A0A087WSW0_HUMAN Loading...

Helt bHLH transcription factor

AlphaFold DB , UniProt , Accession A0A087WSW0, Species HUMAN (Homo sapiens, Human), Gene HELT, Length 327 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M38.1Very low41.7Very low242 Ų242163.9 Ų163.9100%1.19282%0.818SS**  0112.60-73-167.2-9100108
2S38.8Very low41.6Very low121 Ų121168.5 Ų168.585%0.84682%0.819SS**  trans62.682.1158.9-520000120.1
3D41.7Very low40.9Very low165 Ų165169.5 Ų169.588%0.88283%0.829SS**  trans-72.6135.1140-86.6-71.7000110.5
4K50.1Low40.3Very low200 Ų200165.2 Ų165.287%0.8783%0.825SS**  trans-135.384.5166.3-93.8-81-178.61720110.7
5L48.2Very low41.3Very low141 Ų141160.9 Ų160.974%0.73881%0.813SS**  trans-5.5127.4135.1-161.471.3000116.8E7L5-E7 HydrophobicContact CD1-CG 3.85Å; L5-E7 HydrophobicContact CD2-CG 4.4Å; L5-E7 HydrophobicContact CG-CG 4.14Å
6K50.4Low40.7Very low210 Ų210161.4 Ų161.491%0.91382%0.819SS**  trans-139.7108.7135.7-165.3158-178.3175.80110.9
7E42.6Very low40Very low104 Ų104155.8 Ų155.849%0.48681%0.811SS.*  trans-69.5156.9178.1-86.4-148.4103.700115L5L5-E7 HydrophobicContact CD1-CG 3.85Å; L5-E7 HydrophobicContact CD2-CG 4.4Å; L5-E7 HydrophobicContact CG-CG 4.14Å
8R39.8Very low39.6Very low206 Ų206155 Ų15578%0.77781%0.814SS**  trans71.9138.8139-76167.2176.8-179.9-37.4117.9
9K36Very low39Very low183 Ų183153.4 Ų153.480%0.79682%0.816SS**  cis-15712246.9-161.5165-178.8-173.70112
10V37.4Very low38.7Very low123 Ų123150.7 Ų150.775%0.74582%0.816SS**  trans-81.2127159.8167.20000107.2R12V10-R12 HydrophobicContact CG1-CG 4Å
11S35.7Very low38.3Very low108 Ų108151 Ų15176%0.75582%0.816SS**  trans-113103.5158.9-67.40000107.6
12R40.5Very low38.1Very low219 Ų219146.2 Ų146.283%0.82680%0.8SS**  trans-75.9145.4157.2-64-173-171.1-107.44.7107.7V10V10-R12 HydrophobicContact CG1-CG 4Å
13L32.3Very low37.8Very low181 Ų181145.7 Ų145.795%0.94879%0.792SS**  -176.2150.9126.3-92.3165.1000109.3
14S33.2Very low37.2Very low110 Ų110146.5 Ų146.577%0.76979%0.79SS**  trans-109.4-151.3-157.8-166.50000111.1
15P54.3Low36.3Very low101 Ų101140.8 Ų140.866%0.65678%0.78SS**  -117.7-178.3-115.839.1-19.6000114.9
16N31.4Very low35.7Very low168 Ų168139.7 Ų139.790%0.89878%0.784SS**  trans91.2140.3163.7-64-27.3000120.7
17G30Very low34.6Very low67 Ų67137.3 Ų137.369%0.69178%0.782SS**  trans139.175.9169.800000112
18T31.4Very low34.1Very low141 Ų141137.1 Ų137.187%0.86579%0.792SS**  65.2129.991.6-33.60000115.3
19C29.8Very low34.6Very low125 Ų125132.8 Ų132.885%0.84579%0.79SS**  trans-45.6146.9-178.2-47.40000116.9
20A31.8Very low34.5Very low99 Ų99129.3 Ų129.382%0.81878%0.784SS**  trans-158.2122.8142.600000111.4
21L31.6Very low34.4Very low157 Ų157133 Ų13382%0.82279%0.785SS**  trans-79.8129.1169.3175.5131.5000108.3V23L21-V23 HydrophobicContact CD2-CG2 4.32Å
22V33.8Very low34.4Very low141 Ų141134.9 Ų134.986%0.85578%0.781SS**  trans-137.3121.1160.2-1800000108.8
23V31.1Very low34.4Very low110 Ų110132.3 Ų132.367%0.66778%0.783SS**  trans-90.5164.2171168.20000108L21L21-V23 HydrophobicContact CD2-CG2 4.32Å
24E29.2Very low34.4Very low183 Ų183127.5 Ų127.586%0.85578%0.777SS**  trans88.7146.3174.9-72.3-164.286.400116.7
25A31.5Very low34.5Very low79 Ų79126 Ų12665%0.65378%0.779SS**  cis-170.6156.2-17.500000105.6
26S34.8Very low34.5Very low118 Ų118127.2 Ų127.283%0.82579%0.787SS**  trans-48.7144173.2-54.30000114
27D29.1Very low34.9Very low161 Ų161128 Ų12886%0.86179%0.787SS**  -176148.6108.2-136.1-7000112.4
28S32.2Very low35.3Very low100 Ų100129.5 Ų129.570%0.69979%0.793SS**  trans-108.7169.9160.8-74.60000106.6
29P50.4Low35.6Very low115 Ų115126.5 Ų126.575%0.74779%0.791SS**  cis-153.8-173.336.834-7.5000116.1
30T32.8Very low36Very low109 Ų109130.1 Ų130.167%0.66979%0.792SS**  trans139.997.6131.1-51.50000116.9
31R36Very low35.8Very low202 Ų202131 Ų13176%0.76279%0.791SS**  60.1141.2126.9-48.2176.9-178.7-119.8-2.4126.2
32H35.3Very low36.7Very low146 Ų146128.3 Ų128.368%0.67678%0.782SS**  trans79.8139.3143.8-67.7-42.8000118.5
33L39.4Very low36.8Very low166 Ų166130.6 Ų130.687%0.86978%0.784SS**  cis-169.6152.38-100.1159.6000109.6
34G33.7Very low37Very low80 Ų80129.2 Ų129.283%0.82579%0.791SS**  trans132.9102.8152.600000118.8
35G34.2Very low37.4Very low77 Ų77126.8 Ų126.879%0.79479%0.789SS**  trans-95.5-144.7172.200000113.8
36P55Low37.8Very low127 Ų127130.2 Ų130.283%0.82580%0.796SS**  cis-134.5173.4-38.539.2-22.7000113.5
37M40.2Very low37.7Very low185 Ų185129.8 Ų129.891%0.91179%0.792SS**  trans-173.697.4146.2-94.5-95.3-109.900107.8
