-CB 3.44Å; P367-F380 HydrophobicContact CB-CE1 4.27Å; P367-F380 HydrophobicContact CB-CZ 4.09Å
368K91.2Very high92.1Very high76 Ų7665.8 Ų65.833%0.3335%0.345SS..PPolyproline II helixtrans-67.5143.2172.1-73-177.551.7178.20110.4T327 N366 K372 L373 W478T327-K368 WeakPolarHBondContact CB-O 3.48Å; T327-K368 PolarHBondContact OG1-O 2.74Å; N366-K368 PolarHBondContact O-N 2.86Å; K368-K372 VanDerWaalsContact CE-O 3.22Å; K368-K372 WeakPolarHBondContact CE-O 3.4Å; K368-K372 PolarHBondContact NZ-O 3.1Å; K368-L373 HydrophobicContact CB-CD2 3.83Å; K368-L373 HydrophobicContact CB-CG 4.36Å; K368-L373 HydrophobicContact CD-CD2 4.28Å; K368-W478 HydrophobicContact CD-CZ2 3.94Å; K368-W478 VanDerWaalsContact CE-CZ2 3.46Å; K368-W478 HydrophobicContact CG-CZ2 4.06Å
369P91.6Very high92.1Very high27 Ų2764.6 Ų64.618%0.17533%0.331CS..PPolyproline II helixtrans-61.5144.9174.225.4-33.7000111.1S371 K372 L373 W478P369-S371 PolarHBondContact O-N 3Å; P369-K372 HydrophobicContact CG-CB 4.22Å; P369-K372 HydrophobicContact CG-CG 3.89Å; P369-K372 PolarHBondContact O-N 3.46Å; P369-L373 PolarHBondContact O-N 2.88Å; P369-W478 HydrophobicContact CG-CB 4.3Å; P369-W478 HydrophobicContact CG-CD2 4.16Å; P369-W478 HydrophobicContact CG-CE3 3.68Å; P369-W478 HydrophobicContact CG-CG 4.44Å; P369-W478 HydrophobicContact CG-CZ3 4.48Å
370W92.4Very high92.1Very high19 Ų1961.8 Ų61.87%0.07231%0.314CS..G310 helixtrans-57.3-42.6-170.8-179.6-108.4000114S323 L325 T327 K372 L373 R377 F380 R381S323-W370 PolarHBondContact O-NE1 3.44Å; L325-W370 HydrophobicContact CB-CD2 4.18Å; L325-W370 HydrophobicContact CB-CE3 3.98Å; L325-W370 HydrophobicContact CB-CH2 4.28Å; L325-W370 HydrophobicContact CB-CZ2 4.47Å; L325-W370 HydrophobicContact CB-CZ3 4.04Å; L325-W370 HydrophobicContact CD1-CH2 3.81Å; L325-W370 HydrophobicContact CD1-CZ2 4.49Å; L325-W370 HydrophobicContact CD1-CZ3 3.93Å; L325-W370 HydrophobicContact CG-CH2 4.25Å; L325-W370 HydrophobicContact CG-CZ2 4.49Å; L325-W370 HydrophobicContact CG-CZ3 4.41Å; L325-W370 VanDerWaalsContact O-CB 3.3Å; L325-W370 WeakPolarHBondContact O-CB 3.32Å; T327-W370 HydrophobicContact CG2-CB 4.06Å; T327-W370 HydrophobicContact CG2-CE3 3.84Å; W370-K372 PolarHBondContact O-N 3.42Å; W370-K372 VanDerWaalsContact O-N 3.08Å; W370-L373 HydrophobicContact CE3-CD1 4.04Å; W370-L373 WeakPolarHBondContact O-CB 3.46Å; W370-L373 PolarHBondContact O-N 3.46Å; W370-R377 HydrophobicContact CD2-CG 4.39Å; W370-R377 HydrophobicContact CE3-CG 4.14Å; W370-R377 HydrophobicContact CH2-CB 3.76Å; W370-R377 HydrophobicContact CH2-CG 4.02Å; W370-R377 HydrophobicContact CZ2-CB 4.38Å; W370-R377 HydrophobicContact CZ2-CG 4.26Å; W370-R377 HydrophobicContact CZ3-CB 3.82Å; W370-R377 HydrophobicContact CZ3-CG 3.94Å; W370-F380 HydrophobicContact CZ3-CB 4.11Å; W370-R381 HydrophobicContact CH2-CG 4.13Å
371S89.6Confident92Very high80 Ų8066.2 Ų66.256%0.55933%0.33SS*.G310 helixtrans-53.4-29.9174.758.20000113.2P369P369-S371 PolarHBondContact O-N 3Å
372K88.8Confident91.9Very high120 Ų12069.8 Ų69.852%0.52234%0.341SS..G310 helixtrans-101.18-176.5-50.1-78.2-169.3177.60113K368 P369 W370 W478K368-K372 VanDerWaalsContact CE-O 3.22Å; K368-K372 WeakPolarHBondContact CE-O 3.4Å; K368-K372 PolarHBondContact NZ-O 3.1Å; P369-K372 HydrophobicContact CG-CB 4.22Å; P369-K372 HydrophobicContact CG-CG 3.89Å; P369-K372 PolarHBondContact O-N 3.46Å; W370-K372 PolarHBondContact O-N 3.42Å; W370-K372 VanDerWaalsContact O-N 3.08Å; K372-W478 HydrophobicContact CB-CE3 4.15Å; K372-W478 HydrophobicContact CB-CH2 3.86Å; K372-W478 HydrophobicContact CB-CZ3 3.44Å; K372-W478 VanDerWaalsContact CB-CZ3 3.44Å; K372-W478 HydrophobicContact CD-CZ3 3.81Å; K372-W478 HydrophobicContact CG-CE3 3.9Å; K372-W478 HydrophobicContact CG-CH2 4.26Å; K372-W478 HydrophobicContact CG-CZ3 3.37Å
373L90.2Very high92.1Very high15 Ų1566.7 Ų66.78%0.07932%0.324CS..  trans-93129.3169.6-67.6178.1000110.7T327 K368 P369 W370 R377 F380T327-L373 HydrophobicContact CG2-CD1 3.82Å; K368-L373 HydrophobicContact CB-CD2 3.83Å; K368-L373 HydrophobicContact CB-CG 4.36Å; K368-L373 HydrophobicContact CD-CD2 4.28Å; P369-L373 PolarHBondContact O-N 2.88Å; W370-L373 HydrophobicContact CE3-CD1 4.04Å; W370-L373 WeakPolarHBondContact O-CB 3.46Å; W370-L373 PolarHBondContact O-N 3.46Å; L373-R377 HydrophobicContact CB-CG 3.61Å; L373-R377 HydrophobicContact CD1-CG 4.47Å; L373-R377 PolarHBondContact O-NE 3.25Å; L373-F380 HydrophobicContact CD1-CD2 3.51Å; L373-F380 HydrophobicContact CD1-CE2 3.66Å; L373-F380 HydrophobicContact CD1-CG 4.44Å; L373-F380 HydrophobicContact CD2-CE2 4.41Å
374K85.2Confident92.1Very high198 Ų19869.1 Ų69.186%0.86133%0.331SS*.SBendtrans-102.7-91.2170-164.2178179.280.90109.7G376K374-G376 VanDerWaalsContact C-N 3.28Å; K374-G376 PolarHBondContact O-N 2.73Å
375S86.3Confident92.1Very high116 Ų11672 Ų7281%0.81135%0.346SS*.THydrogen-bonded Turntrans-68.5-20.3176.352.30000114.8R377S375-R377 VanDerWaalsContact C-N 3.35Å; S375-R377 PolarHBondContact O-N 3.03Å
376G89.4Confident92.2Very high24 Ų2463.3 Ų63.325%0.24731%0.313CS..THydrogen-bonded Turntrans-73.7-17-17700000115.6K374 E378 T379K374-G376 VanDerWaalsContact C-N 3.28Å; K374-G376 PolarHBondContact O-N 2.73Å; G376-E378 VanDerWaalsContact C-N 3.27Å; G376-E378 PolarHBondContact O-N 2.95Å; G376-T379 PolarHBondContact O-N 2.96Å; G376-T379 VanDerWaalsContact O-N 3.08Å
377R94.1Very high92.5Very high79 Ų7960 Ų6030%0.29830%0.295SS..Hα-helixtrans-55.3-41.8-175.6-68.3-172.3-174.5-162.1-2.7112.4W370 L373 S375 T379 F380 R381W370-R377 HydrophobicContact CD2-CG 4.39Å; W370-R377 HydrophobicContact CE3-CG 4.14Å; W370-R377 HydrophobicContact CH2-CB 3.76Å; W370-R377 HydrophobicContact CH2-CG 4.02Å; W370-R377 HydrophobicContact CZ2-CB 4.38Å; W370-R377 HydrophobicContact CZ2-CG 4.26Å; W370-R377 HydrophobicContact CZ3-CB 3.82Å; W370-R377 HydrophobicContact CZ3-CG 3.94Å; L373-R377 HydrophobicContact CB-CG 3.61Å; L373-R377 HydrophobicContact CD1-CG 4.47Å; L373-R377 PolarHBondContact O-NE 3.25Å; S375-R377 VanDerWaalsContact C-N 3.35Å; S375-R377 PolarHBondContact O-N 3.03Å; R377-T379 PolarHBondContact O-N 3.46Å; R377-F380 PolarHBondContact O-N 2.71Å; R377-R381 PolarHBondContact O-N 3.33Å
378E93.5Very high92.6Very high68 Ų6863 Ų6332%0.31831%0.31SS..Hα-helixtrans-58.7-31.7-179.9177.155.7-164.800113.8G376 R381 R382G376-E378 VanDerWaalsContact C-N 3.27Å; G376-E378 PolarHBondContact O-N 2.95Å; E378-R381 PolarHBondContact O-N 3.22Å; E378-R381 IonicContact OE2-CZ 3.58Å; E378-R381 IonicContact OE2-NH1 2.64Å; E378-R381 PolarHBondContact OE2-NH1 2.68Å; E378-R382 WeakPolarHBondContact O-CG 3.26Å; E378-R382 PolarHBondContact O-N 3.18Å; E378-R382 IonicContact OE1-CZ 2.76Å; E378-R382 VanDerWaalsContact OE1-CZ 3.24Å; E378-R382 IonicContact OE1-NE 3.44Å; E378-R382 PolarHBondContact OE1-NE 3.12Å; E378-R382 IonicContact OE1-NH2 3.75Å; E378-R382 PolarHBondContact OE1-NH2 3.33Å
379T94.8Very high92.7Very high14 Ų1461.9 Ų61.99%0.08631%0.306CS..Hα-helixtrans-71.7-34.1177.5-54.20000111.3L353 R355 L363 G376 R377 M383L353-T379 HydrophobicContact CD1-CG2 4.25Å; L353-T379 HydrophobicContact CD2-CG2 4.44Å; R355-T379 HydrophobicContact CG-CG2 4.48Å; L363-T379 HydrophobicContact CD1-CG2 3.82Å; G376-T379 PolarHBondContact O-N 2.96Å; G376-T379 VanDerWaalsContact O-N 3.08Å; R377-T379 PolarHBondContact O-N 3.46Å; T379-M383 HydrophobicContact CG2-CE 4.26Å; T379-M383 WeakPolarHBondContact O-CG 3.22Å; T379-M383 PolarHBondContact O-N 2.67Å
380F95.9Very high92.8Very high0 Ų063.2 Ų63.20%032%0.315CS..Hα-helixtrans-75.4-35.6172.8-75.4-84.1000112.4T327 L330 L363 P367 W370 L373 R377 R382 M383 W384T327-F380 HydrophobicContact CG2-CD1 3.98Å; T327-F380 HydrophobicContact CG2-CD2 4.23Å; T327-F380 HydrophobicContact CG2-CE1 4.1Å; T327-F380 HydrophobicContact CG2-CE2 4.34Å; T327-F380 HydrophobicContact CG2-CG 4.04Å; T327-F380 HydrophobicContact CG2-CZ 4.27Å; L330-F380 HydrophobicContact CD2-CB 4.1Å; L330-F380 HydrophobicContact CD2-CD1 3.99Å; L363-F380 HydrophobicContact CD2-CE2 4Å; L363-F380 HydrophobicContact CD2-CZ 4.2Å; P367-F380 HydrophobicContact CB-CE1 4.27Å; P367-F380 HydrophobicContact CB-CZ 4.09Å; W370-F380 HydrophobicContact CZ3-CB 4.11Å; L373-F380 HydrophobicContact CD1-CD2 3.51Å; L373-F380 HydrophobicContact CD1-CE2 3.66Å; L373-F380 HydrophobicContact CD1-CG 4.44Å; L373-F380 HydrophobicContact CD2-CE2 4.41Å; R377-F380 PolarHBondContact O-N 2.71Å; F380-R382 VanDerWaalsContact C-N 3.32Å; F380-R382 PolarHBondContact O-N 3.28Å; F380-M383 HydrophobicContact CD1-SD 3.89Å; F380-M383 HydrophobicContact CE1-SD 4.27Å; F380-M383 WeakPolarHBondContact O-CB 3.39Å; F380-M383 PolarHBondContact O-N 2.92Å; F380-M383 VanDerWaalsContact O-N 3.15Å; F380-W384 PolarHBondContact O-N 3.47Å
381R94.7Very high92.8Very high93 Ų9367.2 Ų67.235%0.35133%0.334SS..Hα-helixtrans-57.6-44.6172.4-65.4-170.2-155.3113.6-7112W370 R377 E378 M383 W384 N385W370-R381 HydrophobicContact CH2-CG 4.13Å; R377-R381 PolarHBondContact O-N 3.33Å; E378-R381 PolarHBondContact O-N 3.22Å; E378-R381 IonicContact OE2-CZ 3.58Å; E378-R381 IonicContact OE2-NH1 2.64Å; E378-R381 PolarHBondContact OE2-NH1 2.68Å; R381-M383 VanDerWaalsContact C-N 3.3Å; R381-M383 PolarHBondContact O-N 3.3Å; R381-W384 PolarHBondContact O-N 2.93Å; R381-W384 VanDerWaalsContact O-N 3.15Å; R381-N385 WeakPolarHBondContact O-CB 3.46Å; R381-N385 VanDerWaalsContact O-CG 3.22Å; R381-N385 PolarHBondContact O-N 3.23Å; R381-N385 PolarHBondContact O-OD1 3.45Å; R381-N385 VanDerWaalsContact O-OD1 3.14Å
382R94.7Very high92.9Very high93 Ų9371.7 Ų71.735%0.35134%0.34SS..Hα-helixtrans-62.8-35.6176.3-68.5174.8-163.5-163.4-4.4113.2L353 E378 F380 W386L353-R382 HydrophobicContact CD2-CB 3.62Å; E378-R382 WeakPolarHBondContact O-CG 3.26Å; E378-R382 PolarHBondContact O-N 3.18Å; E378-R382 IonicContact OE1-CZ 2.76Å; E378-R382 VanDerWaalsContact OE1-CZ 3.24Å; E378-R382 IonicContact OE1-NE 3.44Å; E378-R382 PolarHBondContact OE1-NE 3.12Å; E378-R382 IonicContact OE1-NH2 3.75Å; E378-R382 PolarHBondContact OE1-NH2 3.33Å; F380-R382 VanDerWaalsContact C-N 3.32Å; F380-R382 PolarHBondContact O-N 3.28Å; R382-W386 WeakPolarHBondContact O-CB 3.37Å; R382-W386 PolarHBondContact O-N 3.26Å
383M96.4Very high93.1Very high0 Ų069.4 Ų69.40%033%0.332CS..Hα-helixtrans-63.1-48.3171.4-69172.2-176.400111.3L330 I334 F348 L353 L360 L363 L364 T379 F380 R381 W386 L387L330-M383 HydrophobicContact CD1-CB 4.36Å; L330-M383 HydrophobicContact CD2-CB 4.44Å; L330-M383 HydrophobicContact CG-CB 4.47Å; I334-M383 HydrophobicContact CD1-CB 3.82Å; I334-M383 HydrophobicContact CD1-CG 4.36Å; I334-M383 HydrophobicContact CG1-CB 3.94Å; I334-M383 HydrophobicContact CG1-CG 4.35Å; F348-M383 HydrophobicContact CE1-CG 4.24Å; F348-M383 HydrophobicContact CZ-CG 4.29Å; L353-M383 HydrophobicContact CD1-CE 3.57Å; L353-M383 HydrophobicContact CD1-CG 4.23Å; L353-M383 HydrophobicContact CD2-CG 3.98Å; L360-M383 HydrophobicContact CD1-CE 3.32Å; L363-M383 HydrophobicContact CD1-CE 4.35Å; L364-M383 HydrophobicContact CD2-CE 4.28Å; L364-M383 HydrophobicContact CD2-SD 4.37Å; T379-M383 HydrophobicContact CG2-CE 4.26Å; T379-M383 WeakPolarHBondContact O-CG 3.22Å; T379-M383 PolarHBondContact O-N 2.67Å; F380-M383 HydrophobicContact CD1-SD 3.89Å; F380-M383 HydrophobicContact CE1-SD 4.27Å; F380-M383 WeakPolarHBondContact O-CB 3.39Å; F380-M383 PolarHBondContact O-N 2.92Å; F380-M383 VanDerWaalsContact O-N 3.15Å; R381-M383 VanDerWaalsContact C-N 3.3Å; R381-M383 PolarHBondContact O-N 3.3Å; M383-W386 PolarHBondContact O-N 2.76Å; M383-L387 WeakPolarHBondContact O-CB 3.3Å; M383-L387 PolarHBondContact O-N 3.17Å
384W95.5Very high93.3Very high92 Ų9269.8 Ų69.835%0.34833%0.332SS..Hα-helixtrans-64.6-46.1-179-175.586.6000112L325 L330 F380 R381 W386 L387 N388L325-W384 HydrophobicContact CD1-CB 4.1Å; L325-W384 HydrophobicContact CD1-CG 4.17Å; L325-W384 VanDerWaalsContact CD2-CD1 3.46Å; L325-W384 HydrophobicContact CD2-CD2 4.09Å; L325-W384 HydrophobicContact CD2-CG 3.81Å; L330-W384 HydrophobicContact CD1-CB 4.07Å; L330-W384 HydrophobicContact CD2-CB 3.93Å; F380-W384 PolarHBondContact O-N 3.47Å; R381-W384 PolarHBondContact O-N 2.93Å; R381-W384 VanDerWaalsContact O-N 3.15Å; W384-W386 PolarHBondContact O-N 3.25Å; W384-L387 PolarHBondContact O-N 3.02Å; W384-L387 VanDerWaalsContact O-N 3.12Å; W384-N388 VanDerWaalsContact CD2-ND2 3.3Å; W384-N388 WeakPolarHBondContact CH2-ND2 3.28Å; W384-N388 WeakPolarHBondContact CZ2-ND2 3.31Å; W384-N388 PolarHBondContact O-N 3.2Å; W384-N388 PolarHBondContact O-ND2 3.37Å