38A38.1Very low38.4Very low98 Ų98128.9 Ų128.981%0.8179%0.792SS**  80.892.891.500000114.3
39G38.2Very low38.6Very low79 Ų79131.9 Ų131.981%0.81480%0.796SS**  trans-158.9109.5162.300000109.5
40K37Very low38.4Very low201 Ų201135.4 Ų135.487%0.87480%0.802SS**  trans-70.2123.4-170.8-67.4166.6171.4-169.20111.7
41C28.3Very low38.4Very low117 Ų117133.8 Ų133.879%0.79180%0.795SS**  65.7153.598.8-62.30000117
42P51.4Low39Very low100 Ų100135.7 Ų135.765%0.64980%0.802SS**  cis-142.1178.3-26.631.9-9.1000115.2
43H35.7Very low39.3Very low190 Ų190133.9 Ų133.988%0.8880%0.801SS**  trans130.5119.1145-69.4-64.4000115.3
44G34Very low40.2Very low80 Ų80137.2 Ų137.283%0.82580%0.802SS**  trans132.778.5156.600000115.5
45T38Very low41.1Very low132 Ų132138.6 Ų138.681%0.8180%0.795SS**  trans-56.5139.5162.5-34.50000110.6
46L39.3Very low42.5Very low152 Ų152140.6 Ų140.680%0.79679%0.794SS**  169.3117.9123.5-87.7163.8000112.5
47S33.6Very low43Very low108 Ų108137.6 Ų137.676%0.75577%0.773SS**  trans44.2127.3140-61.10000122.7
48V43.6Very low45.1Very low142 Ų142131.9 Ų131.986%0.86175%0.752SS**  trans-31.3125.5149175.60000113
49E35.9Very low47.7Very low164 Ų164134.5 Ų134.577%0.76675%0.747SS**  trans-149.8108.9148.3-123.8-87.710300106.7S51E49-S51 PolarHBondContact O-N 3.33Å
50E45.9Very low50.2Low189 Ų189138.7 Ų138.788%0.88374%0.743SS**  trans-6973.3170.5-174.2171.4154.200108.6
51S32.8Very low52.8Low75 Ų75131.9 Ų131.952%0.52472%0.718SS.*  trans-88.9118.7163.5-167.10000106.7E49 V53E49-S51 PolarHBondContact O-N 3.33Å; S51-V53 WeakPolarHBondContact O-CG2 3.45Å; S51-V53 PolarHBondContact O-N 3.39Å
52R48.6Very low55.9Low241 Ų241131 Ų13191%0.90970%0.704SS**  trans-6278.5167.6-165.1177.6-164.11726.3107.7R54R52-R54 VanDerWaalsContact C-N 3.32Å; R52-R54 PolarHBondContact O-N 2.93Å
53V42.7Very low58Low108 Ų108128.2 Ų128.266%0.65568%0.682SS**  trans-62.699.2177.7179.90000105.3S51 T55S51-V53 WeakPolarHBondContact O-CG2 3.45Å; S51-V53 PolarHBondContact O-N 3.39Å; V53-T55 PolarHBondContact O-N 3.32Å
54R57.6Low60.9Low236 Ų236125.1 Ų125.189%0.89167%0.666SS**  trans-56.896.8160-81.8180175.8176.40.5105.1R52 P56R52-R54 VanDerWaalsContact C-N 3.32Å; R52-R54 PolarHBondContact O-N 2.93Å; R54-P56 VanDerWaalsContact O-N 3.16Å
55T52.4Low63.9Low110 Ų110128.8 Ų128.868%0.67566%0.655SS**  trans-48.3125.2172.848.80000107.1V53 V57V53-T55 PolarHBondContact O-N 3.32Å; T55-V57 PolarHBondContact O-N 2.88Å
56P64.3Low66.7Low119 Ų119128.2 Ų128.277%0.77364%0.638SS**  trans-57.7114.4-177.422.5-31.4000107.3R54 S58R54-P56 VanDerWaalsContact O-N 3.16Å; P56-S58 PolarHBondContact O-N 2.84Å
57V66.1Low69.5Low63 Ų63127.1 Ų127.138%0.38262%0.624SS.*  trans-56115.7178176.60000106T55 H59 V61 I62T55-V57 PolarHBondContact O-N 2.88Å; V57-H59 PolarHBondContact O-N 3.36Å; V57-V61 HydrophobicContact CG1-CB 3.61Å; V57-V61 HydrophobicContact CG1-CG1 3.44Å; V57-V61 VanDerWaalsContact CG1-CG1 3.44Å; V57-I62 HydrophobicContact CB-CD1 4.41Å; V57-I62 HydrophobicContact CB-CG1 4.11Å; V57-I62 HydrophobicContact CG1-CG1 3.74Å; V57-I62 WeakPolarHBondContact O-CD1 3.5Å
58S84.3Confident72.5Confident66 Ų66125.1 Ų125.146%0.46260%0.604SS.*  trans-49.7137.6-174.8176.90000110P56 K60 V61 I62P56-S58 PolarHBondContact O-N 2.84Å; S58-K60 PolarHBondContact O-N 3.05Å; S58-V61 WeakPolarHBondContact O-CA 3.48Å; S58-V61 WeakPolarHBondContact O-CB 3.36Å; S58-V61 PolarHBondContact O-N 3.25Å; S58-I62 PolarHBondContact O-N 2.73Å; S58-I62 VanDerWaalsContact O-N 3.15Å
59H91.3Very high75Confident153 Ų153125.2 Ų125.271%0.70859%0.589SS**Hα-helixtrans-46.3-36.7177.6-178-93.6000112.2V57 V61 I62 E63V57-H59 PolarHBondContact O-N 3.36Å; H59-V61 VanDerWaalsContact C-N 3.34Å; H59-V61 PolarHBondContact O-N 2.89Å; H59-I62 PolarHBondContact O-N 3.35Å; H59-E63 WeakPolarHBondContact O-CB 3.47Å; H59-E63 PolarHBondContact O-N 3.4Å
60K91.4Very high77.9Confident167 Ų167120.4 Ų120.473%0.72657%0.568SS**Hα-helixtrans-60.6-37.6174.6-68.5-176.2177.6179.70113.6S58 K64S58-K60 PolarHBondContact O-N 3.05Å; K60-K64 WeakPolarHBondContact O-CB 3.42Å; K60-K64 PolarHBondContact O-N 3.16Å
61V92.6Very high80.2Confident58 Ų58115.2 Ų115.235%0.35255%0.546SS..Hα-helixtrans-74.8-40.5178.7176.70000111V57 S58 H59 E63 K64 R65V57-V61 HydrophobicContact CG1-CB 3.61Å; V57-V61 HydrophobicContact CG1-CG1 3.44Å; V57-V61 VanDerWaalsContact CG1-CG1 3.44Å; S58-V61 WeakPolarHBondContact O-CA 3.48Å; S58-V61 WeakPolarHBondContact O-CB 3.36Å; S58-V61 PolarHBondContact O-N 3.25Å; H59-V61 VanDerWaalsContact C-N 3.34Å; H59-V61 PolarHBondContact O-N 2.89Å; V61-E63 VanDerWaalsContact C-N 3.33Å; V61-K64 PolarHBondContact O-N 3.07Å; V61-R65 VanDerWaalsContact O-CG 3.31Å; V61-R65 WeakPolarHBondContact O-CG 3.48Å; V61-R65 PolarHBondContact O-N 3.16Å