385N94.5Very high93.6Very high82 Ų8263.1 Ų63.144%0.43930%0.304SS..Hα-helixtrans-54.1-54.7172.8-698.9000110.5R381 L387 N388 E389R381-N385 WeakPolarHBondContact O-CB 3.46Å; R381-N385 VanDerWaalsContact O-CG 3.22Å; R381-N385 PolarHBondContact O-N 3.23Å; R381-N385 PolarHBondContact O-OD1 3.45Å; R381-N385 VanDerWaalsContact O-OD1 3.14Å; N385-L387 PolarHBondContact O-N 3.37Å; N385-N388 PolarHBondContact O-N 3.12Å; N385-N388 VanDerWaalsContact O-N 3.13Å; N385-E389 WeakPolarHBondContact O-CG 3.32Å; N385-E389 PolarHBondContact O-N 3.08Å
386W95.4Very high93.8Very high5 Ų559.7 Ų59.72%0.01928%0.281CS..Hα-helixtrans-61.7-30.6178.6-179.683.2000112.9I334 E337 L338 I343 F348 V352 R382 M383 W384 R394 L398I334-W386 HydrophobicContact CD1-CE3 3.95Å; I334-W386 HydrophobicContact CD1-CZ3 4.21Å; E337-W386 HydrophobicContact CB-CZ3 4.44Å; E337-W386 HydrophobicContact CG-CH2 4.3Å; E337-W386 HydrophobicContact CG-CZ3 4.25Å; L338-W386 HydrophobicContact CD2-CH2 4.41Å; I343-W386 HydrophobicContact CD1-CH2 3.97Å; I343-W386 HydrophobicContact CD1-CZ2 4.08Å; F348-W386 HydrophobicContact CD2-CD2 4.2Å; F348-W386 HydrophobicContact CD2-CE3 4.39Å; F348-W386 HydrophobicContact CD2-CZ2 4.32Å; F348-W386 HydrophobicContact CE2-CB 4.34Å; F348-W386 AromaticContact CE2-CD2 3.41Å; F348-W386 HydrophobicContact CE2-CD2 3.41Å; F348-W386 VanDerWaalsContact CE2-CD2 3.41Å; F348-W386 AromaticContact CE2-CE2 3.82Å; F348-W386 AromaticContact CE2-CE3 3.54Å; F348-W386 HydrophobicContact CE2-CE3 3.54Å; F348-W386 AromaticContact CE2-CG 3.77Å; F348-W386 HydrophobicContact CE2-CG 3.77Å; F348-W386 HydrophobicContact CE2-CH2 4.41Å; F348-W386 HydrophobicContact CE2-CZ2 4.31Å; F348-W386 HydrophobicContact CE2-CZ3 4.05Å; F348-W386 HydrophobicContact CZ-CD2 4.22Å; F348-W386 HydrophobicContact CZ-CE3 4Å; V352-W386 HydrophobicContact CG1-CB 3.84Å; V352-W386 HydrophobicContact CG1-CG 3.98Å; V352-W386 HydrophobicContact CG2-CG 4.31Å; R382-W386 WeakPolarHBondContact O-CB 3.37Å; R382-W386 PolarHBondContact O-N 3.26Å; M383-W386 PolarHBondContact O-N 2.76Å; W384-W386 PolarHBondContact O-N 3.25Å; W386-R394 HydrophobicContact CD2-CG 4.44Å; W386-R394 HydrophobicContact CZ2-CB 3.96Å; W386-R394 PolarHBondContact NE1-O 2.83Å; W386-R394 VanDerWaalsContact NE1-O 3.13Å; W386-R394 WeakPolarHBondContact O-CD 3.05Å; W386-R394 WeakPolarHBondContact O-CG 2.96Å; W386-L398 HydrophobicContact CZ2-CD1 4.27Å
387L95.5Very high93.8Very high31 Ų3159.7 Ų59.716%0.16228%0.278CS..Hα-helixtrans-71-33.7177.3-168129.5000112.3R333 I334 M383 W384 N385R333-L387 HydrophobicContact CB-CD1 3.67Å; I334-L387 HydrophobicContact CD1-CB 4.24Å; I334-L387 HydrophobicContact CD1-CD1 3.93Å; I334-L387 HydrophobicContact CG1-CD1 4.23Å; M383-L387 WeakPolarHBondContact O-CB 3.3Å; M383-L387 PolarHBondContact O-N 3.17Å; W384-L387 PolarHBondContact O-N 3.02Å; W384-L387 VanDerWaalsContact O-N 3.12Å; N385-L387 PolarHBondContact O-N 3.37Å
388N94.4Very high93.6Very high91 Ų9156.7 Ų56.749%0.48727%0.268SS..Hα-helixtrans-87.1-13.8179.1-65.7-22.1000114W384 N385W384-N388 VanDerWaalsContact CD2-ND2 3.3Å; W384-N388 WeakPolarHBondContact CH2-ND2 3.28Å; W384-N388 WeakPolarHBondContact CZ2-ND2 3.31Å; W384-N388 PolarHBondContact O-N 3.2Å; W384-N388 PolarHBondContact O-ND2 3.37Å; N385-N388 PolarHBondContact O-N 3.12Å; N385-N388 VanDerWaalsContact O-N 3.13Å
389E93.6Very high93.2Very high52 Ų5262.3 Ų62.324%0.24329%0.286CS..SBendtrans-60.9144.1171.1-80178.7155.600110.9N385 Q393 R394N385-E389 WeakPolarHBondContact O-CG 3.32Å; N385-E389 PolarHBondContact O-N 3.08Å; E389-Q393 HydrophobicContact CB-CB 4.32Å; E389-Q393 HydrophobicContact CB-CG 4.22Å; E389-Q393 VanDerWaalsContact CD-NE2 3.31Å; E389-Q393 HydrophobicContact CG-CG 4.06Å; E389-Q393 PolarHBondContact OE1-NE2 3.08Å; E389-R394 HydrophobicContact CB-CG 3.62Å; E389-R394 WeakPolarHBondContact O-CD 3.14Å; E389-R394 VanDerWaalsContact O-CG 3.26Å; E389-R394 WeakPolarHBondContact O-CG 3.4Å
390P93.8Very high91.7Very high56 Ų5668 Ų6836%0.36432%0.315SS..  trans-64.7151.2175.128.6-35.1000110.9Y392 Q393 R394P390-Y392 VanDerWaalsContact C-N 3.28Å; P390-Y392 HydrophobicContact CB-CD1 3.95Å; P390-Y392 HydrophobicContact CB-CE1 3.52Å; P390-Y392 HydrophobicContact CG-CD1 4.2Å; P390-Y392 HydrophobicContact CG-CE1 3.53Å; P390-Y392 HydrophobicContact CG-CE2 4.2Å; P390-Y392 PolarHBondContact O-N 3.44Å; P390-Y392 VanDerWaalsContact O-N 3.08Å; P390-Q393 HydrophobicContact CG-CB 3.98Å; P390-Q393 WeakPolarHBondContact O-CA 3.29Å; P390-Q393 WeakPolarHBondContact O-CB 3.39Å; P390-Q393 PolarHBondContact O-N 3.16Å; P390-R394 PolarHBondContact O-N 3.04Å
391E92.5Very high89.9Confident102 Ų10269.5 Ų69.548%0.47733%0.328SS..Hα-helixtrans-52.6-40.8-168.4-173174.8143.300114.4Y341 Q393 R394 M395Y341-E391 HydrophobicContact CE1-CG 4.4Å; Y341-E391 WeakPolarHBondContact CE1-OE1 3.41Å; Y341-E391 PolarHBondContact OH-OE2 3.46Å; E391-Q393 VanDerWaalsContact C-N 3.29Å; E391-Q393 PolarHBondContact O-N 3.36Å; E391-R394 PolarHBondContact O-N 3.29Å; E391-M395 WeakPolarHBondContact O-CB 3.44Å; E391-M395 PolarHBondContact O-N 3.5Å
392Y92.5Very high87.6Confident175 Ų17570.4 Ų70.469%0.68634%0.344SS*.Hα-helixtrans-62.5-35178.167.1-96.5000112.9P390 S396P390-Y392 VanDerWaalsContact C-N 3.28Å; P390-Y392 HydrophobicContact CB-CD1 3.95Å; P390-Y392 HydrophobicContact CB-CE1 3.52Å; P390-Y392 HydrophobicContact CG-CD1 4.2Å; P390-Y392 HydrophobicContact CG-CE1 3.53Å; P390-Y392 HydrophobicContact CG-CE2 4.2Å; P390-Y392 PolarHBondContact O-N 3.44Å; P390-Y392 VanDerWaalsContact O-N 3.08Å; Y392-S396 WeakPolarHBondContact O-CB 3.29Å; Y392-S396 PolarHBondContact O-N 3.15Å
393Q93Very high85.4Confident72 Ų7268.3 Ų68.334%0.33634%0.343SS..Hα-helixtrans-76.5-41177.4-177.8169.7-23.800110.9E389 P390 E391 M395 S396 A397E389-Q393 HydrophobicContact CB-CB 4.32Å; E389-Q393 HydrophobicContact CB-CG 4.22Å; E389-Q393 VanDerWaalsContact CD-NE2 3.31Å; E389-Q393 HydrophobicContact CG-CG 4.06Å; E389-Q393 PolarHBondContact OE1-NE2 3.08Å; P390-Q393 HydrophobicContact CG-CB 3.98Å; P390-Q393 WeakPolarHBondContact O-CA 3.29Å; P390-Q393 WeakPolarHBondContact O-CB 3.39Å; P390-Q393 PolarHBondContact O-N 3.16Å; E391-Q393 VanDerWaalsContact C-N 3.29Å; E391-Q393 PolarHBondContact O-N 3.36Å; Q393-M395 PolarHBondContact O-N 3.15Å; Q393-S396 PolarHBondContact O-N 3.4Å; Q393-S396 VanDerWaalsContact O-N 3.1Å; Q393-S396 PolarHBondContact O-OG 3.13Å; Q393-A397 PolarHBondContact O-N 3.22Å
394R93.4Very high82.9Confident23 Ų2378.1 Ų78.19%0.08739%0.386CS..Hα-helixtrans-56.1-42.1172.6-62.1-167.5-58.2172.27.3111.9E337 Y341 W386 E389 P390 E391 L398E337-R394 IonicContact OE1-CZ 2.76Å; E337-R394 IonicContact OE1-NH1 3.24Å; E337-R394 PolarHBondContact OE1-NH1 2.05Å; E337-R394 IonicContact OE1-NH2 2.83Å; E337-R394 PolarHBondContact OE1-NH2 2.95Å; Y341-R394 PolarHBondContact OH-NH2 2.84Å; W386-R394 HydrophobicContact CD2-CG 4.44Å; W386-R394 HydrophobicContact CZ2-CB 3.96Å; W386-R394 PolarHBondContact NE1-O 2.83Å; W386-R394 VanDerWaalsContact NE1-O 3.13Å; W386-R394 WeakPolarHBondContact O-CD 3.05Å; W386-R394 WeakPolarHBondContact O-CG 2.96Å; E389-R394 HydrophobicContact CB-CG 3.62Å; E389-R394 WeakPolarHBondContact O-CD 3.14Å; E389-R394 VanDerWaalsContact O-CG 3.26Å; E389-R394 WeakPolarHBondContact O-CG 3.4Å; P390-R394 PolarHBondContact O-N 3.04Å; E391-R394 PolarHBondContact O-N 3.29Å; R394-L398 WeakPolarHBondContact O-CG 3.25Å; R394-L398 PolarHBondContact O-N 3.37Å
395M92Very high80.6Confident57 Ų5783.5 Ų83.528%0.28141%0.406SS..Hα-helixtrans-73.5-32.7177.9-15863.166.400112.6Y341 E391 Q393 L398 R399Y341-M395 HydrophobicContact CD1-CE 4.44Å; E391-M395 WeakPolarHBondContact O-CB 3.44Å; E391-M395 PolarHBondContact O-N 3.5Å; Q393-M395 PolarHBondContact O-N 3.15Å; M395-L398 HydrophobicContact SD-CD1 4.22Å; M395-R399 WeakPolarHBondContact O-CG 3.12Å; M395-R399 PolarHBondContact O-N 3.13Å
396S90.5Very high78Confident45 Ų4586.3 Ų86.332%0.31541%0.414SS..Hα-helixtrans-70.5-4017582.50000112.1Y392 Q393 L398 R399 L400Y392-S396 WeakPolarHBondContact O-CB 3.29Å; Y392-S396 PolarHBondContact O-N 3.15Å; Q393-S396 PolarHBondContact O-N 3.4Å; Q393-S396 VanDerWaalsContact O-N 3.1Å; Q393-S396 PolarHBondContact O-OG 3.13Å; S396-L398 VanDerWaalsContact C-N 3.3Å; S396-L398 PolarHBondContact O-N 2.75Å; S396-R399 PolarHBondContact O-N 3.11Å; S396-L400 WeakPolarHBondContact O-CB 3.5Å; S396-L400 WeakPolarHBondContact O-CG 3.44Å; S396-L400 PolarHBondContact O-N 2.79Å
397A89.5Confident75.4Confident24 Ų2490.1 Ų90.120%0.19844%0.438CS..Hα-helixtrans-57.8-40176.100000112.5V352 Q393 R399 A401V352-A397 HydrophobicContact CG2-CB 4.5Å; Q393-A397 PolarHBondContact O-N 3.22Å; A397-R399 VanDerWaalsContact C-N 3.34Å; A397-R399 PolarHBondContact O-N 3.19Å; A397-A401 WeakPolarHBondContact O-CB 3.2Å; A397-A401 PolarHBondContact O-N 3.39Å
398L90.2Very high72.8Confident15 Ų1597.2 Ų97.28%0.07947%0.47CS..Hα-helixtrans-64-36174.5-66.7170.6000112.5I343 V347 F348 R351 V352 W386 R394 M395 S396I343-L398 HydrophobicContact CD1-CD1 3.71Å; I343-L398 HydrophobicContact CG1-CD1 3.95Å; I343-L398 HydrophobicContact CG2-CD1 4.05Å; I343-L398 HydrophobicContact CG2-CD2 4Å; V347-L398 HydrophobicContact CG1-CD2 4.19Å; F348-L398 HydrophobicContact CB-CD2 4.38Å; F348-L398 HydrophobicContact CD2-CD2 4.24Å; R351-L398 WeakPolarHBondContact CG-O 3.34Å; R351-L398 PolarHBondContact NH1-O 3.31Å; V352-L398 HydrophobicContact CG2-CD2 4.2Å; W386-L398 HydrophobicContact CZ2-CD1 4.27Å; R394-L398 WeakPolarHBondContact O-CG 3.25Å; R394-L398 PolarHBondContact O-N 3.37Å; M395-L398 HydrophobicContact SD-CD1 4.22Å; S396-L398 VanDerWaalsContact C-N 3.3Å; S396-L398 PolarHBondContact O-N 2.75Å
399R83.6Confident70.3Confident187 Ų18799.8 Ų99.871%0.70648%0.48SS*.Hα-helixtrans-75.8-47.1179.4-66.7174.1-171.91743.5112.4R351 M395 S396 A397R351-R399 PolarHBondContact NH1-O 3.11Å; M395-R399 WeakPolarHBondContact O-CG 3.12Å; M395-R399 PolarHBondContact O-N 3.13Å; S396-R399 PolarHBondContact O-N 3.11Å; A397-R399 VanDerWaalsContact C-N 3.34Å; A397-R399 PolarHBondContact O-N 3.19Å
400L64.1Low67.9Low133 Ų133101.9 Ų101.970%0.69650%0.496SS*.Hα-helixtrans-92.5-22.3-160.9-66.5172.1000115.4S396 T402S396-L400 WeakPolarHBondContact O-CB 3.5Å; S396-L400 WeakPolarHBondContact O-CG 3.44Å; S396-L400 PolarHBondContact O-N 2.79Å; L400-T402 VanDerWaalsContact C-N 3.29Å; L400-T402 PolarHBondContact O-N 2.79Å
401A58.2Low65.5Low32 Ų32106.1 Ų106.126%0.26451%0.511SS..  trans-77.374.3-172.900000113.4R351 A397 C403R351-A401 HydrophobicContact CB-CB 4.07Å; R351-A401 WeakPolarHBondContact CD-O 3.45Å; R351-A401 WeakPolarHBondContact O-CB 3.35Å; A397-A401 WeakPolarHBondContact O-CB 3.2Å; A397-A401 PolarHBondContact O-N 3.39Å; A401-C403 PolarHBondContact O-N 3.18Å; A401-C403 VanDerWaalsContact O-N 3.13Å
402T47.3Very low63.1Low112 Ų112111.6 Ų111.669%0.68753%0.533SS*.  trans-64108.1154.153.20000107.1L400 K404L400-T402 VanDerWaalsContact C-N 3.29Å; L400-T402 PolarHBondContact O-N 2.79Å; T402-K404 PolarHBondContact O-N 3.13Å
403C47.3Very low60.7Low49 Ų49106.6 Ų106.633%0.33153%0.528SS..  trans-60.2102.1174.5-69.80000108.6Q350 C354 A401 R405Q350-C403 PolarHBondContact O-SG 3.1Å; C354-C403 VanDerWaalsContact CA-SG 3.54Å; C354-C403 HydrophobicContact CB-CB 4.22Å; C354-C403 WeakPolarHBondContact CB-SG 3.45Å; C354-C403 WeakPolarHBondContact SG-CB 3.43Å; C354-C403 CovalentContact SG-SG 2.05Å; C354-C403 PolarHBondContact SG-SG 2.98Å; A401-C403 PolarHBondContact O-N 3.18Å; A401-C403 VanDerWaalsContact O-N 3.13Å; C403-R405 PolarHBondContact O-N 3.45Å
404K45.1Very low58.4Low205 Ų205109.1 Ų109.189%0.89154%0.54SS*.  trans-62.569.6161.1-77.9-171169.7-173.20109.4T402 K406T402-K404 PolarHBondContact O-N 3.13Å; K404-K406 PolarHBondContact O-N 3.19Å
405R47Very low56.1Low205 Ų205115.7 Ų115.777%0.77458%0.577SS**  trans-64.2124.1146.1-80.9-173-72.3138.1-1105.2C403 T407C403-R405 PolarHBondContact O-N 3.45Å; R405-T407 PolarHBondContact O-N 3.28Å; R405-T407 PolarHBondContact O-OG1 3.44Å; R405-T407 VanDerWaalsContact O-OG1 3.1Å