62I92.4Very high83.2Confident97 Ų97118.7 Ų118.750%0.49755%0.548SS..Hα-helixtrans-61.3-45.8174.1-59.4178000109.8V57 S58 H59 K64 R65 R66V57-I62 HydrophobicContact CB-CD1 4.41Å; V57-I62 HydrophobicContact CB-CG1 4.11Å; V57-I62 HydrophobicContact CG1-CG1 3.74Å; V57-I62 WeakPolarHBondContact O-CD1 3.5Å; S58-I62 PolarHBondContact O-N 2.73Å; S58-I62 VanDerWaalsContact O-N 3.15Å; H59-I62 PolarHBondContact O-N 3.35Å; I62-K64 PolarHBondContact O-N 2.88Å; I62-R65 PolarHBondContact O-N 2.88Å; I62-R66 PolarHBondContact O-N 3.43Å
63E96.4Very high85.5Confident42 Ų42110.9 Ų110.920%0.19653%0.529CS..Hα-helixtrans-67.4-37.5179.3-177.552.6-151.800112.8H59 V61 R66 R67H59-E63 WeakPolarHBondContact O-CB 3.47Å; H59-E63 PolarHBondContact O-N 3.4Å; V61-E63 VanDerWaalsContact C-N 3.33Å; E63-R66 VanDerWaalsContact CD-NH1 3.35Å; E63-R66 PolarHBondContact O-N 3.24Å; E63-R66 IonicContact OE1-CZ 3.23Å; E63-R66 VanDerWaalsContact OE1-CZ 3.23Å; E63-R66 IonicContact OE1-NE 3.6Å; E63-R66 IonicContact OE1-NH1 3.4Å; E63-R66 PolarHBondContact OE1-NH1 2.81Å; E63-R66 IonicContact OE1-NH2 3.49Å; E63-R66 PolarHBondContact OE1-NH2 3.22Å; E63-R66 IonicContact OE2-CZ 3.18Å; E63-R66 IonicContact OE2-NE 3.51Å; E63-R66 IonicContact OE2-NH1 2.63Å; E63-R66 PolarHBondContact OE2-NH1 3Å; E63-R67 WeakPolarHBondContact O-CG 3.3Å; E63-R67 PolarHBondContact O-N 3.38Å; E63-R67 PolarHBondContact O-NE 3.38Å; E63-R67 IonicContact OE1-NE 3.91Å
64K95.8Very high87.8Confident126 Ų126106.5 Ų106.555%0.54850%0.502SS..Hα-helixtrans-59.8-49.2172.1-174.8177.9177.8-178.60110.7K60 V61 I62 R66 R67 D68K60-K64 WeakPolarHBondContact O-CB 3.42Å; K60-K64 PolarHBondContact O-N 3.16Å; V61-K64 PolarHBondContact O-N 3.07Å; I62-K64 PolarHBondContact O-N 2.88Å; K64-R66 VanDerWaalsContact C-N 3.31Å; K64-R66 PolarHBondContact O-N 2.71Å; K64-R67 PolarHBondContact O-N 3.32Å; K64-D68 PolarHBondContact O-N 3.08Å
65R96.6Very high89.3Confident156 Ų156100.1 Ų100.159%0.58949%0.486SS*.Hα-helixtrans-61.3-37.2177.9-70.7174.6-177.3-177.41.8112.7V61 I62 R69V61-R65 VanDerWaalsContact O-CG 3.31Å; V61-R65 WeakPolarHBondContact O-CG 3.48Å; V61-R65 PolarHBondContact O-N 3.16Å; I62-R65 PolarHBondContact O-N 2.88Å; R65-R69 PolarHBondContact O-N 2.89Å
66R97.6Very high91.2Very high121 Ų12199.9 Ų99.946%0.45748%0.477SS..Hα-helixtrans-61.9-50.1174-167.6-170.899.7-161.711.4111.1I62 E63 K64 D68 R69 I70I62-R66 PolarHBondContact O-N 3.43Å; E63-R66 VanDerWaalsContact CD-NH1 3.35Å; E63-R66 PolarHBondContact O-N 3.24Å; E63-R66 IonicContact OE1-CZ 3.23Å; E63-R66 VanDerWaalsContact OE1-CZ 3.23Å; E63-R66 IonicContact OE1-NE 3.6Å; E63-R66 IonicContact OE1-NH1 3.4Å; E63-R66 PolarHBondContact OE1-NH1 2.81Å; E63-R66 IonicContact OE1-NH2 3.49Å; E63-R66 PolarHBondContact OE1-NH2 3.22Å; E63-R66 IonicContact OE2-CZ 3.18Å; E63-R66 IonicContact OE2-NE 3.51Å; E63-R66 IonicContact OE2-NH1 2.63Å; E63-R66 PolarHBondContact OE2-NH1 3Å; K64-R66 VanDerWaalsContact C-N 3.31Å; K64-R66 PolarHBondContact O-N 2.71Å; R66-D68 PolarHBondContact O-N 3.41Å; R66-R69 WeakPolarHBondContact O-CB 3.11Å; R66-R69 PolarHBondContact O-N 3.16Å; R66-I70 HydrophobicContact CG-CD1 4.24Å; R66-I70 WeakPolarHBondContact O-CG1 3.4Å; R66-I70 PolarHBondContact O-N 2.89Å
67R97.2Very high92.4Very high129 Ų12996.7 Ų96.749%0.48745%0.453SS..Hα-helixtrans-60.1-44.7177.7-74.8-179.1-74.5170.9-6.1111.8E63 K64 R69 I70 N71E63-R67 WeakPolarHBondContact O-CG 3.3Å; E63-R67 PolarHBondContact O-N 3.38Å; E63-R67 PolarHBondContact O-NE 3.38Å; E63-R67 IonicContact OE1-NE 3.91Å; K64-R67 PolarHBondContact O-N 3.32Å; R67-R69 VanDerWaalsContact C-N 3.28Å; R67-R69 PolarHBondContact O-N 3.22Å; R67-I70 PolarHBondContact O-N 3.4Å; R67-N71 PolarHBondContact O-N 2.93Å; R67-N71 PolarHBondContact O-ND2 3.34Å
68D97.1Very high93.3Very high66 Ų6694.3 Ų94.335%0.35344%0.441SS..Hα-helixtrans-60.8-40.1177.7-63.4-23.2000111.3K64 R66 R72K64-D68 PolarHBondContact O-N 3.08Å; R66-D68 PolarHBondContact O-N 3.41Å; D68-R72 WeakPolarHBondContact O-CG 3.26Å; D68-R72 PolarHBondContact O-N 3.44Å; D68-R72 PolarHBondContact O-NH1 3.31Å
69R96.9Very high93.4Very high143 Ų14396.7 Ų96.754%0.5444%0.444SS..Hα-helixtrans-63.7-46.3175.2-172179.367.2-128.42.3111.9R65 R66 R67 N71 R72 C73R65-R69 PolarHBondContact O-N 2.89Å; R66-R69 WeakPolarHBondContact O-CB 3.11Å; R66-R69 PolarHBondContact O-N 3.16Å; R67-R69 VanDerWaalsContact C-N 3.28Å; R67-R69 PolarHBondContact O-N 3.22Å; R69-N71 PolarHBondContact O-N 3.28Å; R69-R72 PolarHBondContact O-N 2.88Å; R69-C73 PolarHBondContact O-N 2.99Å; R69-C73 VanDerWaalsContact O-N 3.07Å; R69-C73 PolarHBondContact O-SG 3.44Å; R69-C73 VanDerWaalsContact O-SG 3.34Å