406K40.1Very low53.9Low141 Ų141121 Ų12161%0.61360%0.601SS**  trans-39.698.8171.1-174.1-174.8-178.8-1640110.1K404 E409K404-K406 PolarHBondContact O-N 3.19Å; K406-E409 VanDerWaalsContact CE-OE2 3.24Å; K406-E409 WeakPolarHBondContact CE-OE2 3.42Å; K406-E409 IonicContact NZ-OE1 3.7Å; K406-E409 PolarHBondContact NZ-OE1 3Å; K406-E409 IonicContact NZ-OE2 2.94Å; K406-E409 PolarHBondContact NZ-OE2 2.97Å
407T39.1Very low51.9Low86 Ų86128.5 Ų128.553%0.52862%0.622SS.*  trans-85.2-15.3-177.2-64.30000111.9R405 E409 T410 Q411R405-T407 PolarHBondContact O-N 3.28Å; R405-T407 PolarHBondContact O-OG1 3.44Å; R405-T407 VanDerWaalsContact O-OG1 3.1Å; T407-E409 VanDerWaalsContact C-N 3.25Å; T407-E409 PolarHBondContact O-N 3.36Å; T407-T410 PolarHBondContact O-N 3.08Å; T407-Q411 HydrophobicContact CG2-CG 4.21Å
408E42.4Very low50Low179 Ų179131.9 Ų131.984%0.83665%0.645SS**THydrogen-bonded Turntrans-80.86.6-168.7-63.5172.8134.400114.6
409E41.7Very low48.2Very low146 Ų146136.8 Ų136.868%0.68268%0.68SS**THydrogen-bonded Turntrans-119.79.3173.1-97.1174.6-178.100113.6K406 T407K406-E409 VanDerWaalsContact CE-OE2 3.24Å; K406-E409 WeakPolarHBondContact CE-OE2 3.42Å; K406-E409 IonicContact NZ-OE1 3.7Å; K406-E409 PolarHBondContact NZ-OE1 3Å; K406-E409 IonicContact NZ-OE2 2.94Å; K406-E409 PolarHBondContact NZ-OE2 2.97Å; T407-E409 VanDerWaalsContact C-N 3.25Å; T407-E409 PolarHBondContact O-N 3.36Å
410T42.6Very low47.5Very low96 Ų96137.4 Ų137.459%0.58969%0.688SS**THydrogen-bonded Turntrans-128.2-3-176.8-41.70000114.4T407 K412 A413T407-T410 PolarHBondContact O-N 3.08Å; T410-K412 PolarHBondContact O-N 3.15Å; T410-A413 PolarHBondContact O-N 3.37Å
411Q43.4Very low48.4Very low145 Ų145140.1 Ų140.168%0.67869%0.694SS**THydrogen-bonded Turntrans-77.35.1-179.6-71.9-176.6-22.100115.3T407T407-Q411 HydrophobicContact CG2-CG 4.21Å
412K41.6Very low50Low216 Ų216144.8 Ų144.894%0.93972%0.721SS**THydrogen-bonded Turntrans-107.710.7171.5-102.3-173.8177.2-177.40114.8T410T410-K412 PolarHBondContact O-N 3.15Å
413A42.4Very low52.1Low70 Ų70150.7 Ų150.758%0.57973%0.731SS**  trans-127.832.7-175.800000113.2T410T410-A413 PolarHBondContact O-N 3.37Å
414Q45.3Very low54.4Low125 Ų125153.2 Ų153.258%0.58474%0.741SS**  trans-89-18.8-167.7-150.9174.4-99.900115.4
415D45.3Very low56.8Low162 Ų162148.9 Ų148.987%0.86673%0.731SS**SBendtrans-94.9-6.6-175.7-67.4-40.5000115.1
416E45.2Very low59.2Low168 Ų168141.3 Ų141.379%0.78570%0.704SS**  trans-102.948.4177.4-85.6-75.7125.800111.8S418E416-S418 PolarHBondContact O-N 3.15Å
417R47.7Very low61.9Low203 Ų203137.9 Ų137.977%0.76670%0.695SS**  trans-76.565.6174-70.5-169.7-172178.56.3111.7S419R417-S419 PolarHBondContact O-N 3.14Å
418S50.8Low64.7Low95 Ų95138.2 Ų138.266%0.66469%0.694SS**  trans-44.4133.817246.50000112.3E416 K420E416-S418 PolarHBondContact O-N 3.15Å; S418-K420 PolarHBondContact O-N 2.91Å
419S53.1Low67.2Low118 Ų118133.4 Ų133.483%0.82567%0.673SS**  trans-56.8109.4-177.5320000110.5R417 K421R417-S419 PolarHBondContact O-N 3.14Å; S419-K421 PolarHBondContact O-N 3.15Å; S419-K421 VanDerWaalsContact O-N 3.07Å
420K68.7Low69.9Low200 Ų200127.6 Ų127.687%0.8765%0.646SS**  trans-60.3116.5-176.8-69.7174.6-1761670109.5S418S418-K420 PolarHBondContact O-N 2.91Å
421K82.1Confident72.5Confident190 Ų190128 Ų12883%0.82664%0.637SS**  trans-45130.2177.4-62-178.8179.3-174.90110.2S419S419-K421 PolarHBondContact O-N 3.15Å; S419-K421 VanDerWaalsContact O-N 3.07Å
422P91.7Very high75.1Confident129 Ų129126 Ų12684%0.83862%0.623SS**PPolyproline II helixtrans-58.2145.4178.125-33.6000109.9L424P422-L424 PolarHBondContact O-N 3.4Å
423R92.1Very high77.7Confident237 Ų237117.7 Ų117.789%0.89459%0.59SS**PPolyproline II helixtrans-73.9129.6179.1-63.8-172.7-172.2-172.55.4109.3V425R423-V425 PolarHBondContact O-N 3.1Å
424L94.9Very high80.4Confident101 Ų101114.4 Ų114.453%0.52956%0.563SS.*PPolyproline II helixtrans-59.6129169.4-174.1151.5000109.8P422 F426 L458 T462P422-L424 PolarHBondContact O-N 3.4Å; L424-F426 HydrophobicContact CD2-CD1 3.88Å; L424-F426 HydrophobicContact CD2-CE1 3.85Å; L424-F426 HydrophobicContact CD2-CG 4.39Å; L424-F426 HydrophobicContact CD2-CZ 4.33Å; L424-L458 HydrophobicContact CD1-CD2 4.22Å; L424-L458 HydrophobicContact CD2-CD2 4.44Å; L424-T462 HydrophobicContact CD1-CG2 4.24Å; L424-T462 HydrophobicContact CD2-CG2 4.12Å
425V96.1Very high82.9Confident114 Ų114112.8 Ų112.869%0.69156%0.555SS**  trans-113.8128170.2-179.40000106.9R423R423-V425 PolarHBondContact O-N 3.1Å
426F96.9Very high85.3Confident46 Ų46107.5 Ų107.520%0.20253%0.534CS..  trans-67.9134.1174.3-64.9-63.4000110.4L424 Q430 R431 L434 L458 T462 F466L424-F426 HydrophobicContact CD2-CD1 3.88Å; L424-F426 HydrophobicContact CD2-CE1 3.85Å; L424-F426 HydrophobicContact CD2-CG 4.39Å; L424-F426 HydrophobicContact CD2-CZ 4.33Å; F426-Q430 HydrophobicContact CB-CB 4.32Å; F426-Q430 HydrophobicContact CD1-CB 4.34Å; F426-R431 HydrophobicContact CB-CB 4.32Å; F426-L434 HydrophobicContact CD1-CD1 4.11Å; F426-L434 HydrophobicContact CE1-CD1 3.89Å; F426-L434 HydrophobicContact CZ-CD1 4.22Å; F426-L458 HydrophobicContact CD1-CD1 4.02Å; F426-L458 HydrophobicContact CD1-CD2 4.24Å; F426-L458 HydrophobicContact CE1-CD1 3.78Å; F426-L458 HydrophobicContact CE1-CD2 4.15Å; F426-T462 HydrophobicContact CE1-CG2 3.54Å; F426-T462 HydrophobicContact CZ-CG2 3.67Å; F426-F466 HydrophobicContact CE2-CD2 4.11Å; F426-F466 HydrophobicContact CZ-CB 4.27Å; F426-F466 HydrophobicContact CZ-CD2 4.42Å
427T97.4Very high87.8Confident70 Ų70100.9 Ų100.943%0.42950%0.504SS..  trans-63158.9165690000109.9I429 Q430 R431T427-I429 VanDerWaalsContact C-N 3.29Å; T427-I429 PolarHBondContact O-N 3.22Å; T427-I429 VanDerWaalsContact OG1-CG2 3.32Å; T427-I429 WeakPolarHBondContact OG1-CG2 3.33Å; T427-Q430 PolarHBondContact O-N 3.06Å; T427-Q430 WeakPolarHBondContact OG1-CB 3.4Å; T427-Q430 WeakPolarHBondContact OG1-CG 3.45Å; T427-Q430 PolarHBondContact OG1-N 2.8Å; T427-Q430 PolarHBondContact OG1-OE1 3.38Å; T427-R431 WeakPolarHBondContact O-CB 3.24Å; T427-R431 PolarHBondContact O-N 3.22Å
428D96.9Very high90.1Very high93 Ų9392.4 Ų92.450%0.49747%0.473SS..Hα-helixtrans-68.2-29.8-175.8-65.1-52.9000113.3R431 R432D428-R431 IonicContact OD1-NE 2.79Å; D428-R431 PolarHBondContact OD1-NE 3.4Å; D428-R432 VanDerWaalsContact O-CB 3.28Å; D428-R432 WeakPolarHBondContact O-CB 3.37Å; D428-R432 VanDerWaalsContact O-CG 3.26Å; D428-R432 WeakPolarHBondContact O-CG 3.03Å; D428-R432 PolarHBondContact O-N 2.91Å; D428-R432 PolarHBondContact O-NE 2.81Å
429I95.6Very high92.3Very high78 Ų7895.4 Ų95.440%0.447%0.474SS..Hα-helixtrans-65.7-47.8170.5-175.160.1000111.3T427 R431 R432 T433T427-I429 VanDerWaalsContact C-N 3.29Å; T427-I429 PolarHBondContact O-N 3.22Å; T427-I429 VanDerWaalsContact OG1-CG2 3.32Å; T427-I429 WeakPolarHBondContact OG1-CG2 3.33Å; I429-R431 VanDerWaalsContact C-N 3.33Å; I429-R431 PolarHBondContact O-N 2.97Å; I429-R432 PolarHBondContact O-N 3.02Å; I429-T433 WeakPolarHBondContact O-CB 3.39Å; I429-T433 PolarHBondContact O-N 3.04Å; I429-T433 PolarHBondContact O-OG1 3.42Å; I429-T433 VanDerWaalsContact O-OG1 3.06Å
430Q98Very high94.3Very high24 Ų2497.7 Ų97.711%0.11247%0.471CS..Hα-helixtrans-58-46.6175.2-72.4170.6-15.600111.1F426 T427 L434 L456 L458F426-Q430 HydrophobicContact CB-CB 4.32Å; F426-Q430 HydrophobicContact CD1-CB 4.34Å; T427-Q430 PolarHBondContact O-N 3.06Å; T427-Q430 WeakPolarHBondContact OG1-CB 3.4Å; T427-Q430 WeakPolarHBondContact OG1-CG 3.45Å; T427-Q430 PolarHBondContact OG1-N 2.8Å; T427-Q430 PolarHBondContact OG1-OE1 3.38Å; Q430-L434 VanDerWaalsContact O-CB 3.27Å; Q430-L434 WeakPolarHBondContact O-CB 3.18Å; Q430-L434 WeakPolarHBondContact O-CD1 3.27Å; Q430-L434 WeakPolarHBondContact O-CG 3.37Å; Q430-L434 PolarHBondContact O-N 2.96Å; Q430-L456 HydrophobicContact CG-CB 4.22Å; Q430-L456 HydrophobicContact CG-CD2 4.41Å; Q430-L456 PolarHBondContact NE2-O 3.32Å; Q430-L458 HydrophobicContact CB-CD1 4.42Å; Q430-L458 HydrophobicContact CG-CD1 4.23Å; Q430-L458 HydrophobicContact CG-CG 4.5Å
431R97.7Very high95.5Very high105 Ų10590 Ų9040%0.39644%0.441SS..Hα-helixtrans-58.2-51.7177.5-175.8-167.6-56.6-94.4-7.4110.9F426 T427 D428 I429 L434 H435F426-R431 HydrophobicContact CB-CB 4.32Å; T427-R431 WeakPolarHBondContact O-CB 3.24Å; T427-R431 PolarHBondContact O-N 3.22Å; D428-R431 IonicContact OD1-NE 2.79Å; D428-R431 PolarHBondContact OD1-NE 3.4Å; I429-R431 VanDerWaalsContact C-N 3.33Å; I429-R431 PolarHBondContact O-N 2.97Å; R431-L434 PolarHBondContact O-N 2.84Å; R431-H435 PolarHBondContact O-N 3.17Å; R431-H435 PolarHBondContact O-ND1 3Å
432R97.2Very high96.1Very high102 Ų10286 Ų8639%0.38542%0.423SS..Hα-helixtrans-64.6-46.3-176.7-76.1-176.1-88.1128.4-23.7111.5C136 D428 I429 L434 H435 A436C136-R432 PolarHBondContact SG-NH1 3.27Å; D428-R432 VanDerWaalsContact O-CB 3.28Å; D428-R432 WeakPolarHBondContact O-CB 3.37Å; D428-R432 VanDerWaalsContact O-CG 3.26Å; D428-R432 WeakPolarHBondContact O-CG 3.03Å; D428-R432 PolarHBondContact O-N 2.91Å; D428-R432 PolarHBondContact O-NE 2.81Å; I429-R432 PolarHBondContact O-N 3.02Å; R432-L434 PolarHBondContact O-N 3.01Å; R432-H435 PolarHBondContact O-N 2.81Å; R432-A436 PolarHBondContact O-N 3.13Å
433T97.7Very high96.3Very high42 Ų4289.1 Ų89.126%0.25842%0.419SS..Hα-helixtrans-61.5-44.8176.5-570000112.2I429 H435 A436 I437 L456I429-T433 WeakPolarHBondContact O-CB 3.39Å; I429-T433 PolarHBondContact O-N 3.04Å; I429-T433 PolarHBondContact O-OG1 3.42Å; I429-T433 VanDerWaalsContact O-OG1 3.06Å; T433-H435 VanDerWaalsContact C-N 3.33Å; T433-H435 PolarHBondContact O-N 3.4Å; T433-A436 PolarHBondContact O-N 2.99Å; T433-I437 HydrophobicContact CG2-CD1 3.8Å; T433-I437 HydrophobicContact CG2-CG1 4.5Å; T433-I437 WeakPolarHBondContact O-CD1 3.2Å; T433-I437 WeakPolarHBondContact O-CG1 3.34Å; T433-I437 PolarHBondContact O-N 3.22Å; T433-L456 HydrophobicContact CG2-CD1 4.33Å; T433-L456 HydrophobicContact CG2-CD2 3.94Å
434L98.1Very high96.6Very high0 Ų078.2 Ų78.20%038%0.378CS..Hα-helixtrans-61.8-37.2176.2-75.2170.4000112.8F426 Q430 R431 R432 F438 I452 L456 L458 V463 F466 F467F426-L434 HydrophobicContact CD1-CD1 4.11Å; F426-L434 HydrophobicContact CE1-CD1 3.89Å; F426-L434 HydrophobicContact CZ-CD1 4.22Å; Q430-L434 VanDerWaalsContact O-CB 3.27Å; Q430-L434 WeakPolarHBondContact O-CB 3.18Å; Q430-L434 WeakPolarHBondContact O-CD1 3.27Å; Q430-L434 WeakPolarHBondContact O-CG 3.37Å; Q430-L434 PolarHBondContact O-N 2.96Å; R431-L434 PolarHBondContact O-N 2.84Å; R432-L434 PolarHBondContact O-N 3.01Å; L434-F438 WeakPolarHBondContact O-CB 3.19Å; L434-F438 PolarHBondContact O-N 3.35Å; L434-I452 HydrophobicContact CD2-CG2 3.81Å; L434-L456 HydrophobicContact CD1-CD1 4.27Å; L434-L456 HydrophobicContact CD2-CD1 3.8Å; L434-L456 HydrophobicContact CG-CD1 3.61Å; L434-L458 HydrophobicContact CD1-CD1 4.16Å; L434-V463 HydrophobicContact CD2-CG1 4.25Å; L434-F466 HydrophobicContact CB-CD1 3.91Å; L434-F466 HydrophobicContact CB-CD2 4.24Å; L434-F466 HydrophobicContact CB-CE1 3.62Å; L434-F466 HydrophobicContact CB-CE2 3.95Å; L434-F466 HydrophobicContact CB-CG 4.24Å; L434-F466 HydrophobicContact CB-CZ 3.64Å; L434-F466 HydrophobicContact CD1-CB 4.38Å; L434-F466 HydrophobicContact CD1-CD1 4.38Å; L434-F466 HydrophobicContact CD1-CD2 4Å; L434-F466 HydrophobicContact CD1-CE2 4.44Å; L434-F466 HydrophobicContact CD1-CG 3.97Å; L434-F466 HydrophobicContact CD2-CD1 4.07Å; L434-F466 HydrophobicContact CD2-CG 4.39Å; L434-F466 HydrophobicContact CG-CD1 4.35Å; L434-F466 HydrophobicContact CG-CG 4.44Å; L434-F466 WeakPolarHBondContact O-CE1 3.43Å; L434-F467 HydrophobicContact CD2-CE2 3.98Å
435H97.2Very high96.7Very high91 Ų9176.4 Ų76.442%0.42138%0.375SS..Hα-helixtrans-72.1-36.9174.9-74.982.1000112.6R431 R432 T433 F438 K439 F466R431-H435 PolarHBondContact O-N 3.17Å; R431-H435 PolarHBondContact O-ND1 3Å; R432-H435 PolarHBondContact O-N 2.81Å; T433-H435 VanDerWaalsContact C-N 3.33Å; T433-H435 PolarHBondContact O-N 3.4Å; H435-F438 PolarHBondContact O-N 3.37Å; H435-K439 PolarHBondContact O-N 2.95Å; H435-F466 AromaticContact CE1-CE2 3.66Å; H435-F466 AromaticContact CE1-CZ 3.82Å; H435-F466 AromaticContact ND1-CE2 3.96Å; H435-F466 AromaticContact ND1-CZ 3.81Å
436A97.1Very high96.7Very high52 Ų5279.6 Ų79.643%0.4338%0.379SS..Hα-helixtrans-61.3-50.3174.100000110.9R432 T433 F438 K439 E440R432-A436 PolarHBondContact O-N 3.13Å; T433-A436 PolarHBondContact O-N 2.99Å; A436-F438 VanDerWaalsContact C-N 3.26Å; A436-F438 PolarHBondContact O-N 2.69Å; A436-K439 WeakPolarHBondContact O-CB 3.03Å; A436-K439 PolarHBondContact O-N 3.05Å; A436-E440 PolarHBondContact O-N 3.36Å
437I97.1Very high96.7Very high29 Ų2984.2 Ų84.215%0.14940%0.401CS..Hα-helixtrans-61.9-35.5176-59.4156.9000111.2T433 K439 E440 T441 M448 I452 F467T433-I437 HydrophobicContact CG2-CD1 3.8Å; T433-I437 HydrophobicContact CG2-CG1 4.5Å; T433-I437 WeakPolarHBondContact O-CD1 3.2Å; T433-I437 WeakPolarHBondContact O-CG1 3.34Å; T433-I437 PolarHBondContact O-N 3.22Å; I437-K439 VanDerWaalsContact C-N 3.27Å; I437-K439 PolarHBondContact O-N 2.93Å; I437-E440 PolarHBondContact O-N 3.44Å; I437-T441 HydrophobicContact CG2-CG2 3.81Å; I437-T441 PolarHBondContact O-N 3.3Å; I437-M448 HydrophobicContact CG2-CE 3.99Å; I437-I452 HydrophobicContact CD1-CD1 3.96Å; I437-I452 HydrophobicContact CD1-CG1 3.86Å; I437-I452 HydrophobicContact CD1-CG2 4.05Å; I437-I452 HydrophobicContact CG2-CD1 3.87Å; I437-F467 HydrophobicContact CB-CZ 4.13Å; I437-F467 HydrophobicContact CG2-CE1 4.25Å; I437-F467 HydrophobicContact CG2-CZ 3.72Å
438F96.9Very high96.7Very high25 Ų2584.4 Ų84.411%0.1140%0.398CS..Hα-helixtrans-69.6-19.2174.1-174.2-108.5000113.8L434 H435 A436 K442 F466 F467 A470 R471L434-F438 WeakPolarHBondContact O-CB 3.19Å; L434-F438 PolarHBondContact O-N 3.35Å; H435-F438 PolarHBondContact O-N 3.37Å; A436-F438 VanDerWaalsContact C-N 3.26Å; A436-F438 PolarHBondContact O-N 2.69Å; F438-K442 HydrophobicContact CD2-CD 4.24Å; F438-K442 HydrophobicContact CE1-CD 4.21Å; F438-K442 HydrophobicContact CE2-CB 4.13Å; F438-K442 HydrophobicContact CE2-CD 3.83Å; F438-K442 HydrophobicContact CZ-CD 3.81Å; F438-K442 VanDerWaalsContact O-CD 3.3Å; F438-K442 WeakPolarHBondContact O-CD 3.4Å; F438-K442 WeakPolarHBondContact O-CE 3.42Å; F438-K442 PolarHBondContact O-NZ 3.47Å; F438-F466 HydrophobicContact CB-CE1 4.22Å; F438-F467 HydrophobicContact CB-CE1 3.99Å; F438-F467 AromaticContact CD2-CD1 3.81Å; F438-F467 HydrophobicContact CD2-CD1 3.81Å; F438-F467 HydrophobicContact CD2-CE1 4.03Å; F438-A470 HydrophobicContact CD1-CB 3.94Å; F438-A470 HydrophobicContact CD2-CB 3.77Å; F438-A470 HydrophobicContact CE1-CB 3.81Å; F438-A470 HydrophobicContact CE2-CB 3.63Å; F438-A470 HydrophobicContact CG-CB 3.91Å; F438-A470 HydrophobicContact CZ-CB 3.66Å; F438-R471 HydrophobicContact CE2-CG 3.86Å; F438-R471 HydrophobicContact CZ-CG 4.33Å
439K95.1Very high96.7Very high157 Ų15781.4 Ų81.468%0.68338%0.381SS*.Hα-helixtrans-68.5-53.2168.4-71.2178.5178.8-175.50109.5H435 A436 I437 K442H435-K439 PolarHBondContact O-N 2.95Å; A436-K439 WeakPolarHBondContact O-CB 3.03Å; A436-K439 PolarHBondContact O-N 3.05Å; I437-K439 VanDerWaalsContact C-N 3.27Å; I437-K439 PolarHBondContact O-N 2.93Å; K439-K442 PolarHBondContact O-NZ 3.06Å
440E95.3Very high96.9Very high167 Ų16779.3 Ų79.378%0.7838%0.375SS*.Hα-helixtrans-64.7-47.6-179.7-55.6-46.211700113.8A436 I437A436-E440 PolarHBondContact O-N 3.36Å; I437-E440 PolarHBondContact O-N 3.44Å
441T94.4Very high96.8Very high37 Ų3780.7 Ų80.723%0.22739%0.385CS..  trans-135.4116.8-178.6-179.70000113.1I437 R443 P444 M448I437-T441 HydrophobicContact CG2-CG2 3.81Å; I437-T441 PolarHBondContact O-N 3.3Å; T441-R443 VanDerWaalsContact C-N 3.25Å; T441-R443 PolarHBondContact O-N 3.12Å; T441-R443 PolarHBondContact OG1-N 3.48Å; T441-P444 HydrophobicContact CG2-CB 4.13Å; T441-M448 HydrophobicContact CG2-CE 3.79Å; T441-M448 HydrophobicContact CG2-SD 3.89Å
442K95.3Very high96.8Very high106 Ų10676 Ų7646%0.46137%0.368SS..SBendtrans-72.7-20175.2-48-57.5168.8-158.40112.4F438 K439 R471F438-K442 HydrophobicContact CD2-CD 4.24Å; F438-K442 HydrophobicContact CE1-CD 4.21Å; F438-K442 HydrophobicContact CE2-CB 4.13Å; F438-K442 HydrophobicContact CE2-CD 3.83Å; F438-K442 HydrophobicContact CZ-CD 3.81Å; F438-K442 VanDerWaalsContact O-CD 3.3Å; F438-K442 WeakPolarHBondContact O-CD 3.4Å; F438-K442 WeakPolarHBondContact O-CE 3.42Å; F438-K442 PolarHBondContact O-NZ 3.47Å; K439-K442 PolarHBondContact O-NZ 3.06Å; K442-R471 VanDerWaalsContact O-CD 3.24Å; K442-R471 WeakPolarHBondContact O-CD 3.41Å; K442-R471 WeakPolarHBondContact O-CG 3.15Å; K442-R471 PolarHBondContact O-NH1 3.23Å
443R96.2Very high96.9Very high195 Ų19571.2 Ų71.274%0.73635%0.351SS*.SBendtrans-141.266-170.1-62.9-176.470.3103.41.1110.9T441T441-R443 VanDerWaalsContact C-N 3.25Å; T441-R443 PolarHBondContact O-N 3.12Å; T441-R443 PolarHBondContact OG1-N 3.48Å
444P96.6Very high96.9Very high8 Ų876.8 Ų76.85%0.05237%0.374CS..  trans-58.2146.8175.526.7-36.5000111.3T441 M448 Q449 F467T441-P444 HydrophobicContact CG2-CB 4.13Å; P444-M448 HydrophobicContact CB-CB 4.17Å; P444-M448 HydrophobicContact CB-CG 4.07Å; P444-M448 HydrophobicContact CB-SD 3.56Å; P444-M448 VanDerWaalsContact CB-SD 3.56Å; P444-Q449 HydrophobicContact CB-CG 4.06Å; P444-Q449 HydrophobicContact CG-CG 3.76Å; P444-Q449 PolarHBondContact O-NE2 2.98Å; P444-F467 VanDerWaalsContact CD-CD1 3.48Å; P444-F467 HydrophobicContact CG-CB 4.47Å; P444-F467 HydrophobicContact CG-CD1 3.62Å; P444-F467 HydrophobicContact CG-CD2 3.76Å; P444-F467 HydrophobicContact CG-CE1 3.7Å; P444-F467 HydrophobicContact CG-CE2 3.85Å; P444-F467 HydrophobicContact CG-CG 3.68Å; P444-F467 HydrophobicContact CG-CZ 3.84Å
445S97.4Very high96.8Very high64 Ų6481.9 Ų81.945%0.44840%0.398SS..  trans-64.5166.6176.272.10000111.6E447 M448 Q449S445-E447 VanDerWaalsContact C-N 3.27Å; S445-E447 PolarHBondContact O-N 2.85Å; S445-M448 PolarHBondContact O-N 2.71Å; S445-M448 WeakPolarHBondContact OG-CB 3.47Å; S445-M448 PolarHBondContact OG-N 3.46Å; S445-Q449 WeakPolarHBondContact O-CB 3.22Å; S445-Q449 VanDerWaalsContact O-CG 3.26Å; S445-Q449 WeakPolarHBondContact O-CG 3.43Å; S445-Q449 PolarHBondContact O-N 3.27Å; S445-Q449 PolarHBondContact O-NE2 3.42Å
446K96.8Very high96.8Very high180 Ų18078.5 Ų78.578%0.78338%0.383SS*.Hα-helixtrans-61.9-38.4176.8-174.4-178.2176.6-172.10111.7A450K446-A450 PolarHBondContact O-N 3.45Å; K446-A450 VanDerWaalsContact O-N 3.09Å
447E97.4Very high96.8Very high144 Ų14483.2 Ų83.267%0.67340%0.401SS*.Hα-helixtrans-64.3-51.8174.4179.9178.2-158.900111.5S445 Q449 A450 T451S445-E447 VanDerWaalsContact C-N 3.27Å; S445-E447 PolarHBondContact O-N 2.85Å; E447-Q449 VanDerWaalsContact C-N 3.25Å; E447-Q449 PolarHBondContact O-N 3.48Å; E447-A450 CarbonylContact O-C 3.59Å; E447-A450 WeakPolarHBondContact O-CA 3.32Å; E447-A450 VanDerWaalsContact O-CB 3.32Å; E447-A450 WeakPolarHBondContact O-CB 3.45Å; E447-A450 PolarHBondContact O-N 3.01Å; E447-T451 PolarHBondContact O-N 3Å; E447-T451 PolarHBondContact O-OG1 3.45Å
448M97.1Very high96.8Very high74 Ų7483 Ų8337%0.36540%0.4SS..Hα-helixtrans-58.1-38.9176.7-170.7-174-171.100111.6I437 T441 P444 S445 A450 T451 I452I437-M448 HydrophobicContact CG2-CE 3.99Å; T441-M448 HydrophobicContact CG2-CE 3.79Å; T441-M448 HydrophobicContact CG2-SD 3.89Å; P444-M448 HydrophobicContact CB-CB 4.17Å; P444-M448 HydrophobicContact CB-CG 4.07Å; P444-M448 HydrophobicContact CB-SD 3.56Å; P444-M448 VanDerWaalsContact CB-SD 3.56Å; S445-M448 PolarHBondContact O-N 2.71Å; S445-M448 WeakPolarHBondContact OG-CB 3.47Å; S445-M448 PolarHBondContact OG-N 3.46Å; M448-A450 VanDerWaalsContact C-N 3.31Å; M448-A450 PolarHBondContact O-N 3.28Å; M448-T451 PolarHBondContact O-N 3.16Å; M448-I452 HydrophobicContact CE-CD1 4.44Å; M448-I452 HydrophobicContact CG-CD1 3.93Å; M448-I452 WeakPolarHBondContact O-CB 3.42Å; M448-I452 WeakPolarHBondContact O-CD1 3.47Å; M448-I452 WeakPolarHBondContact O-CG1 3.47Å; M448-I452 PolarHBondContact O-N 3.13Å
449Q97.7Very high96.8Very high30 Ų3088.1 Ų88.114%0.1442%0.424CS..Hα-helixtrans-63.2-34.3173.1-72.6171.457.500112.8P444 S445 E447 A453 V460 V463 A464P444-Q449 HydrophobicContact CB-CG 4.06Å; P444-Q449 HydrophobicContact CG-CG 3.76Å; P444-Q449 PolarHBondContact O-NE2 2.98Å; S445-Q449 WeakPolarHBondContact O-CB 3.22Å; S445-Q449 VanDerWaalsContact O-CG 3.26Å; S445-Q449 WeakPolarHBondContact O-CG 3.43Å; S445-Q449 PolarHBondContact O-N 3.27Å; S445-Q449 PolarHBondContact O-NE2 3.42Å; E447-Q449 VanDerWaalsContact C-N 3.25Å; E447-Q449 PolarHBondContact O-N 3.48Å; Q449-A453 WeakPolarHBondContact O-CB 3.41Å; Q449-A453 PolarHBondContact O-N 2.9Å; Q449-V460 HydrophobicContact CB-CG1 4.36Å; Q449-V463 HydrophobicContact CB-CG1 4.23Å; Q449-V463 HydrophobicContact CG-CG1 4.24Å; Q449-A464 VanDerWaalsContact OE1-CA 3.28Å
450A98.1Very high96.9Very high33 Ų3383.7 Ų83.727%0.27341%0.41SS..Hα-helixtrans-70.2-41.8174.100000111.9K446 E447 M448 A453 Q454 V460K446-A450 PolarHBondContact O-N 3.45Å; K446-A450 VanDerWaalsContact O-N 3.09Å; E447-A450 CarbonylContact O-C 3.59Å; E447-A450 WeakPolarHBondContact O-CA 3.32Å; E447-A450 VanDerWaalsContact O-CB 3.32Å; E447-A450 WeakPolarHBondContact O-CB 3.45Å; E447-A450 PolarHBondContact O-N 3.01Å; M448-A450 VanDerWaalsContact C-N 3.31Å; M448-A450 PolarHBondContact O-N 3.28Å; A450-A453 WeakPolarHBondContact O-CB 3.45Å; A450-A453 PolarHBondContact O-N 2.97Å; A450-Q454 WeakPolarHBondContact O-CG 3.45Å; A450-Q454 PolarHBondContact O-N 3.43Å; A450-V460 HydrophobicContact CB-CG2 4.28Å
451T97.5Very high97Very high53 Ų5378.2 Ų78.233%0.32539%0.39SS..Hα-helixtrans-60.4-45.9173.7-46.90000111.6E447 M448 A453 Q454 Q455E447-T451 PolarHBondContact O-N 3Å; E447-T451 PolarHBondContact O-OG1 3.45Å; M448-T451 PolarHBondContact O-N 3.16Å; T451-A453 VanDerWaalsContact C-N 3.34Å; T451-A453 PolarHBondContact O-N 3.13Å; T451-Q454 PolarHBondContact O-N 2.92Å; T451-Q455 WeakPolarHBondContact O-CB 2.86Å; T451-Q455 WeakPolarHBondContact O-CG 3.15Å; T451-Q455 PolarHBondContact O-N 3.38Å
452I97.3Very high97.2Very high6 Ų677.7 Ų77.73%0.03139%0.387CS..Hα-helixtrans-63-41.5176.7-65.5161.7000110.9L434 I437 M448 Q455 L456 V463 F467L434-I452 HydrophobicContact CD2-CG2 3.81Å; I437-I452 HydrophobicContact CD1-CD1 3.96Å; I437-I452 HydrophobicContact CD1-CG1 3.86Å; I437-I452 HydrophobicContact CD1-CG2 4.05Å; I437-I452 HydrophobicContact CG2-CD1 3.87Å; M448-I452 HydrophobicContact CE-CD1 4.44Å; M448-I452 HydrophobicContact CG-CD1 3.93Å; M448-I452 WeakPolarHBondContact O-CB 3.42Å; M448-I452 WeakPolarHBondContact O-CD1 3.47Å; M448-I452 WeakPolarHBondContact O-CG1 3.47Å; M448-I452 PolarHBondContact O-N 3.13Å; I452-Q455 PolarHBondContact O-N 2.98Å; I452-L456 HydrophobicContact CG2-CD1 3.8Å; I452-L456 HydrophobicContact CG2-CG 4.37Å; I452-L456 VanDerWaalsContact O-CB 3.3Å; I452-L456 WeakPolarHBondContact O-CB 3.44Å; I452-L456 WeakPolarHBondContact O-CG 3.23Å; I452-L456 PolarHBondContact O-N 2.77Å; I452-V463 HydrophobicContact CB-CG1 4.2Å; I452-V463 HydrophobicContact CG2-CG1 3.86Å; I452-V463 HydrophobicContact CG2-CG2 4.23Å; I452-F467 HydrophobicContact CD1-CE2 4.23Å; I452-F467 HydrophobicContact CD1-CZ 4.34Å
453A97.9Very high97.3Very high3 Ų372.6 Ų72.63%0.02537%0.365CS..Hα-helixtrans-61.1-45.5177.600000111.8Q449 A450 T451 N457 L458 V460 V463Q449-A453 WeakPolarHBondContact O-CB 3.41Å; Q449-A453 PolarHBondContact O-N 2.9Å; A450-A453 WeakPolarHBondContact O-CB 3.45Å; A450-A453 PolarHBondContact O-N 2.97Å; T451-A453 VanDerWaalsContact C-N 3.34Å; T451-A453 PolarHBondContact O-N 3.13Å; A453-N457 WeakPolarHBondContact O-CA 3.24Å; A453-N457 PolarHBondContact O-N 3.47Å; A453-L458 CarbonylContact C-O 3.59Å; A453-L458 WeakPolarHBondContact CB-O 3.43Å; A453-L458 PolarHBondContact O-N 3.36Å; A453-V460 HydrophobicContact CB-CB 4.33Å; A453-V460 HydrophobicContact CB-CG2 3.86Å; A453-V463 HydrophobicContact CB-CG2 3.83Å
454Q97.5Very high97.4Very high158 Ų15864.6 Ų64.674%0.73834%0.34SS*.Hα-helixtrans-62.3-49.7174.5-72.6173.7-28.200112.1A450 T451 L456 N457A450-Q454 WeakPolarHBondContact O-CG 3.45Å; A450-Q454 PolarHBondContact O-N 3.43Å; T451-Q454 PolarHBondContact O-N 2.92Å; Q454-L456 VanDerWaalsContact C-N 3.28Å; Q454-L456 PolarHBondContact O-N 3.38Å; Q454-N457 PolarHBondContact O-N 3.47Å
455Q96.7Very high97.4Very high107 Ų10768 Ų6850%0.536%0.357SS..Hα-helixtrans-63.1-31.7-178.6-73.3176.45.900113.7T451 I452T451-Q455 WeakPolarHBondContact O-CB 2.86Å; T451-Q455 WeakPolarHBondContact O-CG 3.15Å; T451-Q455 PolarHBondContact O-N 3.38Å; I452-Q455 PolarHBondContact O-N 2.98Å