70I95.9Very high93.1Very high64 Ų6493.3 Ų93.333%0.32843%0.434SS..Hα-helixtrans-60.1-46.4178.4-69.2167000110.7R66 R67 R72 C73 L74R66-I70 HydrophobicContact CG-CD1 4.24Å; R66-I70 WeakPolarHBondContact O-CG1 3.4Å; R66-I70 PolarHBondContact O-N 2.89Å; R67-I70 PolarHBondContact O-N 3.4Å; I70-R72 VanDerWaalsContact C-N 3.33Å; I70-R72 PolarHBondContact O-N 2.99Å; I70-C73 PolarHBondContact O-N 3.4Å; I70-L74 HydrophobicContact CG2-CD1 3.83Å; I70-L74 HydrophobicContact CG2-CG 4.43Å; I70-L74 WeakPolarHBondContact O-CG 3.21Å; I70-L74 PolarHBondContact O-N 3.5Å
71N95.1Very high92.7Very high79 Ų7985.5 Ų85.542%0.42240%0.4SS..Hα-helixtrans-66.2-35.7-179-69.3-17.7000112.1R67 R69 L74 N75R67-N71 PolarHBondContact O-N 2.93Å; R67-N71 PolarHBondContact O-ND2 3.34Å; R69-N71 PolarHBondContact O-N 3.28Å; N71-L74 PolarHBondContact O-N 3.06Å; N71-N75 WeakPolarHBondContact O-CB 3.25Å; N71-N75 VanDerWaalsContact O-CG 3.32Å; N71-N75 PolarHBondContact O-N 2.75Å
72R95.6Very high92Very high148 Ų14884.4 Ų84.456%0.55839%0.394SS*.Hα-helixtrans-60-48.8170.6-75.8-168.8-59-876.1111.5D68 R69 I70 L74 N75 E76D68-R72 WeakPolarHBondContact O-CG 3.26Å; D68-R72 PolarHBondContact O-N 3.44Å; D68-R72 PolarHBondContact O-NH1 3.31Å; R69-R72 PolarHBondContact O-N 2.88Å; I70-R72 VanDerWaalsContact C-N 3.33Å; I70-R72 PolarHBondContact O-N 2.99Å; R72-L74 VanDerWaalsContact C-N 3.34Å; R72-L74 PolarHBondContact O-N 3.2Å; R72-N75 PolarHBondContact O-N 3.41Å; R72-E76 WeakPolarHBondContact O-CG 3.34Å; R72-E76 PolarHBondContact O-N 3.37Å
73C95.3Very high91.1Very high77 Ų7785.1 Ų85.152%0.5240%0.397SS..Hα-helixtrans-60.4-43.4178.8-65.20000112.1R69 I70 N75 E76 L77R69-C73 PolarHBondContact O-N 2.99Å; R69-C73 VanDerWaalsContact O-N 3.07Å; R69-C73 PolarHBondContact O-SG 3.44Å; R69-C73 VanDerWaalsContact O-SG 3.34Å; I70-C73 PolarHBondContact O-N 3.4Å; C73-N75 PolarHBondContact O-N 3.45Å; C73-E76 PolarHBondContact O-N 2.97Å; C73-L77 VanDerWaalsContact O-CB 3.25Å; C73-L77 WeakPolarHBondContact O-CB 3.47Å; C73-L77 PolarHBondContact O-N 3.01Å
74L91.9Very high89.9Confident17 Ų1784 Ų849%0.08940%0.395CS..Hα-helixtrans-63.6-40.5177.8-72.5167000112.4I70 N71 R72 L77 G78 K136 I139 L140I70-L74 HydrophobicContact CG2-CD1 3.83Å; I70-L74 HydrophobicContact CG2-CG 4.43Å; I70-L74 WeakPolarHBondContact O-CG 3.21Å; I70-L74 PolarHBondContact O-N 3.5Å; N71-L74 PolarHBondContact O-N 3.06Å; R72-L74 VanDerWaalsContact C-N 3.34Å; R72-L74 PolarHBondContact O-N 3.2Å; L74-L77 PolarHBondContact O-N 3.35Å; L74-G78 PolarHBondContact O-N 3.39Å; L74-K136 HydrophobicContact CD1-CD 3.72Å; L74-K136 HydrophobicContact CD1-CG 3.89Å; L74-K136 HydrophobicContact CD2-CG 4.42Å; L74-I139 HydrophobicContact CD2-CG2 4.24Å; L74-L140 HydrophobicContact CD2-CD2 3.95Å; L74-L140 HydrophobicContact CD2-CG 4.29Å
75N89.5Confident88.5Confident102 Ų10280.5 Ų80.555%0.54538%0.382SS..Hα-helixtrans-64.5-40.9176.9-77.2-0.1000112.5N71 R72 C73 K79N71-N75 WeakPolarHBondContact O-CB 3.25Å; N71-N75 VanDerWaalsContact O-CG 3.32Å; N71-N75 PolarHBondContact O-N 2.75Å; R72-N75 PolarHBondContact O-N 3.41Å; C73-N75 PolarHBondContact O-N 3.45Å; N75-K79 WeakPolarHBondContact O-CG 3.33Å; N75-K79 PolarHBondContact O-N 2.95Å
76E92.4Very high86.9Confident104 Ų10475.9 Ų75.949%0.48638%0.377SS..Hα-helixtrans-68.3-40.3177.2-68.2-56.1109.100111.5R72 C73 K79 T80R72-E76 WeakPolarHBondContact O-CG 3.34Å; R72-E76 PolarHBondContact O-N 3.37Å; C73-E76 PolarHBondContact O-N 2.97Å; E76-K79 PolarHBondContact O-N 3.27Å; E76-K79 IonicContact OE1-NZ 2.87Å; E76-K79 PolarHBondContact OE1-NZ 2.95Å; E76-T80 WeakPolarHBondContact O-CB 3.33Å; E76-T80 PolarHBondContact O-N 3.48Å; E76-T80 PolarHBondContact O-OG1 3.48Å
77L89.2Confident85.1Confident52 Ų5278.1 Ų78.127%0.27239%0.39SS..Hα-helixtrans-64.5-43.3177.3-169.765.2000111.8C73 L74 K79 T80 V81 I139 T143C73-L77 VanDerWaalsContact O-CB 3.25Å; C73-L77 WeakPolarHBondContact O-CB 3.47Å; C73-L77 PolarHBondContact O-N 3.01Å; L74-L77 PolarHBondContact O-N 3.35Å; L77-K79 PolarHBondContact O-N 3.28Å; L77-T80 PolarHBondContact O-N 3.03Å; L77-V81 HydrophobicContact CD1-CG2 3.51Å; L77-V81 HydrophobicContact CG-CG2 4.03Å; L77-V81 WeakPolarHBondContact O-CG2 3.4Å; L77-V81 PolarHBondContact O-N 2.92Å; L77-I139 HydrophobicContact CB-CG2 4.06Å; L77-I139 HydrophobicContact CD2-CG2 3.84Å; L77-I139 HydrophobicContact CG-CG2 3.93Å; L77-T143 HydrophobicContact CD1-CG2 3.79Å; L77-T143 HydrophobicContact CD2-CG2 3.94Å; L77-T143 VanDerWaalsContact CD2-OG1 3.23Å; L77-T143 WeakPolarHBondContact CD2-OG1 3.35Å; L77-T143 HydrophobicContact CG-CG2 4.21Å; L77-T143 WeakPolarHBondContact CG-OG1 3.47Å