456L97Very high97.5Very high21 Ų2166 Ų6611%0.1134%0.341CS..THydrogen-bonded Turntrans-96.20.3-179.7-66.8-175.1000114Q430 T433 L434 I452 Q454 L458Q430-L456 HydrophobicContact CG-CB 4.22Å; Q430-L456 HydrophobicContact CG-CD2 4.41Å; Q430-L456 PolarHBondContact NE2-O 3.32Å; T433-L456 HydrophobicContact CG2-CD1 4.33Å; T433-L456 HydrophobicContact CG2-CD2 3.94Å; L434-L456 HydrophobicContact CD1-CD1 4.27Å; L434-L456 HydrophobicContact CD2-CD1 3.8Å; L434-L456 HydrophobicContact CG-CD1 3.61Å; I452-L456 HydrophobicContact CG2-CD1 3.8Å; I452-L456 HydrophobicContact CG2-CG 4.37Å; I452-L456 VanDerWaalsContact O-CB 3.3Å; I452-L456 WeakPolarHBondContact O-CB 3.44Å; I452-L456 WeakPolarHBondContact O-CG 3.23Å; I452-L456 PolarHBondContact O-N 2.77Å; Q454-L456 VanDerWaalsContact C-N 3.28Å; Q454-L456 PolarHBondContact O-N 3.38Å; L456-L458 VanDerWaalsContact C-N 3.35Å; L456-L458 HydrophobicContact CB-CD1 3.85Å; L456-L458 HydrophobicContact CB-CG 4.1Å; L456-L458 HydrophobicContact CD1-CD1 4.24Å; L456-L458 PolarHBondContact O-N 2.91Å
457N97Very high97.5Very high151 Ų15157.4 Ų57.481%0.80730%0.304SS*.THydrogen-bonded Turntrans50.351.7-172.7-154.354.5000112.6A453 Q454A453-N457 WeakPolarHBondContact O-CA 3.24Å; A453-N457 PolarHBondContact O-N 3.47Å; Q454-N457 PolarHBondContact O-N 3.47Å
458L97Very high97.4Very high24 Ų2455.2 Ų55.213%0.12629%0.294CS..  trans-123.5160.2-179.7-71.4172.5000110.5L424 F426 Q430 L434 A453 L456 T462 V463L424-L458 HydrophobicContact CD1-CD2 4.22Å; L424-L458 HydrophobicContact CD2-CD2 4.44Å; F426-L458 HydrophobicContact CD1-CD1 4.02Å; F426-L458 HydrophobicContact CD1-CD2 4.24Å; F426-L458 HydrophobicContact CE1-CD1 3.78Å; F426-L458 HydrophobicContact CE1-CD2 4.15Å; Q430-L458 HydrophobicContact CB-CD1 4.42Å; Q430-L458 HydrophobicContact CG-CD1 4.23Å; Q430-L458 HydrophobicContact CG-CG 4.5Å; L434-L458 HydrophobicContact CD1-CD1 4.16Å; A453-L458 CarbonylContact C-O 3.59Å; A453-L458 WeakPolarHBondContact CB-O 3.43Å; A453-L458 PolarHBondContact O-N 3.36Å; L456-L458 VanDerWaalsContact C-N 3.35Å; L456-L458 HydrophobicContact CB-CD1 3.85Å; L456-L458 HydrophobicContact CB-CG 4.1Å; L456-L458 HydrophobicContact CD1-CD1 4.24Å; L456-L458 PolarHBondContact O-N 2.91Å; L458-T462 HydrophobicContact CD2-CG2 4.33Å; L458-V463 HydrophobicContact CB-CG2 4.16Å; L458-V463 HydrophobicContact CD1-CG2 4.32Å
459E97.1Very high97.4Very high133 Ų13354.6 Ų54.662%0.62129%0.293SS*.  trans-69.6143.8167.3-68-171.4179.900111.7S461 T462 V463E459-S461 VanDerWaalsContact CB-OG 3.31Å; E459-S461 WeakPolarHBondContact CB-OG 3.44Å; E459-S461 PolarHBondContact O-N 3.31Å; E459-S461 PolarHBondContact OE2-OG 2.93Å; E459-T462 WeakPolarHBondContact O-CA 3.44Å; E459-T462 WeakPolarHBondContact O-CB 3.16Å; E459-T462 PolarHBondContact O-N 2.79Å; E459-V463 PolarHBondContact O-N 3.43Å; E459-V463 VanDerWaalsContact O-N 3.09Å
460V97.7Very high97.3Very high63 Ų6353.9 Ų53.938%0.38229%0.292SS..Hα-helixtrans-55.7-35170.8-167.90000111.3Q449 A450 A453 T462 V463 A464Q449-V460 HydrophobicContact CB-CG1 4.36Å; A450-V460 HydrophobicContact CB-CG2 4.28Å; A453-V460 HydrophobicContact CB-CB 4.33Å; A453-V460 HydrophobicContact CB-CG2 3.86Å; V460-T462 VanDerWaalsContact C-N 3.29Å; V460-T462 PolarHBondContact O-N 2.92Å; V460-V463 PolarHBondContact O-N 3Å; V460-A464 WeakPolarHBondContact O-CB 3.44Å; V460-A464 PolarHBondContact O-N 2.98Å
461S97.4Very high97.1Very high53 Ų5355.2 Ų55.237%0.37129%0.29SS..Hα-helixtrans-56.6-42.3173.1770000111.9E459 N465E459-S461 VanDerWaalsContact CB-OG 3.31Å; E459-S461 WeakPolarHBondContact CB-OG 3.44Å; E459-S461 PolarHBondContact O-N 3.31Å; E459-S461 PolarHBondContact OE2-OG 2.93Å; S461-N465 VanDerWaalsContact O-CB 3.31Å; S461-N465 WeakPolarHBondContact O-CB 3.26Å; S461-N465 VanDerWaalsContact O-CG 3.22Å; S461-N465 PolarHBondContact O-N 3.35Å; S461-N465 PolarHBondContact O-ND2 2.99Å
462T97.7Very high96.8Very high25 Ų2558.5 Ų58.515%0.15330%0.296CS..Hα-helixtrans-76-40.4-174.7-68.30000110.4L424 F426 L458 E459 V460 N465 F466L424-T462 HydrophobicContact CD1-CG2 4.24Å; L424-T462 HydrophobicContact CD2-CG2 4.12Å; F426-T462 HydrophobicContact CE1-CG2 3.54Å; F426-T462 HydrophobicContact CZ-CG2 3.67Å; L458-T462 HydrophobicContact CD2-CG2 4.33Å; E459-T462 WeakPolarHBondContact O-CA 3.44Å; E459-T462 WeakPolarHBondContact O-CB 3.16Å; E459-T462 PolarHBondContact O-N 2.79Å; V460-T462 VanDerWaalsContact C-N 3.29Å; V460-T462 PolarHBondContact O-N 2.92Å; T462-N465 PolarHBondContact O-N 2.86Å; T462-F466 PolarHBondContact O-N 2.89Å
463V98.2Very high96.5Very high0 Ų066.1 Ų66.10%033%0.325CS..Hα-helixtrans-62.2-48.6171.4179.20000110.6L434 Q449 I452 A453 L458 E459 V460 N465 F466 F467L434-V463 HydrophobicContact CD2-CG1 4.25Å; Q449-V463 HydrophobicContact CB-CG1 4.23Å; Q449-V463 HydrophobicContact CG-CG1 4.24Å; I452-V463 HydrophobicContact CB-CG1 4.2Å; I452-V463 HydrophobicContact CG2-CG1 3.86Å; I452-V463 HydrophobicContact CG2-CG2 4.23Å; A453-V463 HydrophobicContact CB-CG2 3.83Å; L458-V463 HydrophobicContact CB-CG2 4.16Å; L458-V463 HydrophobicContact CD1-CG2 4.32Å; E459-V463 PolarHBondContact O-N 3.43Å; E459-V463 VanDerWaalsContact O-N 3.09Å; V460-V463 PolarHBondContact O-N 3Å; V463-N465 VanDerWaalsContact C-N 3.31Å; V463-N465 PolarHBondContact O-N 3.11Å; V463-F466 WeakPolarHBondContact O-CB 3.28Å; V463-F466 PolarHBondContact O-N 2.84Å; V463-F466 VanDerWaalsContact O-N 3.1Å; V463-F467 HydrophobicContact CG1-CD2 3.8Å; V463-F467 HydrophobicContact CG1-CE2 3.71Å; V463-F467 VanDerWaalsContact O-CD2 3.31Å; V463-F467 WeakPolarHBondContact O-CD2 3.47Å; V463-F467 PolarHBondContact O-N 3.15Å
464A98Very high96Very high26 Ų2667.7 Ų67.722%0.21534%0.336CS..Hα-helixtrans-56.1-45175.700000112.2Q449 V460 F467 M468Q449-A464 VanDerWaalsContact OE1-CA 3.28Å; V460-A464 WeakPolarHBondContact O-CB 3.44Å; V460-A464 PolarHBondContact O-N 2.98Å; A464-F467 PolarHBondContact O-N 3.23Å; A464-M468 WeakPolarHBondContact O-CG 3.41Å; A464-M468 PolarHBondContact O-N 2.87Å
465N97.6Very high94.5Very high79 Ų7965.9 Ų65.942%0.42233%0.33SS..Hα-helixtrans-63.3-37.5175.8-79.9-41.3000113.2S461 T462 V463 M468 N469S461-N465 VanDerWaalsContact O-CB 3.31Å; S461-N465 WeakPolarHBondContact O-CB 3.26Å; S461-N465 VanDerWaalsContact O-CG 3.22Å; S461-N465 PolarHBondContact O-N 3.35Å; S461-N465 PolarHBondContact O-ND2 2.99Å; T462-N465 PolarHBondContact O-N 2.86Å; V463-N465 VanDerWaalsContact C-N 3.31Å; V463-N465 PolarHBondContact O-N 3.11Å; N465-M468 WeakPolarHBondContact OD1-CE 3.44Å; N465-N469 WeakPolarHBondContact O-CB 3.44Å; N465-N469 PolarHBondContact O-N 3.08Å; N465-N469 PolarHBondContact O-ND2 2.72Å
466F98.2Very high92.8Very high23 Ų2367.5 Ų67.510%0.10134%0.342CS..Hα-helixtrans-59.6-55172173.5-88.1000110.4F426 L434 H435 F438 T462 V463 M468 N469 A470F426-F466 HydrophobicContact CE2-CD2 4.11Å; F426-F466 HydrophobicContact CZ-CB 4.27Å; F426-F466 HydrophobicContact CZ-CD2 4.42Å; L434-F466 HydrophobicContact CB-CD1 3.91Å; L434-F466 HydrophobicContact CB-CD2 4.24Å; L434-F466 HydrophobicContact CB-CE1 3.62Å; L434-F466 HydrophobicContact CB-CE2 3.95Å; L434-F466 HydrophobicContact CB-CG 4.24Å; L434-F466 HydrophobicContact CB-CZ 3.64Å; L434-F466 HydrophobicContact CD1-CB 4.38Å; L434-F466 HydrophobicContact CD1-CD1 4.38Å; L434-F466 HydrophobicContact CD1-CD2 4Å; L434-F466 HydrophobicContact CD1-CE2 4.44Å; L434-F466 HydrophobicContact CD1-CG 3.97Å; L434-F466 HydrophobicContact CD2-CD1 4.07Å; L434-F466 HydrophobicContact CD2-CG 4.39Å; L434-F466 HydrophobicContact CG-CD1 4.35Å; L434-F466 HydrophobicContact CG-CG 4.44Å; L434-F466 WeakPolarHBondContact O-CE1 3.43Å; H435-F466 AromaticContact CE1-CE2 3.66Å; H435-F466 AromaticContact CE1-CZ 3.82Å; H435-F466 AromaticContact ND1-CE2 3.96Å; H435-F466 AromaticContact ND1-CZ 3.81Å; F438-F466 HydrophobicContact CB-CE1 4.22Å; T462-F466 PolarHBondContact O-N 2.89Å; V463-F466 WeakPolarHBondContact O-CB 3.28Å; V463-F466 PolarHBondContact O-N 2.84Å; V463-F466 VanDerWaalsContact O-N 3.1Å; F466-M468 VanDerWaalsContact C-N 3.31Å; F466-M468 PolarHBondContact O-N 3.36Å; F466-N469 PolarHBondContact O-N 3.05Å; F466-A470 HydrophobicContact CE1-CB 4.15Å; F466-A470 HydrophobicContact CZ-CB 4.39Å; F466-A470 WeakPolarHBondContact O-CB 3.29Å; F466-A470 PolarHBondContact O-N 3.41Å
467F97.6Very high91Very high0 Ų071.2 Ų71.20%036%0.357CS..Hα-helixtrans-63.9-34.1-178.1-79.4-80.5000112.8L434 I437 F438 P444 I452 V463 A464 R471L434-F467 HydrophobicContact CD2-CE2 3.98Å; I437-F467 HydrophobicContact CB-CZ 4.13Å; I437-F467 HydrophobicContact CG2-CE1 4.25Å; I437-F467 HydrophobicContact CG2-CZ 3.72Å; F438-F467 HydrophobicContact CB-CE1 3.99Å; F438-F467 AromaticContact CD2-CD1 3.81Å; F438-F467 HydrophobicContact CD2-CD1 3.81Å; F438-F467 HydrophobicContact CD2-CE1 4.03Å; P444-F467 VanDerWaalsContact CD-CD1 3.48Å; P444-F467 HydrophobicContact CG-CB 4.47Å; P444-F467 HydrophobicContact CG-CD1 3.62Å; P444-F467 HydrophobicContact CG-CD2 3.76Å; P444-F467 HydrophobicContact CG-CE1 3.7Å; P444-F467 HydrophobicContact CG-CE2 3.85Å; P444-F467 HydrophobicContact CG-CG 3.68Å; P444-F467 HydrophobicContact CG-CZ 3.84Å; I452-F467 HydrophobicContact CD1-CE2 4.23Å; I452-F467 HydrophobicContact CD1-CZ 4.34Å; V463-F467 HydrophobicContact CG1-CD2 3.8Å; V463-F467 HydrophobicContact CG1-CE2 3.71Å; V463-F467 VanDerWaalsContact O-CD2 3.31Å; V463-F467 WeakPolarHBondContact O-CD2 3.47Å; V463-F467 PolarHBondContact O-N 3.15Å; A464-F467 PolarHBondContact O-N 3.23Å; F467-R471 WeakPolarHBondContact O-CB 3.4Å; F467-R471 WeakPolarHBondContact O-CG 3.49Å; F467-R471 PolarHBondContact O-N 3.41Å; F467-R471 VanDerWaalsContact O-N 3.13Å; F467-R471 PolarHBondContact O-NH1 3.28Å
468M95.7Very high89.3Confident97 Ų9767.7 Ų67.748%0.47833%0.333SS..Hα-helixtrans-62.5-45.4170.5-75.2-163.1-66.400112.4A464 N465 F466 R472A464-M468 WeakPolarHBondContact O-CG 3.41Å; A464-M468 PolarHBondContact O-N 2.87Å; N465-M468 WeakPolarHBondContact OD1-CE 3.44Å; F466-M468 VanDerWaalsContact C-N 3.31Å; F466-M468 PolarHBondContact O-N 3.36Å; M468-R472 WeakPolarHBondContact O-CB 3.34Å; M468-R472 PolarHBondContact O-N 3.01Å; M468-R472 VanDerWaalsContact O-N 3.07Å
469N95.7Very high87.3Confident61 Ų6171.2 Ų71.233%0.32636%0.355SS..Hα-helixtrans-72.9-36.4-180-80.5-70.1000113.1N465 F466 R472 R473N465-N469 WeakPolarHBondContact O-CB 3.44Å; N465-N469 PolarHBondContact O-N 3.08Å; N465-N469 PolarHBondContact O-ND2 2.72Å; F466-N469 PolarHBondContact O-N 3.05Å; N469-R472 WeakPolarHBondContact O-CB 3.47Å; N469-R472 PolarHBondContact O-N 3.1Å; N469-R472 VanDerWaalsContact O-N 3.11Å; N469-R472 PolarHBondContact OD1-NE 2.96Å; N469-R473 WeakPolarHBondContact O-CB 3.47Å; N469-R473 WeakPolarHBondContact O-CG 3.45Å; N469-R473 PolarHBondContact O-N 3.31Å
470A96Very high84.8Confident15 Ų1569.1 Ų69.112%0.12435%0.349CS..Hα-helixtrans-60.5-48.4174.400000110.7F438 F466 R472 R473 S474F438-A470 HydrophobicContact CD1-CB 3.94Å; F438-A470 HydrophobicContact CD2-CB 3.77Å; F438-A470 HydrophobicContact CE1-CB 3.81Å; F438-A470 HydrophobicContact CE2-CB 3.63Å; F438-A470 HydrophobicContact CG-CB 3.91Å; F438-A470 HydrophobicContact CZ-CB 3.66Å; F466-A470 HydrophobicContact CE1-CB 4.15Å; F466-A470 HydrophobicContact CZ-CB 4.39Å; F466-A470 WeakPolarHBondContact O-CB 3.29Å; F466-A470 PolarHBondContact O-N 3.41Å; A470-R472 VanDerWaalsContact C-N 3.26Å; A470-R472 PolarHBondContact O-N 3.28Å; A470-R473 PolarHBondContact O-N 3.29Å; A470-S474 PolarHBondContact O-N 2.99Å
471R95.2Very high82.3Confident62 Ų6272.8 Ų72.823%0.23437%0.366CS..Hα-helixtrans-62.6-26.2171.5-72.7-168.8-63-87.10114.4F438 K442 F467 S474 K477F438-R471 HydrophobicContact CE2-CG 3.86Å; F438-R471 HydrophobicContact CZ-CG 4.33Å; K442-R471 VanDerWaalsContact O-CD 3.24Å; K442-R471 WeakPolarHBondContact O-CD 3.41Å; K442-R471 WeakPolarHBondContact O-CG 3.15Å; K442-R471 PolarHBondContact O-NH1 3.23Å; F467-R471 WeakPolarHBondContact O-CB 3.4Å; F467-R471 WeakPolarHBondContact O-CG 3.49Å; F467-R471 PolarHBondContact O-N 3.41Å; F467-R471 VanDerWaalsContact O-N 3.13Å; F467-R471 PolarHBondContact O-NH1 3.28Å; R471-S474 PolarHBondContact O-OG 2.84Å; R471-K477 WeakPolarHBondContact O-CD 3.13Å