78G85.9Confident82.9Confident13 Ų1375.5 Ų75.513%0.13438%0.384CS..Hα-helixtrans-64.3-20.1177.300000114.5L74 P82 L134L74-G78 PolarHBondContact O-N 3.39Å; G78-P82 VanDerWaalsContact O-CD 3.27Å; G78-P82 WeakPolarHBondContact O-CD 3.49Å; G78-P82 WeakPolarHBondContact O-CG 3.35Å; G78-L134 VanDerWaalsContact O-CD1 3.27Å; G78-L134 WeakPolarHBondContact O-CD1 3.32Å
79K86.1Confident80.5Confident117 Ų11775 Ų7551%0.50939%0.393SS..Hα-helixtrans-89-44.9170.5-61.7167.3-164.1162.20111.5N75 E76 L77 M83N75-K79 WeakPolarHBondContact O-CG 3.33Å; N75-K79 PolarHBondContact O-N 2.95Å; E76-K79 PolarHBondContact O-N 3.27Å; E76-K79 IonicContact OE1-NZ 2.87Å; E76-K79 PolarHBondContact OE1-NZ 2.95Å; L77-K79 PolarHBondContact O-N 3.28Å; K79-M83 WeakPolarHBondContact O-CB 3.29Å; K79-M83 WeakPolarHBondContact O-CG 3.37Å; K79-M83 PolarHBondContact O-N 2.9Å
80T84.2Confident77.9Confident81 Ų8175 Ų7550%0.49740%0.399SS..Hα-helixtrans-70.9-44.7-169.3-550000112.2E76 L77 M83 A84E76-T80 WeakPolarHBondContact O-CB 3.33Å; E76-T80 PolarHBondContact O-N 3.48Å; E76-T80 PolarHBondContact O-OG1 3.48Å; L77-T80 PolarHBondContact O-N 3.03Å; T80-M83 PolarHBondContact O-N 3.36Å; T80-A84 VanDerWaalsContact O-CB 3.32Å; T80-A84 WeakPolarHBondContact O-CB 3.27Å; T80-A84 PolarHBondContact O-N 2.94Å
81V83.2Confident75.5Confident3 Ų376.2 Ų76.22%0.01841%0.412CS..Hα-helixtrans-66.4-48.2-174176.70000112.3L77 M83 A84 L85 M142 T143 Y146L77-V81 HydrophobicContact CD1-CG2 3.51Å; L77-V81 HydrophobicContact CG-CG2 4.03Å; L77-V81 WeakPolarHBondContact O-CG2 3.4Å; L77-V81 PolarHBondContact O-N 2.92Å; V81-M83 VanDerWaalsContact C-N 3.31Å; V81-M83 PolarHBondContact O-N 3.03Å; V81-A84 PolarHBondContact O-N 3.33Å; V81-L85 HydrophobicContact CG1-CD1 3.98Å; V81-L85 HydrophobicContact CG1-CG 4.49Å; V81-L85 WeakPolarHBondContact O-CB 3.39Å; V81-L85 VanDerWaalsContact O-CG 3.3Å; V81-L85 WeakPolarHBondContact O-CG 3.36Å; V81-L85 PolarHBondContact O-N 3.31Å; V81-M142 HydrophobicContact CB-CE 3.96Å; V81-M142 HydrophobicContact CB-SD 4.49Å; V81-M142 HydrophobicContact CG1-CE 3.91Å; V81-M142 HydrophobicContact CG1-CG 3.69Å; V81-M142 HydrophobicContact CG1-SD 3.94Å; V81-T143 HydrophobicContact CG2-CG2 4.43Å; V81-Y146 HydrophobicContact CG1-CD1 4.38Å; V81-Y146 HydrophobicContact CG1-CG 4.11Å; V81-Y146 HydrophobicContact CG2-CD1 4.38Å
82P77.7Confident73.2Confident36 Ų3679.1 Ų79.123%0.23442%0.423CS..Hα-helixtrans-61-40174.2-19.328.7000112.8G78 L85 A86 L134 M142G78-P82 VanDerWaalsContact O-CD 3.27Å; G78-P82 WeakPolarHBondContact O-CD 3.49Å; G78-P82 WeakPolarHBondContact O-CG 3.35Å; P82-L85 PolarHBondContact O-N 3.02Å; P82-A86 VanDerWaalsContact O-CB 3.31Å; P82-A86 WeakPolarHBondContact O-CB 3.26Å; P82-A86 PolarHBondContact O-N 2.99Å; P82-L134 HydrophobicContact CG-CD1 3.71Å; P82-M142 HydrophobicContact CB-SD 4.25Å; P82-M142 HydrophobicContact CG-CE 3.55Å; P82-M142 HydrophobicContact CG-SD 3.65Å
83M74.2Confident70.9Confident111 Ų11180.4 Ų80.455%0.54744%0.435SS..Hα-helixtrans-65.5-40.9178.7-74.8177.461.600112.1K79 T80 V81 A86 K87K79-M83 WeakPolarHBondContact O-CB 3.29Å; K79-M83 WeakPolarHBondContact O-CG 3.37Å; K79-M83 PolarHBondContact O-N 2.9Å; T80-M83 PolarHBondContact O-N 3.36Å; V81-M83 VanDerWaalsContact C-N 3.31Å; V81-M83 PolarHBondContact O-N 3.03Å; M83-A86 PolarHBondContact O-N 3.47Å; M83-K87 VanDerWaalsContact O-CB 3.32Å; M83-K87 WeakPolarHBondContact O-CB 3.34Å; M83-K87 WeakPolarHBondContact O-CG 3.24Å; M83-K87 PolarHBondContact O-N 2.93Å
84A71Confident68.6Low20 Ų2078.8 Ų78.817%0.16543%0.427CS..Hα-helixtrans-66.1-42.9176.800000111.2T80 V81 A86 K87 Q88 Y146T80-A84 VanDerWaalsContact O-CB 3.32Å; T80-A84 WeakPolarHBondContact O-CB 3.27Å; T80-A84 PolarHBondContact O-N 2.94Å; V81-A84 PolarHBondContact O-N 3.33Å; A84-A86 VanDerWaalsContact C-N 3.33Å; A84-A86 PolarHBondContact O-N 2.88Å; A84-K87 PolarHBondContact O-N 2.98Å; A84-Q88 WeakPolarHBondContact O-CG 3.44Å; A84-Q88 PolarHBondContact O-N 3.4Å; A84-Q88 VanDerWaalsContact O-N 3.12Å; A84-Y146 HydrophobicContact CB-CE2 4.16Å
85L66Low66.5Low52 Ų5279.5 Ų79.527%0.27243%0.431SS..Hα-helixtrans-62.3-38.6174.3-71.7171000112.2V81 P82 M142 Y146V81-L85 HydrophobicContact CG1-CD1 3.98Å; V81-L85 HydrophobicContact CG1-CG 4.49Å; V81-L85 WeakPolarHBondContact O-CB 3.39Å; V81-L85 VanDerWaalsContact O-CG 3.3Å; V81-L85 WeakPolarHBondContact O-CG 3.36Å; V81-L85 PolarHBondContact O-N 3.31Å; P82-L85 PolarHBondContact O-N 3.02Å; L85-M142 HydrophobicContact CD1-CG 3.82Å; L85-M142 HydrophobicContact CD1-SD 4.14Å; L85-Y146 HydrophobicContact CD2-CD2 3.73Å; L85-Y146 HydrophobicContact CD2-CE2 4.49Å; L85-Y146 HydrophobicContact CG-CD2 4.11Å
86A63.4Low64.7Low59 Ų5977 Ų7749%0.48843%0.425SS..Hα-helixtrans-74.2-29.8177.100000113.4P82 M83 A84P82-A86 VanDerWaalsContact O-CB 3.31Å; P82-A86 WeakPolarHBondContact O-CB 3.26Å; P82-A86 PolarHBondContact O-N 2.99Å; M83-A86 PolarHBondContact O-N 3.47Å; A84-A86 VanDerWaalsContact C-N 3.33Å; A84-A86 PolarHBondContact O-N 2.88Å
87K58.6Low62.7Low168 Ų16878.3 Ų78.373%0.7343%0.431SS*.Hα-helixtrans-79.9-22.1178.4-83176.1173.1-80.80113.8M83 A84 G89M83-K87 VanDerWaalsContact O-CB 3.32Å; M83-K87 WeakPolarHBondContact O-CB 3.34Å; M83-K87 WeakPolarHBondContact O-CG 3.24Å; M83-K87 PolarHBondContact O-N 2.93Å; A84-K87 PolarHBondContact O-N 2.98Å; K87-G89 PolarHBondContact O-N 3.28Å
88Q52.3Low61Low74 Ų7478.1 Ų78.135%0.34643%0.429SS..  trans-75.657.8173.5-70-151.7-1.300111.9A84 E90 L95A84-Q88 WeakPolarHBondContact O-CG 3.44Å; A84-Q88 PolarHBondContact O-N 3.4Å; A84-Q88 VanDerWaalsContact O-N 3.12Å; Q88-E90 VanDerWaalsContact C-N 3.3Å; Q88-E90 PolarHBondContact O-N 3.37Å; Q88-L95 WeakPolarHBondContact O-CD1 3.21Å
89G47.1Very low59.4Low54 Ų5484.6 Ų84.656%0.55745%0.45SS*.  trans-70.8-12.5178.800000115.4K87K87-G89 PolarHBondContact O-N 3.28Å
90E40.9Very low57.8Low143 Ų14382.6 Ų82.667%0.66845%0.451SS*.  trans-156.9122.1174.7-72-58.8143.600106.9Q88Q88-E90 VanDerWaalsContact C-N 3.3Å; Q88-E90 PolarHBondContact O-N 3.37Å
91P45.7Very low56.5Low91 Ų9186.7 Ų86.759%0.59146%0.457SS*.  -126.4141.555.320.71.6000114.3E93P91-E93 PolarHBondContact O-N 2.96Å
92Q47.4Very low55Low140 Ų14088.7 Ų88.765%0.65447%0.469SS*.Hα-helixtrans-74.7-7.7-155.3-147.417260.900117.3
93E46.6Very low53.8Low174 Ų17495.2 Ų95.281%0.81349%0.489SS*.Hα-helixtrans-92.6-42.5-173.8-82.7172.5140.300114.7P91 A96 Q97P91-E93 PolarHBondContact O-N 2.96Å; E93-A96 PolarHBondContact O-N 2.83Å; E93-Q97 PolarHBondContact O-N 3.36Å
94A47.5Very low52.5Low43 Ų4393.1 Ų93.136%0.35549%0.486SS..Hα-helixtrans-70.2-36.8-179.800000111.9Q97 I98A94-Q97 PolarHBondContact O-N 3.49Å; A94-I98 WeakPolarHBondContact O-CD1 3.49Å; A94-I98 VanDerWaalsContact O-CG1 3.3Å; A94-I98 WeakPolarHBondContact O-CG1 3.11Å; A94-I98 PolarHBondContact O-N 2.87Å
95L48.5Very low51.5Low33 Ų3397.9 Ų97.917%0.17351%0.508CS..Hα-helixtrans-71.9-28.6178-71.7170.4000113Q88 I98 R99Q88-L95 WeakPolarHBondContact O-CD1 3.21Å; L95-I98 HydrophobicContact CD2-CD1 4.37Å; L95-I98 PolarHBondContact O-N 3.49Å; L95-R99 VanDerWaalsContact O-CB 3.26Å; L95-R99 WeakPolarHBondContact O-CB 3.36Å; L95-R99 WeakPolarHBondContact O-CG 3.44Å; L95-R99 PolarHBondContact O-N 2.87Å
96A51.2Low50.8Low50 Ų50100 Ų10041%0.41352%0.522SS..Hα-helixtrans-66.4-40.7171.800000111E93 S100E93-A96 PolarHBondContact O-N 2.83Å; A96-S100 WeakPolarHBondContact O-CB 3.4Å; A96-S100 PolarHBondContact O-N 2.98Å
97Q50.8Low50Low131 Ų131103.1 Ų103.161%0.61253%0.53SS*.Hα-helixtrans-66-41.6173.2-85.8-171.226.700112.8E93 A94 S100 R101E93-Q97 PolarHBondContact O-N 3.36Å; A94-Q97 PolarHBondContact O-N 3.49Å; Q97-S100 PolarHBondContact O-N 3.19Å; Q97-R101 WeakPolarHBondContact O-CB 3.02Å; Q97-R101 PolarHBondContact O-N 3.24Å
98I52.2Low49.2Very low47 Ų4799.5 Ų99.524%0.24153%0.526CS..Hα-helixtrans-67.2-46.5177.7-66.2157.6000110.5A94 L95 S100 R101 V102 A149A94-I98 WeakPolarHBondContact O-CD1 3.49Å; A94-I98 VanDerWaalsContact O-CG1 3.3Å; A94-I98 WeakPolarHBondContact O-CG1 3.11Å; A94-I98 PolarHBondContact O-N 2.87Å; L95-I98 HydrophobicContact CD2-CD1 4.37Å; L95-I98 PolarHBondContact O-N 3.49Å; I98-S100 VanDerWaalsContact C-N 3.28Å; I98-S100 PolarHBondContact O-N 3.43Å; I98-R101 PolarHBondContact O-N 2.72Å; I98-V102 HydrophobicContact CG2-CG2 4.33Å; I98-V102 WeakPolarHBondContact O-CB 3.37Å; I98-V102 VanDerWaalsContact O-CG2 3.31Å; I98-V102 WeakPolarHBondContact O-CG2 3.43Å; I98-V102 PolarHBondContact O-N 3.18Å; I98-A149 HydrophobicContact CD1-CB 3.43Å; I98-A149 VanDerWaalsContact CD1-CB 3.43Å; I98-A149 HydrophobicContact CG1-CB 4.19Å