472R91.1Very high79.8Confident121 Ų12177.9 Ų77.946%0.45738%0.381SS..Hα-helixtrans-76.2-32.5176-171.4-175.369.682.5-10111.9D362 M468 N469 A470D362-R472 IonicContact OD2-CZ 2.98Å; D362-R472 IonicContact OD2-NH1 2.72Å; D362-R472 PolarHBondContact OD2-NH1 3.08Å; D362-R472 IonicContact OD2-NH2 3.18Å; D362-R472 PolarHBondContact OD2-NH2 3.44Å; M468-R472 WeakPolarHBondContact O-CB 3.34Å; M468-R472 PolarHBondContact O-N 3.01Å; M468-R472 VanDerWaalsContact O-N 3.07Å; N469-R472 WeakPolarHBondContact O-CB 3.47Å; N469-R472 PolarHBondContact O-N 3.1Å; N469-R472 VanDerWaalsContact O-N 3.11Å; N469-R472 PolarHBondContact OD1-NE 2.96Å; A470-R472 VanDerWaalsContact C-N 3.26Å; A470-R472 PolarHBondContact O-N 3.28Å
473R90.3Very high77.5Confident167 Ų16782.3 Ų82.363%0.6340%0.404SS*.Hα-helixtrans-101.1-14.9-171.5-70.6175.7171.7171-2.1114.9N469 A470 L475N469-R473 WeakPolarHBondContact O-CB 3.47Å; N469-R473 WeakPolarHBondContact O-CG 3.45Å; N469-R473 PolarHBondContact O-N 3.31Å; A470-R473 PolarHBondContact O-N 3.29Å; R473-L475 PolarHBondContact O-N 3.44Å; R473-L475 VanDerWaalsContact O-N 3.12Å
474S87.6Confident75.2Confident36 Ų3687.1 Ų87.125%0.25243%0.433SS..  trans-58.6113.8177.254.60000110.9A470 R471 D476 K477A470-S474 PolarHBondContact O-N 2.99Å; R471-S474 PolarHBondContact O-OG 2.84Å; S474-D476 VanDerWaalsContact C-N 3.29Å; S474-D476 PolarHBondContact O-N 3.11Å; S474-K477 PolarHBondContact O-N 2.76Å; S474-K477 WeakPolarHBondContact OG-CD 3.42Å
475L65Low72.5Confident119 Ų11993.3 Ų93.362%0.62346%0.458SS*.G310 helixtrans-58.4-37.4-169.2-177.361.8000113.8R473 K477 W478R473-L475 PolarHBondContact O-N 3.44Å; R473-L475 VanDerWaalsContact O-N 3.12Å; L475-K477 PolarHBondContact O-N 2.61Å; L475-W478 PolarHBondContact O-N 3.08Å
476D61.1Low70.1Confident141 Ų14196.4 Ų96.475%0.75447%0.474SS*.G310 helixtrans-37.3-34173.8-171.4-105.6000114.7S474 W478S474-D476 VanDerWaalsContact C-N 3.29Å; S474-D476 PolarHBondContact O-N 3.11Å; D476-W478 VanDerWaalsContact C-N 3.26Å; D476-W478 PolarHBondContact O-N 3.06Å; D476-W478 VanDerWaalsContact O-N 3.13Å
477K60.7Low67.8Low99 Ų99100.4 Ų100.443%0.4350%0.5SS..G310 helixtrans-68.5-12-173.4-71.6-173.788.7-50.50116.4R471 S474 L475R471-K477 WeakPolarHBondContact O-CD 3.13Å; S474-K477 PolarHBondContact O-N 2.76Å; S474-K477 WeakPolarHBondContact OG-CD 3.42Å; L475-K477 PolarHBondContact O-N 2.61Å
478W60.3Low65.5Low77 Ų77103.9 Ų103.929%0.29253%0.529SS..G310 helixtrans-138.312.9-175-45.6117.3000114.4K368 P369 K372 L475 D476 D480K368-W478 HydrophobicContact CD-CZ2 3.94Å; K368-W478 VanDerWaalsContact CE-CZ2 3.46Å; K368-W478 HydrophobicContact CG-CZ2 4.06Å; P369-W478 HydrophobicContact CG-CB 4.3Å; P369-W478 HydrophobicContact CG-CD2 4.16Å; P369-W478 HydrophobicContact CG-CE3 3.68Å; P369-W478 HydrophobicContact CG-CG 4.44Å; P369-W478 HydrophobicContact CG-CZ3 4.48Å; K372-W478 HydrophobicContact CB-CE3 4.15Å; K372-W478 HydrophobicContact CB-CH2 3.86Å; K372-W478 HydrophobicContact CB-CZ3 3.44Å; K372-W478 VanDerWaalsContact CB-CZ3 3.44Å; K372-W478 HydrophobicContact CD-CZ3 3.81Å; K372-W478 HydrophobicContact CG-CE3 3.9Å; K372-W478 HydrophobicContact CG-CH2 4.26Å; K372-W478 HydrophobicContact CG-CZ3 3.37Å; L475-W478 PolarHBondContact O-N 3.08Å; D476-W478 VanDerWaalsContact C-N 3.26Å; D476-W478 PolarHBondContact O-N 3.06Å; D476-W478 VanDerWaalsContact O-N 3.13Å; W478-D480 PolarHBondContact O-N 3.36Å
479V54.3Low63.2Low98 Ų98103.9 Ų103.959%0.59454%0.538SS*.  trans-75.4101.7162.5-178.30000105.5
480D44.6Very low60.8Low90 Ų90106.9 Ų106.948%0.48156%0.559SS.*  trans-73.5148.6-179.4-129.9-92.6000109.6W478 K482W478-D480 PolarHBondContact O-N 3.36Å; D480-K482 PolarHBondContact O-N 3.22Å
481D46.1Very low58.4Low140 Ų140110.6 Ų110.675%0.74958%0.584SS**THydrogen-bonded Turntrans-56.61.3-168.5-103.7-101.6000117.3
482K45.3Very low55.8Low159 Ų159113.3 Ų113.369%0.69161%0.613SS**Hα-helixtrans-80.7-24.6-166.8-65.4-166.9173.3-174.30115.3D480D480-K482 PolarHBondContact O-N 3.22Å
483D48Very low53.7Low118 Ų118113.6 Ų113.663%0.63163%0.63SS**Hα-helixtrans-81.9-16.4-177.9-67.1-46.2000113.6T487D483-T487 PolarHBondContact O-OG1 3.43Å
484V49.8Very low51.5Low102 Ų102111.8 Ų111.862%0.61864%0.637SS**Hα-helixtrans-84.1-29.9177.5179.50000112T487 A488V484-T487 PolarHBondContact O-OG1 3.18Å; V484-A488 WeakPolarHBondContact O-CB 3.47Å; V484-A488 PolarHBondContact O-N 3.15Å
485Q41.4Very low49.4Very low156 Ų156119.3 Ų119.373%0.72967%0.668SS**Hα-helixtrans-76.6-23.8-176.9-161.6128.573.700113.5S489Q485-S489 PolarHBondContact O-OG 3.35Å
486L48.4Very low48.2Very low144 Ų144118.3 Ų118.375%0.75467%0.671SS**THydrogen-bonded Turntrans-85.6-11.1179.1-73.8164.4000114
487T49Very low47.4Very low106 Ų106119.2 Ų119.265%0.6568%0.675SS**THydrogen-bonded Turntrans-108.5-16.7179.850.10000113.5D483 V484D483-T487 PolarHBondContact O-OG1 3.43Å; V484-T487 PolarHBondContact O-OG1 3.18Å
488A50.8Low46.4Very low73 Ų73123.7 Ų123.760%0.60370%0.698SS**SBendtrans-87.1-6.7179.600000115.2V484V484-A488 WeakPolarHBondContact O-CB 3.47Å; V484-A488 PolarHBondContact O-N 3.15Å
489S47Very low45.6Very low97 Ų97123.1 Ų123.168%0.67872%0.716SS**SBendtrans-97.15.1-171.5-59.50000115.8Q485Q485-S489 PolarHBondContact O-OG 3.35Å
490T45Very low45Very low125 Ų125124.2 Ų124.277%0.76773%0.728SS**SBendtrans-137.346.8-170.8-37.70000113.4
491S44.7Very low45Very low93 Ų93125.8 Ų125.865%0.6574%0.743SS**  trans-159.279170.947.80000112.8
492S41.8Very low45.2Very low119 Ų119124.8 Ų124.883%0.83274%0.744SS**  trans-110.7101.2169.3-55.90000110.3V494S492-V494 PolarHBondContact O-N 2.9Å
493P47.1Very low45.1Very low126 Ų126124.5 Ų124.582%0.81875%0.75SS**  trans-74.8120.9172.5-11.928.5000110.1
494V43.7Very low45.1Very low130 Ų130127.7 Ų127.779%0.78876%0.761SS**  trans-68137.7163.2-76.90000109.9S492S492-V494 PolarHBondContact O-N 2.9Å
495H43.5Very low44.7Very low194 Ų194128.3 Ų128.390%0.89877%0.769SS**  trans-161.4152.6142.5-103.5-66.7000111.7
496S39.5Very low44.8Very low98 Ų98125.2 Ų125.269%0.68577%0.77SS**  trans-91158.1-155.2-48.60000116.2
497L44.2Very low44.5Very low160 Ų160129.8 Ų129.884%0.83878%0.778SS**  trans39.4117.4135.5-70.9156.7000119.7
498E39.5Very low44.2Very low193 Ų193132.6 Ų132.690%0.90279%0.785SS**  -169.6145.7122.1-162.366.3-178.100110.5
499G43Very low43.8Very low65 Ų65134.3 Ų134.367%0.6779%0.793SS**  trans108.168.915300000121.9
500S41.9Very low43.8Very low121 Ų121135.2 Ų135.285%0.84680%0.795SS**  trans50.8129.1136.6-57.40000124.2
501P45.6Very low43.7Very low123 Ų123137.7 Ų137.780%0.79980%0.797SS**  trans-106-178.8174.742.1-35.8000114.6
502P50.7Low43.7Very low119 Ų119140.5 Ų140.577%0.77380%0.802SS**  trans-140.4140.313736.7-22.9000117
503N43Very low43.7Very low152 Ų152138.1 Ų138.181%0.81380%0.796SS**  trans32.1122.6147.5-76.7-22.7000122.3
504H47.5Very low43.3Very low186 Ų186138.4 Ų138.486%0.86179%0.79SS**  -158147.9110.648.8-77.3000111.7
505S40.5Very low43.2Very low114 Ų114140.3 Ų140.380%0.79779%0.79SS**  trans-84.3146.9-170.7-48.60000113.6
506A45.2Very low42.7Very low91 Ų91136.8 Ų136.875%0.75279%0.787SS**  157.3140.69800000114.7
507R41Very low42.7Very low241 Ų241138.4 Ų138.491%0.90979%0.792SS**  trans72.4130.7148.5-146.9170.7-169.11702.5118.3
508M43.3Very low42.3Very low165 Ų165136.1 Ų136.181%0.81378%0.784SS**  cis168.8145.1-24.8-98.1-85.3159.100106.1
509S42.9Very low42.2Very low109 Ų109137.5 Ų137.576%0.76278%0.781SS**  trans111.793.9170.8-64.10000114.7
510T45.6Very low41.8Very low116 Ų116139.9 Ų139.971%0.71279%0.788SS**  80.197.657.567.70000116.3
511H44.2Very low41.7Very low177 Ų177138.2 Ų138.282%0.81978%0.781SS**  trans-176.686.3138.3-167.7-68000108.1
512M43.2Very low41.5Very low152 Ų152140.4 Ų140.475%0.74978%0.78SS**  48.4108.1103.6-51.5-50.6178.800113.1
513G41.7Very low40.9Very low69 Ų69141.5 Ų141.571%0.71178%0.78SS**  90.3149.593.700000111.4
514D38.8Very low40.8Very low131 Ų131138 Ų13870%0.70177%0.772SS**  cis-165.1167.6-10.9-138.4-43.8000110
515H41.9Very low40.5Very low170 Ų170137 Ų13779%0.78777%0.771SS**  trans68.5131.9159.1-54.8-25.9000122.2
516C34.3Very low40.4Very low121 Ų121136.6 Ų136.682%0.81876%0.764SS**  trans-79-175.2170-57.50000112.9
517V38.1Very low40.5Very low131 Ų131138 Ų13879%0.79476%0.764SS**  trans116.6108.8146.9-177.20000116.4
518V37.3Very low41.1Very low112 Ų112132 Ų13268%0.67976%0.755SS**  trans94.7122.8139.61570000123.6
519R35.9Very low40.9Very low222 Ų222132.3 Ų132.384%0.83876%0.755SS**  trans70.7132.8146.7-80.8171-178154.9-3.7123.1
520S35.6Very low40.8Very low116 Ų116133.8 Ų133.881%0.81175%0.753SS**  trans20.2136.7135.1-430000118.9
521A39.1Very low40.5Very low85 Ų85132 Ų13270%0.70275%0.751SS**  cis-177.8159.348.800000112.6
522H41.3Very low40.4Very low169 Ų169132.4 Ų132.478%0.78275%0.753SS**  trans76.6151.9141.7-100.6-96000124.4
523D39Very low40.3Very low143 Ų143129.9 Ų129.977%0.76575%0.75SS**  trans73141.1163.8-54.8-29.2000120.4
524A40Very low40.4Very low79 Ų79134.3 Ų134.365%0.65375%0.754SS**  cis171.8178.9-27.900000107.6
525I41.4Very low40.6Very low163 Ų163132.1 Ų132.184%0.83675%0.749SS**  trans84.7127.9169.1-56.5164.5000114.5
526T38.9Very low40.6Very low107 Ų107130.6 Ų130.666%0.65675%0.747SS**  cis-167.7111.2-6.1-93.30000111.4
527T47.6Very low41Very low120 Ų120129.4 Ų129.474%0.73674%0.74SS**  44.4166.2126.763.70000124.7
528P53.3Low41Very low114 Ų114128.7 Ų128.774%0.7474%0.736SS**  cis-147.9-161.5-40.243.2-24.2000115.7
529H37.9Very low40.9Very low172 Ų172129.9 Ų129.980%0.79674%0.738SS**  trans93132.8159.4-139-124.8000115.6
530L42.2Very low40.9Very low140 Ų140125.8 Ų125.873%0.73373%0.732SS**  cis-144.4142.519.7-158.8163.4000110.5
531A39.9Very low40.8Very low80 Ų80131.6 Ų131.666%0.66174%0.736SS**  trans-83.6156.7-167.900000117.4
532E41.6Very low40.8Very low185 Ų185134.9 Ų134.986%0.86474%0.741SS**  trans-179.9113.2130.1-97.9175.4127.400108.3
533S41.2Very low40.8Very low98 Ų98132.9 Ų132.969%0.68574%0.742SS**  76.5122.994.9-175.50000113.4
534M44.1Very low40.7Very low162 Ų162128.9 Ų128.980%0.79874%0.735SS**  cis-164.2150.54.9-115.5173.37300110.2
535S42.5Very low40.3Very low86 Ų86129.4 Ų129.460%0.60173%0.733SS**  trans38139.5146.961.30000121.9
536D40.8Very low40.2Very low137 Ų137124.9 Ų124.973%0.73371%0.708SS**  cis-168.3153.90.9-122.3-64.2000111.4
537S43.9Very low39.9Very low96 Ų96122.1 Ų122.167%0.67169%0.693SS**  trans35.8141.6131.6-63.80000122
538V36.7Very low39.5Very low117 Ų117120 Ų12071%0.70969%0.688SS**  cis-168.4145.810.2109.50000113.3
539L35.6Very low38.6Very low137 Ų137118.8 Ų118.872%0.71768%0.675SS**  trans47.4130.6153.9-68160.7000124.3
540N35.6Very low38.8Very low136 Ų136116.3 Ų116.373%0.72767%0.673SS**  28.5135.8127.5-63.1-6.9000119.3
541R34.5Very low38.6Very low237 Ų237115.4 Ų115.489%0.89467%0.674SS**  -166.2157.354.7-158178.5-72.8-154.9-1.8112.3
542I38.6Very low38.4Very low155 Ų155116.9 Ų116.980%0.79568%0.679SS**  trans-101.2166-173.3-52.5166.3000109.3
543P41.7Very low38.4Very low126 Ų126115.3 Ų115.382%0.81868%0.682SS**  cis-129.2-169.4-42.340.9-24.4000114
544G37Very low38.3Very low59 Ų59118.5 Ų118.561%0.60869%0.686SS**  trans127.7108.3159.500000112.9
545C31.3Very low38.1Very low90 Ų90117.7 Ų117.761%0.60869%0.685SS**  96138.472.165.60000112.9
546H38.6Very low38.1Very low68 Ų68119.4 Ų119.432%0.31570%0.697SS.*  trans73.7122.8178.7-46.1-85.1000115.3N34 F35 D36N34-H546 WeakPolarHBondContact CB-ND1 3.33Å; N34-H546 PolarHBondContact ND2-CE1 3.18Å; N34-H546 PolarHBondContact ND2-ND1 3.24Å; N34-H546 PolarHBondContact ND2-NE2 3.09Å; N34-H546 PolarHBondContact O-ND1 3.42Å; F35-H546 PolarHBondContact O-CE1 3.33Å; D36-H546 VanDerWaalsContact CA-CE1 3.47Å; D36-H546 WeakPolarHBondContact CA-CE1 3.43Å; D36-H546 WeakPolarHBondContact CB-CE1 3.29Å; D36-H546 WeakPolarHBondContact CB-NE2 3.18Å; D36-H546 VanDerWaalsContact CG-NE2 3.3Å; D36-H546 PolarHBondContact N-CE1 2.87Å; D36-H546 PolarHBondContact N-ND1 3.39Å; D36-H546 VanDerWaalsContact N-ND1 3.18Å; D36-H546 IonicContact OD2-CD2 3.79Å; D36-H546 PolarHBondContact OD2-CD2 3.2Å; D36-H546 IonicContact OD2-CE1 2.69Å; D36-H546 IonicContact OD2-NE2 2.95Å; D36-H546 PolarHBondContact OD2-NE2 3.5Å; D36-H546 VanDerWaalsContact OD2-NE2 3.09Å