99R52Low48.8Very low149 Ų149100.5 Ų100.556%0.56254%0.541SS*.Hα-helixtrans-58.3-40173.2-80.8-176.9-123.41510.8111.7L95 R103L95-R99 VanDerWaalsContact O-CB 3.26Å; L95-R99 WeakPolarHBondContact O-CB 3.36Å; L95-R99 WeakPolarHBondContact O-CG 3.44Å; L95-R99 PolarHBondContact O-N 2.87Å; R99-R103 WeakPolarHBondContact O-CB 3.28Å; R99-R103 PolarHBondContact O-N 3.21Å; R99-R103 VanDerWaalsContact O-N 3.07Å
100S53.8Low48.4Very low76 Ų76101.7 Ų101.753%0.53155%0.546SS..Hα-helixtrans-67.5-44.1177.8-178.60000112.3A96 Q97 I98 R103 S104A96-S100 WeakPolarHBondContact O-CB 3.4Å; A96-S100 PolarHBondContact O-N 2.98Å; Q97-S100 PolarHBondContact O-N 3.19Å; I98-S100 VanDerWaalsContact C-N 3.28Å; I98-S100 PolarHBondContact O-N 3.43Å; S100-R103 PolarHBondContact O-N 3.45Å; S100-S104 WeakPolarHBondContact O-CB 3.38Å; S100-S104 PolarHBondContact O-N 3.48Å
101R55.6Low48.2Very low167 Ų167100.9 Ų100.963%0.6355%0.551SS**Hα-helixtrans-70.9-39.2179.2-94.7170.4164.1-174.1-4.9113.6Q97 I98 R103 S104 L105Q97-R101 WeakPolarHBondContact O-CB 3.02Å; Q97-R101 PolarHBondContact O-N 3.24Å; I98-R101 PolarHBondContact O-N 2.72Å; R101-R103 VanDerWaalsContact C-N 3.32Å; R101-S104 PolarHBondContact O-N 3.29Å; R101-L105 WeakPolarHBondContact O-CB 3.49Å; R101-L105 WeakPolarHBondContact O-CG 3.48Å; R101-L105 PolarHBondContact O-N 2.65Å
102V52.1Low48Very low45 Ų45102.2 Ų102.227%0.27356%0.557SS.*Hα-helixtrans-64.4-41.2173173.40000110.2I98 S104 L105 V106I98-V102 HydrophobicContact CG2-CG2 4.33Å; I98-V102 WeakPolarHBondContact O-CB 3.37Å; I98-V102 VanDerWaalsContact O-CG2 3.31Å; I98-V102 WeakPolarHBondContact O-CG2 3.43Å; I98-V102 PolarHBondContact O-N 3.18Å; V102-S104 PolarHBondContact O-N 3.21Å; V102-L105 PolarHBondContact O-N 3.46Å; V102-V106 VanDerWaalsContact O-CG2 3.29Å; V102-V106 WeakPolarHBondContact O-CG2 3.31Å; V102-V106 PolarHBondContact O-N 3.41Å; V102-V106 VanDerWaalsContact O-N 3.1Å
103R52.8Low48.5Very low172 Ų172101 Ų10165%0.64956%0.561SS**Hα-helixtrans-62.1-40.1174.3-163.5-177.1-64.2-161.8-2.5112.1R99 S100 R101 L107R99-R103 WeakPolarHBondContact O-CB 3.28Å; R99-R103 PolarHBondContact O-N 3.21Å; R99-R103 VanDerWaalsContact O-N 3.07Å; S100-R103 PolarHBondContact O-N 3.45Å; R101-R103 VanDerWaalsContact C-N 3.32Å; R103-L107 WeakPolarHBondContact O-CD1 3.28Å; R103-L107 PolarHBondContact O-N 3.23Å; R103-L107 VanDerWaalsContact O-N 3.1Å
104S47.5Very low47.7Very low68 Ų6898.9 Ų98.948%0.47656%0.556SS.*Hα-helixtrans-69.9-41.4177.8-1760000113.6S100 R101 V102 L107 S108S100-S104 WeakPolarHBondContact O-CB 3.38Å; S100-S104 PolarHBondContact O-N 3.48Å; R101-S104 PolarHBondContact O-N 3.29Å; V102-S104 PolarHBondContact O-N 3.21Å; S104-L107 PolarHBondContact O-N 2.93Å; S104-S108 WeakPolarHBondContact O-CB 3.41Å; S104-S108 PolarHBondContact O-N 2.84Å; S104-S108 PolarHBondContact O-OG 3.39Å
105L50.6Low46.9Very low120 Ų120103.8 Ų103.863%0.62857%0.571SS**Hα-helixtrans-66.4-35.8177-76.5165000112.5R101 V102R101-L105 WeakPolarHBondContact O-CB 3.49Å; R101-L105 WeakPolarHBondContact O-CG 3.48Å; R101-L105 PolarHBondContact O-N 2.65Å; V102-L105 PolarHBondContact O-N 3.46Å
106V49.4Very low46.3Very low95 Ų95110.6 Ų110.658%0.57660%0.602SS**Hα-helixtrans-76.5-30176.8174.50000112.2V102 S109V102-V106 VanDerWaalsContact O-CG2 3.29Å; V102-V106 WeakPolarHBondContact O-CG2 3.31Å; V102-V106 PolarHBondContact O-N 3.41Å; V102-V106 VanDerWaalsContact O-N 3.1Å; V106-S109 PolarHBondContact O-OG 3.4Å; V106-S109 VanDerWaalsContact O-OG 3.09Å
107L47.5Very low45.3Very low126 Ų126112.8 Ų112.866%0.6662%0.62SS**Hα-helixtrans-74.2-28.5173.1-102.874.3000112.8R103 S104 S109 A110R103-L107 WeakPolarHBondContact O-CD1 3.28Å; R103-L107 PolarHBondContact O-N 3.23Å; R103-L107 VanDerWaalsContact O-N 3.1Å; S104-L107 PolarHBondContact O-N 2.93Å; L107-S109 VanDerWaalsContact C-N 3.29Å; L107-S109 PolarHBondContact O-N 2.83Å; L107-A110 PolarHBondContact O-N 3.44Å
108S42.5Very low44.7Very low92 Ų92115.6 Ų115.664%0.64364%0.638SS**THydrogen-bonded Turntrans-77.7-12.9-178.2-60.30000113.5S104S104-S108 WeakPolarHBondContact O-CB 3.41Å; S104-S108 PolarHBondContact O-N 2.84Å; S104-S108 PolarHBondContact O-OG 3.39Å
109S42.8Very low43.6Very low95 Ų95116 Ų11666%0.66465%0.654SS**THydrogen-bonded Turntrans-94.2-0.4173.650.80000114V106 L107V106-S109 PolarHBondContact O-OG 3.4Å; V106-S109 VanDerWaalsContact O-OG 3.09Å; L107-S109 VanDerWaalsContact C-N 3.29Å; L107-S109 PolarHBondContact O-N 2.83Å
110A39.3Very low43Very low78 Ų78119.5 Ų119.565%0.64567%0.667SS**  trans-106.387177.300000111.2L107 V112L107-A110 PolarHBondContact O-N 3.44Å; A110-V112 PolarHBondContact O-N 2.85Å
111T35.9Very low42Very low126 Ų126121.5 Ų121.577%0.77368%0.68SS**  trans-83.3100.2172.9-45.80000110.1