547S33.4Very low38.2Very low49 Ų49118.1 Ų118.134%0.34370%0.698SS.*  cis89.4121.640.7-60.60000113.3N32 N34N32-S547 VanDerWaalsContact O-CB 3.29Å; N32-S547 WeakPolarHBondContact O-CB 3.09Å; N32-S547 PolarHBondContact O-OG 3.09Å; N34-S547 WeakPolarHBondContact CA-OG 3.49Å; N34-S547 WeakPolarHBondContact CB-OG 3.32Å; N34-S547 PolarHBondContact N-OG 3.08Å; N34-S547 WeakPolarHBondContact O-CB 3.07Å; N34-S547 PolarHBondContact O-OG 3.2Å
548A38.8Very low38.2Very low77 Ų77119 Ų11964%0.63671%0.705SS**  trans153.858.8-167.200000118.8Q33Q33-A548 VanDerWaalsContact NE2-N 3.14Å
549I35.6Very low38.8Very low88 Ų88119.5 Ų119.545%0.45171%0.71SS.*  trans-63.9150.5159.9-13.6174.9000111D31D31-I549 HydrophobicContact CB-CD1 3.47Å; D31-I549 VanDerWaalsContact CB-CD1 3.47Å; D31-I549 HydrophobicContact CB-CG1 3.86Å; D31-I549 WeakPolarHBondContact OD1-CG1 3.47Å
550P40.3Very low39.4Very low119 Ų119117 Ų11777%0.77371%0.709SS**  -139.5150.694.423.8-3.1000117.4
551T38.9Very low40Very low121 Ų121116.3 Ų116.374%0.74271%0.712SS**  trans-11.4140.9162.643.80000123.9
552S36.6Very low40.9Very low111 Ų111110.9 Ų110.978%0.77671%0.708SS**  trans81.3108.4134.2-65.90000121.9
553V41.5Very low40.8Very low153 Ų153108.7 Ų108.793%0.92771%0.706SS**  -152.9156.9121.7-102.30000112.1
554E38.8Very low41.1Very low164 Ų164110.6 Ų110.677%0.76671%0.708SS**  trans-50.2158.5-164.3-89.117183.900125
555L40.4Very low41.4Very low146 Ų146113.9 Ų113.976%0.76472%0.717SS**  trans66.4110.1140.3-68.7167.3000122.4
556S42.6Very low42.3Very low122 Ų122115.6 Ų115.685%0.85373%0.727SS**  170167.191.2-162.50000111.9
557S41.3Very low42.5Very low109 Ų109119.7 Ų119.776%0.76275%0.751SS**  trans-122.9143.3-151.2-55.20000117.5
558S44.4Very low42.9Very low116 Ų116122.6 Ų122.681%0.81177%0.769SS**  trans70.1159.1155-115.60000117.8
559P50Low42.9Very low126 Ų126124.2 Ų124.282%0.81878%0.776SS**  cis-136.417448.637.6-17.8000117.9
560A46.7Very low43Very low85 Ų85128.4 Ų128.470%0.70280%0.798SS**PPolyproline II helixtrans-100.2161.6178.600000113.1
561P49.1Very low42.7Very low122 Ų122127.1 Ų127.179%0.79279%0.792SS**PPolyproline II helixtrans-80.5159.3-175.832.6-35.7000114.4
562P53.4Low42.7Very low123 Ų123128.6 Ų128.680%0.79979%0.792SS**PPolyproline II helixtrans-88.1151.5-162.534.3-36.8000115.4
563S37.2Very low42.6Very low108 Ų108128.7 Ų128.776%0.75578%0.784SS**PPolyproline II helixtrans-97142.7163.8-176.60000110
564L47.1Very low42.5Very low166 Ų166128.8 Ų128.887%0.86977%0.774SS**  trans-112.6114.4175.9-74.1173.8000111
565T42.9Very low42.6Very low129 Ų129125.5 Ų125.579%0.79177%0.769SS**  trans-118.8143.1163.849.20000109.4
566P50.3Low42.1Very low126 Ų126127.1 Ų127.182%0.81877%0.772SS**  trans-141.7163.3135.237.2-24.9000111.7
567D43Very low41.9Very low153 Ų153128 Ų12882%0.81877%0.773SS**  cis-167.8141.2-29.7-155.11.6000103.9
568P41.7Very low41.5Very low110 Ų110130.5 Ų130.571%0.71477%0.772SS**  trans-93.6170.7-173.435.2-30.6000113.8
569S38.2Very low41.2Very low112 Ų112131.4 Ų131.478%0.78377%0.767SS**  trans83.5113.5173.380.50000117.6
570L39.1Very low40.3Very low176 Ų176132.4 Ų132.492%0.92177%0.765SS**  -148.6155104.8-93.4-180000108.8
571S33.4Very low39.8Very low91 Ų91132.4 Ų132.464%0.63677%0.766SS**  trans-107175.1-163.8640000113.7
572M39.5Very low39.1Very low152 Ų152132.4 Ų132.475%0.74977%0.766SS**  trans104.4138.8168.3-58.2-66.3115.300115.5
573N34.7Very low37.9Very low114 Ų114132.8 Ų132.861%0.6177%0.769SS**  cis-164.3160.8-37.9-138.8-9.9000108.9
574H39.1Very low37.6Very low155 Ų155136 Ų13672%0.71878%0.777SS**  trans70.4109.2162.7-66.1-59.9000121.7
575S39.5Very low36.9Very low95 Ų95135.1 Ų135.166%0.66478%0.779SS**  94.3105.4124.7-580000120.6
576E31.7Very low36.4Very low179 Ų179134.4 Ų134.484%0.83678%0.779SS**  trans32121.7132-64.2172.383.600119.7
577V37.4Very low35.6Very low141 Ų141137.3 Ų137.386%0.85578%0.781SS**  -167.6152.693.9149.90000110.7
578H33.6Very low35.4Very low162 Ų162137.6 Ų137.675%0.7578%0.783SS**  trans-58.1151.9-174.5-97155.4000117.7
579L36.5Very low35.3Very low134 Ų134135.3 Ų135.370%0.70277%0.774SS**  trans45.1136.3133.6-55.9164.1000118.2
580N33.1Very low35.2Very low147 Ų147140.6 Ų140.679%0.78678%0.776SS**  cis-174169.733.7-148.2-7.6000111.2
581A35.8Very low34.9Very low86 Ų86140 Ų14071%0.71177%0.774SS**  trans75.8159.5157.100000118.1
582P33.2Very low34.7Very low122 Ų122141.8 Ų141.879%0.79278%0.781SS**  trans-126.2152.2-131.440.4-27000116.3
583C29.7Very low34.3Very low130 Ų130141.6 Ų141.688%0.87878%0.783SS**  trans-124.2130.2174.4-67.40000112.8
584L29.5Very low34.2Very low176 Ų176143.6 Ų143.692%0.92179%0.792SS**PPolyproline II helixtrans-69.8147.9167.5-69.8159.2000110.2
585V33Very low33.6Very low148 Ų148143.5 Ų143.590%0.89780%0.796SS**PPolyproline II helixtrans-85.9127.6168178.50000108.4
586S31.9Very low33.2Very low113 Ų113145.1 Ų145.179%0.7981%0.808SS**PPolyproline II helixtrans-91.9147.1-176.6-169.40000112.1
587E35.1Very low33.2Very low187 Ų187142.3 Ų142.387%0.87481%0.808SS**PPolyproline II helixtrans-67.5159.4156.1-73.5171.777.100110.7
588D38.2Very low33Very low159 Ų159139 Ų13985%0.8580%0.802SS**PPolyproline II helixtrans-103.1157.9-178-156.2-70.7000112.1
589A38.6Very low33Very low63 Ų63138.1 Ų138.152%0.52180%0.803SS.*  trans76.993.2162.600000121.3
590R36.2Very low32.8Very low223 Ų223135.9 Ų135.984%0.84280%0.799SS**  81.995.3128.8-57.7163.3-163.7-179.94.6119.5
591N34.4Very low32.7Very low164 Ų164136.3 Ų136.388%0.87780%0.801SS**  -170.9144.494.8-93.7-8.3000112.8
592T28.3Very low32.7Very low127 Ų127139.3 Ų139.378%0.77980%0.804SS**  trans-94.1152.3-160.6-340000113.4
593L30.7Very low32.8Very low149 Ų149140.8 Ų140.878%0.7880%0.804SS**  175.1114.5120.6-89.6168.7000114.5
594L32Very low33.1Very low155 Ų155139.6 Ų139.681%0.81280%0.795SS**  trans69.5135.6144.1-62.2173.2000123.2
595L26.6Very low33.4Very low153 Ų153136.8 Ų136.880%0.80179%0.79SS**  trans-94.8159.7179.4-6273.9000111.8
596S31.9Very low33.4Very low130 Ų130138.2 Ų138.291%0.90979%0.787SS**  -158.8147.2125.1-116.80000112.5
597S31.1Very low33.3Very low119 Ų119140.4 Ų140.483%0.83279%0.789SS**  trans-89.4168.2-170.3-49.80000113.6
598G34Very low32.8Very low72 Ų72139 Ų13974%0.74279%0.787SS**  trans171.179.7168.100000116.7
599D33Very low32.5Very low144 Ų144136.4 Ų136.477%0.7778%0.781SS**  trans24119.3155.6-74.9-70.3000124.9
600S32.3Very low32Very low87 Ų87141.1 Ų141.161%0.60879%0.792SS**  41.4116.5107.1-400000120.2
601N32.1Very low31.6Very low156 Ų156138.2 Ų138.283%0.83479%0.793SS**  165.4159.3111.7-88.8-58.5000115.7
602L35.3Very low31.2Very low149 Ų149136.1 Ų136.178%0.7879%0.785SS**  trans82.192.4161.5-63.4170.1000122.3
603L34.5Very low31.2Very low152 Ų152136.8 Ų136.880%0.79679%0.789SS**  63.9160.4110.2-90.1163.8000121.2
604P36.5Very low31.1Very low105 Ų105132.9 Ų132.968%0.68278%0.784SS**  -120.1170.5-104.242.8-31.3000115.7
605S35.8Very low30.8Very low117 Ų117129 Ų12982%0.81878%0.782SS**  trans-154.8104.2163.4-80.20000114.9
606Q33.1Very low30.9Very low179 Ų179130.6 Ų130.684%0.83679%0.785SS**  trans51.2144139.4-63.3-145.1-15.900124.8
607L29.1Very low30.6Very low158 Ų158132.3 Ų132.383%0.82778%0.784SS**  trans79.376.7158.4-67.3169000120
608L26Very low30.4Very low157 Ų157131.5 Ų131.582%0.82279%0.785SS**  trans-153.6125135.7-160.467.5000112.8
609S30.9Very low30Very low105 Ų105136 Ų13673%0.73479%0.789SS**  trans-155.3107.4168.952.80000107.8
610H28.5Very low29.6Very low162 Ų162136.9 Ų136.975%0.7579%0.792SS**  75.6143.367.8-76.4-71.6000114.8
611L27Very low29.3Very low163 Ų163137.1 Ų137.185%0.85379%0.79SS**  trans92133.6177.5-57.2156.2000114.5
612V25.9Very low29.3Very low119 Ų119135.6 Ų135.672%0.72179%0.786SS**  cis142.6158.6-3.4150.40000105.9
613V29.7Very low29.1Very low142 Ų142136.4 Ų136.486%0.86179%0.786SS**  trans75.2138.6-171.6-164.80000111.4
614G27.6Very low28.8Very low66 Ų66137 Ų13768%0.6879%0.79SS**  cis126.1141.115.800000107.7
615G25.7Very low28.7Very low74 Ų74138 Ų13876%0.76379%0.794SS**  trans-77.9-171.5-158.800000117.3
616Q29.8Very low28.4Very low186 Ų186136.9 Ų136.987%0.86979%0.786SS**  trans94.8116.5176.4-5616934.700116.4
617N25.1Very low29Very low167 Ų167134.1 Ų134.189%0.89378%0.784SS**  trans31.1103.6144-54.3-15.2000118.4
618A26.1Very low29.2Very low101 Ų101134.5 Ų134.584%0.83579%0.787SS**  trans-126.6103.4164.900000111.1
619M25.7Very low29.8Very low168 Ų168130.2 Ų130.283%0.82878%0.78SS**  trans-65.7126.6161.7-76.4169.155.200109V621M619-V621 HydrophobicContact CB-CG2 4.22Å; M619-V621 HydrophobicContact CE-CG2 3.65Å; M619-V621 PolarHBondContact O-N 2.87Å
620L25.1Very low30.1Very low161 Ų161131.3 Ų131.384%0.84378%0.778SS**  trans-90.278.4171.5-147.4156.3000109.3T622L620-T622 HydrophobicContact CD2-CG2 4.34Å; L620-T622 PolarHBondContact O-N 3.49Å
621V26.8Very low30.7Very low92 Ų92131.2 Ų131.256%0.55878%0.776SS**  trans-77.4113.9169.4178.70000108.2M619 Q623M619-V621 HydrophobicContact CB-CG2 4.22Å; M619-V621 HydrophobicContact CE-CG2 3.65Å; M619-V621 PolarHBondContact O-N 2.87Å; V621-Q623 VanDerWaalsContact C-N 3.32Å; V621-Q623 HydrophobicContact CG1-CG 4.23Å; V621-Q623 PolarHBondContact O-N 2.52Å
622T30.4Very low31.1Very low125 Ų125130 Ų13077%0.76777%0.77SS**  trans-70.889.1166.946.50000109.4L620 N624L620-T622 HydrophobicContact CD2-CG2 4.34Å; L620-T622 PolarHBondContact O-N 3.49Å; T622-N624 PolarHBondContact O-N 3.31Å
623Q31.4Very low31.6Very low165 Ų165130.7 Ų130.777%0.77177%0.768SS**  trans-66.9114.2172.3-83.9-173.4-46.500110.5V621 V625V621-Q623 VanDerWaalsContact C-N 3.32Å; V621-Q623 HydrophobicContact CG1-CG 4.23Å; V621-Q623 PolarHBondContact O-N 2.52Å; Q623-V625 PolarHBondContact O-N 2.79Å
624N29.2Very low31.9Very low164 Ų164130.6 Ų130.688%0.87776%0.76SS**  trans-78.5101.7172-152.538.2000108.8T622 S626T622-N624 PolarHBondContact O-N 3.31Å; N624-S626 PolarHBondContact O-N 3.18Å
625V34.3Very low32.2Very low127 Ų127135 Ų13577%0.7776%0.763SS**  trans-81.4109.8179.3178.70000109.7Q623Q623-V625 PolarHBondContact O-N 2.79Å
626S28.1Very low32.7Very low93 Ų93136.1 Ų136.165%0.6576%0.759SS**  trans-97.3129.1173.5178.70000111N624N624-S626 PolarHBondContact O-N 3.18Å
627P46.8Very low33Very low121 Ų121133.3 Ų133.379%0.78675%0.754SS**  trans-96.2101.9158.832.7-24.5000109.9
628N33.1Very low33.5Very low166 Ų166131 Ų13189%0.88875%0.749SS**  trans-78130.8166.6-134.9-4.2000108.3
629G39.7Very low33.9Very low67 Ų67133.8 Ų133.869%0.69175%0.749SS**  trans-172.433-164.900000119.4
630D36.7Very low34.1Very low129 Ų129131 Ų13169%0.6975%0.746SS**  trans57.8130.5145.6-109.8-15.5000122.4
631K40.9Very low34.5Very low160 Ų160128.8 Ų128.870%0.69674%0.743SS**  trans80.6109146.6-65.9153.4-173.9144.70120.5
632N35.3Very low34.5Very low138 Ų138129.4 Ų129.474%0.73875%0.752SS**  109.1119.2119.9-83.1-17.2000120.5
633I36.4Very low34.3Very low133 Ų133128.9 Ų128.968%0.68275%0.752SS**  trans86.692.6134.7-63.3167.8000117.6
634M36Very low34.4Very low140 Ų140127.5 Ų127.569%0.6975%0.754SS**  75.3115.3126.6-64.5-178.975.900122.1
635H34.7Very low34.3Very low159 Ų159126 Ų12674%0.73675%0.751SS**  87.5143.5123.3-79-138.3000121.6
636S35.3Very low34.2Very low97 Ų97125.2 Ų125.268%0.67875%0.752SS**  trans80.994.6154.390000120.2
637T36.3Very low34.3Very low127 Ų127126.4 Ų126.478%0.77976%0.76SS**  56.8133.4121.652.40000122
638P35.7Very low33.5Very low119 Ų119124.3 Ų124.377%0.77376%0.76SS**  trans-90.7142175.936.5-33000113.2
639L34.4Very low33.7Very low159 Ų159125.1 Ų125.183%0.83276%0.764SS**  trans-156.1124.1165-101.9126.7000113.9
640S30.1Very low33.3Very low110 Ų110126.8 Ų126.877%0.76977%0.765SS**  trans10.9117.3140.3-46.20000121.3
641S33.4Very low33.2Very low113 Ų113126 Ų12679%0.7977%0.765SS**  trans-175.7124141.2380000108.2
642S27.2Very low33.1Very low105 Ų105126.4 Ų126.473%0.73477%0.773SS**  71.2123.653.4-175.20000113.9
643C24.8Very low33.1Very low115 Ų115128.3 Ų128.378%0.77777%0.774SS**  trans57.4148.1171.467.60000116.3
644V33.4Very low33Very low135 Ų135126.3 Ų126.382%0.81877%0.772SS**  cis-152.3165.241.9-77.30000113.6
645T27.2Very low33Very low132 Ų132124 Ų12481%0.8178%0.775SS**  trans-83.3140.7174.550.70000114.2
646S33.2Very low33.1Very low112 Ų112124.5 Ų124.578%0.78378%0.783SS**  trans-159.6126.2147.348.70000108.3
647S30Very low32.8Very low118 Ų118127 Ų12783%0.82579%0.789SS**  cis78.599.941.8-59.30000114.1
648G30.6Very low32.7Very low76 Ų76125.5 Ų125.578%0.78478%0.783SS**  trans97.9114.3151.500000116.9
649L35.6Very low32.6Very low184 Ų184127.5 Ų127.596%0.96379%0.786SS**  -161.2128.9109.1-102167.3000110.2
650S32.2Very low32.6Very low102 Ų102125.3 Ų125.371%0.71378%0.783SS**  trans-108.3170.5-177.957.80000111.5
651T34.6Very low33Very low112 Ų112127.1 Ų127.169%0.68778%0.784SS**  trans86.893.9153.5-450000118.8
652I39.7Very low33.3Very low168 Ų168126.9 Ų126.986%0.86278%0.78SS**  -156.5103.1126.1-36.5179.5000105
653K33.6Very low34.5Very low178 Ų178128.3 Ų128.377%0.77479%0.787SS**  63.5127.661.8-158169.9177.766.90111.9
654S35.3Very low34.7Very low92 Ų92127.6 Ų127.664%0.64378%0.783SS**  cis-160.5162.88.2-128.10000110.4
655A36.2Very low34.8Very low91 Ų91128.7 Ų128.775%0.75278%0.783SS**  trans69.6143.6159.300000118.2
656L36.2Very low35.2Very low169 Ų169127 Ų12789%0.88578%0.777SS**  cis-119.1142.41.1-81.492.3000112.5
657D29.1Very low35.4Very low151 Ų151126.9 Ų126.981%0.80777%0.774SS**  trans-101134.5156.9174.9-85000107.7
658S33.1Very low35.8Very low94 Ų94129.6 Ų129.666%0.65777%0.773SS**  trans177.6129158-88.40000112.9
659L34.2Very low35.9Very low162 Ų162130.2 Ų130.285%0.84877%0.765SS**  trans68.6102.4158.9-51.6170.2000115.3
660C35.1Very low36Very low112 Ų112129.5 Ų129.576%0.75776%0.757SS**  62.6130.653.8-65.30000116.3
661D37.5Very low36.4Very low148 Ų148132.1 Ų132.179%0.79176%0.762SS**  trans76.2135.2161.8-70-68.5000122
662P39.9Very low37.3Very low109 Ų109132.4 Ų132.471%0.70877%0.765SS**  trans-90.6145.9176.836.8-33.5000111.9
663P51.9Low37.6Very low135 Ų135129.5 Ų129.588%0.87776%0.758SS**  trans-80.6126.6176.631.2-32.4000111.8
664S30.6Very low37.9Very low99 Ų99125.5 Ų125.569%0.69276%0.758SS**  trans-126.9159.715873.40000108.7
665L33.9Very low38.4Very low158 Ų158127.1 Ų127.183%0.82777%0.766SS**  trans69.9143.1-179.7-49.4173.2000113.4
666S35.7Very low38.7Very low98 Ų98128.8 Ų128.869%0.68577%0.767SS**  cis-158.8158.3-9.9-91.90000108.3
667P38.7Very low38.9Very low109 Ų109129.8 Ų129.871%0.70877%0.767SS**  trans-81.6138.816933.5-31.6000110.7
668H37.9Very low39.3Very low174 Ų174127.3 Ų127.381%0.80676%0.761SS**  trans-179.8120.4140.5-99.7-59.4000113.7
669S32.6Very low39.7Very low90 Ų90130.3 Ų130.363%0.62977%0.769SS**  trans61.9163.5154.746.70000117.2
670H37.6Very low40.1Very low168 Ų168130 Ų13078%0.77876%0.763SS**  cis-144.3156.623.3-46.7-100.9000111.7
671L40.5Very low40.2Very low157 Ų157130.4 Ų130.482%0.82276%0.758SS**  trans-72.9163.5177.4-121.280.8000113.3
672P53.1Low40.3Very low118 Ų118129.5 Ų129.577%0.76675%0.752SS**  -128.5162.1125.837.1-30000113.7
673P46.1Very low40.5Very low107 Ų107132.1 Ų132.170%0.69575%0.754SS**  trans-119.8165.6-16341.3-30.3000116.9
674A40.2Very low39.9Very low94 Ų94131 Ų13178%0.77775%0.747SS**  trans70.5159.1151.800000117.5
675P45.8Very low40.6Very low126 Ų126134 Ų13482%0.81875%0.754SS**  cis-130.2-166.620.841.5-22.2000117.6
676V42.1Very low40.9Very low127 Ų127131.9 Ų131.977%0.7775%0.749SS**  trans-93.8158.5-156.5-69.30000115.6
677E41.2Very low41Very low189 Ų189138.9 Ų138.988%0.88376%0.76SS**  trans-175.3105.7135.9-101.8176.2160.600107.8
678S38.2Very low40.9Very low99 Ų99138.8 Ų138.869%0.69276%0.762SS**  7693.670.8-70.40000115.6
679L40.8Very low40.9Very low157 Ų157139.1 Ų139.182%0.82277%0.766SS**  trans-171.6115.7136.4-102.4147000113.3
680H42.8Very low41.2Very low156 Ų156139.2 Ų139.272%0.72277%0.772SS**  trans16145.7135.6-52.695.9000119.7
681N36.6Very low41.3Very low121 Ų121140.1 Ų140.165%0.64778%0.776SS**  cis-167.4142.918.3-1242.6000113.3
682I41.1Very low41.1Very low129 Ų129143.7 Ų143.766%0.66278%0.779SS**  53.2110.5129.7-62.8174.3000121
683H42.2Very low40.3Very low163 Ų163142 Ų14276%0.75577%0.77SS**  152126.2104.5-129.1106.6000113.4
684P39.9Very low40Very low112 Ų112142.5 Ų142.573%0.72777%0.771SS**  trans-109.2149.6170.737.6-29.6000113.5
685I45.1Very low39.9Very low163 Ų163142.8 Ų142.884%0.83677%0.767SS**  trans-141.8122169.8-57.3179.7000110.7
686P39.8Very low39.5Very low112 Ų112143.1 Ų143.173%0.72776%0.762SS**  trans-117.7139.5167.236.7-26.4000113.5
687R38.8Very low39.1Very low246 Ų246142.5 Ų142.593%0.92876%0.759SS**  trans-177122.6158.6-101.6153.9-178.5156.41.8106.8
688S35.8Very low38.7Very low106 Ų106140.7 Ų140.774%0.74175%0.754SS**  100.8149.855.6-1720000111.4
689M39.7Very low38.4Very low182 Ų182141.5 Ų141.590%0.89776%0.758SS**  trans77.8112.2-170.9-49.8-169-170.900114.3
690A37.8Very low38.1Very low91 Ų91138 Ų13875%0.75275%0.752SS**  cis107.695.620.300000114.5
691H40.9Very low37.7Very low187 Ų187134.9 Ų134.987%0.86675%0.753SS**  trans-141.3111.9150.8-74.9-90.7000105.2
692R34.8Very low37.7Very low233 Ų233136.8 Ų136.888%0.87976%0.764SS**  53.9118.485.4-138.9175.3-161.8-106.34.7110.3
693S37Very low37.5Very low82 Ų82139.9 Ų139.957%0.57378%0.775SS**  cis-160.8152.341.3-1560000113
694T39.3Very low37.1Very low118 Ų118137.9 Ų137.972%0.72477%0.774SS**  trans25.2130.9139.958.80000118.4
695S38.4Very low36.8Very low99 Ų99139.4 Ų139.469%0.69278%0.775SS**  cis179.8171.316.1-106.90000107.9
696D36.6Very low36.4Very low134 Ų134137.1 Ų137.172%0.71777%0.771SS**  cis-145.6-147.11.5-142.6-79.7000112.4
697T33.7Very low35.9Very low113 Ų113136.4 Ų136.469%0.69377%0.769SS**  trans-130.1177.7-169.6-47.50000111.9
698I33.8Very low35.6Very low151 Ų151129.3 Ų129.377%0.77476%0.763SS**  trans83.7130.8164.5-48.5166.8000112.7
699C32.1Very low35.6Very low116 Ų116129.2 Ų129.278%0.78476%0.762SS**  cis-148167.819.4-144.10000115.2
700A34.9Very low35.4Very low84 Ų84126.5 Ų126.569%0.69476%0.756SS**  trans19.1116.8151.200000119.8
701A34Very low35.2Very low91 Ų91130 Ų13075%0.75276%0.761SS**  65.7106.870.600000115
702N36.3Very low35Very low161 Ų161128.8 Ų128.886%0.86176%0.759SS**  trans-149.871.4152-106.7-33.5000110.7
703H36Very low34.9Very low193 Ų193120.1 Ų120.189%0.89474%0.743SS**  trans-88.5113.7155.8-99.4-84.1000107.8
704V34.9Very low35Very low121 Ų121125.2 Ų125.273%0.73376%0.757SS**  trans-138.2104.8166.2-178.70000110.3
705L33.6Very low34.7Very low145 Ų145125.8 Ų125.876%0.75976%0.755SS**  trans-76.4151.2155-79.5158.1000108.8
706P36.6Very low34.7Very low114 Ų114131.7 Ų131.774%0.7476%0.762SS**  -142.6156.193.220.61.7000112.7
707S29.9Very low34.6Very low98 Ų98131.5 Ų131.569%0.68576%0.761SS**  cis65.5119.917.5-85.10000118.7
708A32Very low34.6Very low97 Ų97132.6 Ų132.680%0.80276%0.761SS**  trans65.3146.6169.700000116
709S34.8Very low34.5Very low104 Ų104130.6 Ų130.673%0.72776%0.755SS**  cis-155.8168.2-15.3-82.10000105.4
710T36.8Very low34.6Very low125 Ų125131.5 Ų131.577%0.76775%0.753SS**  178.612667.2-72.80000108.2
711L32.1Very low34.9Very low163 Ų163131.3 Ų131.385%0.85375%0.746SS**  trans-68175.9163.6-120.4160.2000110
712I37.1Very low34.8Very low162 Ų162133.8 Ų133.883%0.83175%0.745SS**  trans87128.7-179.5-47.9149000112.6
713G32.2Very low34.6Very low52 Ų52129 Ų12954%0.53673%0.734SS.*  cis147.6101.6-200000112.3
714H39.6Very low34.4Very low188 Ų188128.3 Ų128.387%0.8773%0.731SS**  trans-157.6106.7164.9-74-72.5000104.3
715D33.5Very low34.2Very low130 Ų130126.8 Ų126.870%0.69573%0.726SS**  cis54.672.827.3-141.5-40.3000113.8
716R39Very low34.1Very low223 Ų223125 Ų12584%0.84273%0.726SS**  -156.2125.3120.5-97159-179.4-130.4-6.1106.5
717L33Very low33.9Very low130 Ų130124.7 Ų124.768%0.68173%0.726SS**  55.2129.177.5-59175.4000109.7
718I33.8Very low33.9Very low136 Ų136125.9 Ų125.970%0.69773%0.73SS**  cis-163.5143.130.2-129.6155.4000106.6
719V33.2Very low33.9Very low109 Ų109126.8 Ų126.866%0.66173%0.725SS**  48.5105.8107.9174.30000111.4
720D33.9Very low33.6Very low136 Ų136127.8 Ų127.873%0.72773%0.726SS**  -177.8167.775.4-110.6-45000107.5
721S39.8Very low33.4Very low79 Ų79128.6 Ų128.655%0.55273%0.725SS**  cis-154.5147.4-5.4-128.20000106.2
722I32.2Very low33.4Very low143 Ų143126.3 Ų126.373%0.73372%0.719SS**  40.5115.499.9-46.3175000111.9
723G32.4Very low33.2Very low61 Ų61123.2 Ų123.263%0.62971%0.711SS**  cis143.8-17311.700000108.4
724Q31.6Very low33.3Very low179 Ų179125.3 Ų125.384%0.83672%0.717SS**  trans66.7154.3169.9-56.3178.563.300114.2
725S32.3Very low33.3Very low88 Ų88123.9 Ų123.962%0.61571%0.711SS**  cis-166.9143.7-1845.30000108.5
726S31.1Very low33.4Very low109 Ų109124 Ų12476%0.76271%0.712SS**  trans58160131.6-53.70000122
727S32.8Very low33.3Very low106 Ų106121.9 Ų121.974%0.74172%0.716SS**  trans79.6112.3164.6-52.30000115
728T29.4Very low33.5Very low124 Ų124119.1 Ų119.176%0.76171%0.712SS**  72.9106.463.8-60.30000111.6
729T30.9Very low33.6Very low115 Ų115120.6 Ų120.671%0.70672%0.721SS**  trans68.6112.9147.2-53.50000118.5
730V29.9Very low33.7Very low125 Ų125120.1 Ų120.176%0.75872%0.719SS**  trans59.1155.8156.8-62.20000121.6
731L32.9Very low33.7Very low142 Ų142122 Ų12274%0.74373%0.728SS**  trans94.499.2158.9-53.5-176.5000119.5
732T31.3Very low33.5Very low116 Ų116123.9 Ų123.971%0.71274%0.735SS**  66.9139.9123.164.50000122.8
733S32.4Very low33.5Very low97 Ų97123.8 Ų123.868%0.67874%0.736SS**  trans74.9114.6158.7-58.10000115.8
734S34.3Very low33.7Very low95 Ų95129.1 Ų129.166%0.66474%0.744SS**  65.9130.874.6-56.30000111.1
735H39.7Very low33.8Very low158 Ų158126 Ų12673%0.73174%0.742SS**  cis-15414844.8-70.7-92.5000114.9
736N35.9Very low34.1Very low133 Ų133130.3 Ų130.371%0.71175%0.749SS**  trans36.6126.5137.7-60.5-30.1000122.4
737L37.6Very low34.1Very low178 Ų178133.3 Ų133.393%0.93275%0.751SS**  -162.375.8116.8-97.6168.6000106.4
738A36.2Very low34.4Very low72 Ų72135.2 Ų135.260%0.59575%0.749SS**  73.282.280.600000113.6
739D36.9Very low34.7Very low168 Ų168136 Ų13690%0.89875%0.748SS**  trans-136.9130.5134.7-142.4-27.2000107.6
740T34.4Very low35.2Very low99 Ų99138.9 Ų138.961%0.60776%0.758SS**  trans-145.5114.9-160.4-61.50000111.7V742T740-V742 HydrophobicContact CG2-CG2 4.21Å
741L34.6Very low35.5Very low176 Ų176137.7 Ų137.792%0.92176%0.756SS**  trans-135.1117.8151.1-73179000109
742V34Very low35.9Very low117 Ų117137.3 Ų137.371%0.70977%0.765SS**  trans-132.5167.5-178.9179.70000107T740T740-V742 HydrophobicContact CG2-CG2 4.21Å
743L33.8Very low36.1Very low142 Ų142135.3 Ų135.374%0.74377%0.768SS**  trans87.9140.2174.3-48.1172.1000113.7
744H35.8Very low36.4Very low173 Ų173138.4 Ų138.480%0.80178%0.776SS**  cis-135.2152.517-111.1147.6000114.1
745S33.4Very low36.6Very low112 Ų112141 Ų14178%0.78378%0.78SS**  trans-74.6157.3171.2-46.30000112.9
746K38.4Very low37Very low179 Ų179140.6 Ų140.678%0.77878%0.782SS**  trans-144127.8145.1-139.7-175.5-175-132.10110.6E748K746-E748 IonicContact NZ-OE2 2.7Å; K746-E748 PolarHBondContact NZ-OE2 2.83Å
747Q30.9Very low37Very low172 Ų172141.1 Ų141.180%0.80479%0.785SS**  trans-122113.7-179.6164.4-166.6-34.700107.3
748E39.8Very low37.3Very low146 Ų146137.1 Ų137.168%0.68278%0.777SS**  trans-149.395.7164.3-60.3-177.8112.400104.8K746K746-E748 IonicContact NZ-OE2 2.7Å; K746-E748 PolarHBondContact NZ-OE2 2.83Å
749D36.1Very low37.5Very low142 Ų142139.2 Ų139.276%0.75978%0.783SS**  66.9117.1102.1-103.1-56.1000115.3
750L41Very low37.6Very low174 Ų174138.9 Ų138.991%0.91178%0.781SS**  trans-172116.8137.6-102.7166.4000111.7
751S35.2Very low38Very low101 Ų101145.5 Ų145.571%0.70681%0.812SS**  trans-75.1140.3-17450.70000116.1
752S41.5Very low38.1Very low133 Ų133144 Ų14493%0.9381%0.807SS**  trans-178.1135.3144.6-78.60000109.1
753G36.1Very low38.4Very low75 Ų75145.4 Ų145.477%0.77381%0.812SS**  cis146.464.22.200000112.4
754L38.3Very low38.6Very low162 Ų162145.6 Ų145.685%0.84882%0.815SS**  trans-150.5113.2165.4-151.773.3000112.1
755I38.1Very low38.8Very low148 Ų148143.9 Ų143.976%0.75982%0.816SS**  trans-108.2126.6174.5-62172.4000107.6
756I48Very low39.1Very low151 Ų151145.9 Ų145.977%0.77482%0.818SS**  trans-132.7106.6158.6-61.5178.6000107.9
757N37.8Very low39.2Very low143 Ų143143.7 Ų143.777%0.76582%0.821SS**  trans-76.7136.3169.1-87.7-19.3000110.1
758A42Very low39.7Very low94 Ų94141.7 Ų141.778%0.77782%0.822SS**  trans-151.667160.400000111.4
759T40.9Very low39.7Very low116 Ų116141.4 Ų141.471%0.71283%0.833SS**  trans7.9119.8143.7-49.80000119.3
760L38.9Very low40Very low162 Ų162141.3 Ų141.385%0.84884%0.839SS**  trans42.4111.5144.2-59.1166.2000119.5
761N42.6Very low39.9Very low237 Ų237138.4 Ų138.4100%1.26783%0.833SS**  -151.50106-149.536.6000110.6

Retrieved 761 of 761 residues in 586.2 ms (Link to these results)