112V41.1Very low41.3Very low120 Ų120120 Ų12073%0.72768%0.68SS**  trans84.1148.3141.4-175.70000117.8A110A110-V112 PolarHBondContact O-N 2.85Å
113P58.6Low41.1Very low114 Ų114119.7 Ų119.774%0.7469%0.686SS**  -133.3-177.6-50.839.3-19.2000113.2
114D29Very low40.8Very low130 Ų130116.5 Ų116.570%0.69569%0.688SS**  trans98.1128.5148-147.627.6000121.6
115Q32.3Very low40.6Very low145 Ų145118.5 Ų118.568%0.67869%0.688SS**  trans48105.3158.5-112.4136.399.600122.8
116Q34.8Very low40.5Very low177 Ų177117.8 Ų117.883%0.82768%0.684SS**  63.493.3118.1-162.7164.88.300118.3
117A30.4Very low40.3Very low96 Ų96119.1 Ų119.179%0.79369%0.688SS**  trans-170115.7138.600000111.9G119A117-G119 PolarHBondContact O-N 3.24Å
118L38.6Very low40.5Very low189 Ų189116 Ų11699%0.9967%0.671SS**  trans-1107.1144.3-146.4122.8000116
119G28.9Very low40.8Very low56 Ų56117.3 Ų117.358%0.57767%0.667SS**  trans178.8101.3173.200000111.6A117 C121A117-G119 PolarHBondContact O-N 3.24Å; G119-C121 VanDerWaalsContact C-N 3.35Å; G119-C121 PolarHBondContact O-N 3.15Å
120R39.5Very low41Very low223 Ų223117 Ų11784%0.84267%0.665SS**  trans-60.390.9173.6-174.5-160.7-88-1303.6109.3E122R120-E122 VanDerWaalsContact C-N 3.3Å; R120-E122 HydrophobicContact CG-CG 4.18Å; R120-E122 PolarHBondContact O-N 3.45Å
121C33Very low41.4Very low118 Ų118116.5 Ų116.580%0.79766%0.657SS**  trans-79.277.8175.5-73.40000110.9G119 G123G119-C121 VanDerWaalsContact C-N 3.35Å; G119-C121 PolarHBondContact O-N 3.15Å; C121-G123 PolarHBondContact O-N 2.97Å
122E40.2Very low42.5Very low134 Ų134114.7 Ų114.763%0.62666%0.663SS**  trans-65.757.9153.9-66-75.4151.900109.2R120R120-E122 VanDerWaalsContact C-N 3.3Å; R120-E122 HydrophobicContact CG-CG 4.18Å; R120-E122 PolarHBondContact O-N 3.45Å
123G48.5Very low44Very low39 Ų39117.5 Ų117.540%0.40267%0.666SS.*  trans-124.8-8.4-144.200000121.2C121C121-G123 PolarHBondContact O-N 2.97Å
124P46.2Very low45.1Very low105 Ų105113.7 Ų113.768%0.68264%0.639SS**SBendtrans-113.1-33.7172.6-3.824.4000115.1
125F43.6Very low47.9Very low111 Ų111114.3 Ų114.349%0.48764%0.638SS.*Hα-helixtrans-88.4-29.9-166.7-140.9-97000113.7L127F125-L127 VanDerWaalsContact C-N 3.31Å
126L48.3Very low50.6Low104 Ų104113.3 Ų113.355%0.54563%0.631SS.*Hα-helixtrans-75.6-20.9175.5-63.4-174.9000112.7Q129L126-Q129 PolarHBondContact O-N 3.44Å
127L46.2Very low53.2Low124 Ų124108.1 Ų108.165%0.64962%0.619SS**Hα-helixtrans-73.1-34.1175.9-131.3160.1000111F125 Q129 S130F125-L127 VanDerWaalsContact C-N 3.31Å; L127-Q129 VanDerWaalsContact C-N 3.31Å; L127-Q129 PolarHBondContact O-N 3.38Å; L127-S130 PolarHBondContact O-N 3.41Å; L127-S130 PolarHBondContact O-OG 3.3Å
128L49.8Very low55.8Low60 Ų60105.5 Ų105.531%0.31459%0.59SS.*Hα-helixtrans-63.9-32.2172.9-130.574.8000113.4S130 L134 E138 M142L128-S130 PolarHBondContact O-N 2.81Å; L128-L134 HydrophobicContact CG-CD2 4.24Å; L128-E138 HydrophobicContact CD1-CG 4.33Å; L128-E138 WeakPolarHBondContact CD1-OE1 3.46Å; L128-E138 HydrophobicContact CD2-CG 4.42Å; L128-E138 WeakPolarHBondContact CG-OE1 3.14Å; L128-M142 HydrophobicContact CD2-SD 4.49Å
129Q49.3Very low58.1Low120 Ų12097.1 Ų97.156%0.56155%0.546SS*.THydrogen-bonded Turntrans-72.7-10.5179.6-82.8-168.4-55.600114.1L126 L127L126-Q129 PolarHBondContact O-N 3.44Å; L127-Q129 VanDerWaalsContact C-N 3.31Å; L127-Q129 PolarHBondContact O-N 3.38Å
130S47.4Very low61.2Low89 Ų8998.3 Ų98.362%0.62254%0.539SS*.THydrogen-bonded Turntrans-105.4-17.9-171.371.70000115L127 L128L127-S130 PolarHBondContact O-N 3.41Å; L127-S130 PolarHBondContact O-OG 3.3Å; L128-S130 PolarHBondContact O-N 2.81Å
131S48.3Very low63.5Low66 Ų6693.4 Ų93.446%0.46253%0.526SS..  trans-98100.7179-1740000109.5K133S131-K133 PolarHBondContact O-N 3Å; S131-K133 PolarHBondContact OG-O 2.82Å
132G58.1Low65.8Low89 Ų8988.4 Ų88.492%0.91849%0.49SS*.SBendtrans-61.415.317500000115.6
133K73.8Confident68.2Low179 Ų17982.8 Ų82.878%0.77847%0.466SS*.  trans-133.490.5173-86.5170.4173.9171.50108.2S131S131-K133 PolarHBondContact O-N 3Å; S131-K133 PolarHBondContact OG-O 2.82Å
134L80.1Confident70.1Confident34 Ų3484.1 Ų84.118%0.17847%0.465CS..  trans-73.9141166.8-59.1175.2000109.6G78 P82 L128 E138 I139 M142G78-L134 VanDerWaalsContact O-CD1 3.27Å; G78-L134 WeakPolarHBondContact O-CD1 3.32Å; P82-L134 HydrophobicContact CG-CD1 3.71Å; L128-L134 HydrophobicContact CG-CD2 4.24Å; L134-E138 WeakPolarHBondContact CA-OE2 3.37Å; L134-E138 HydrophobicContact CD2-CG 4.28Å; L134-E138 WeakPolarHBondContact CD2-OE1 3.31Å; L134-I139 HydrophobicContact CB-CD1 4.07Å; L134-I139 HydrophobicContact CB-CG1 3.52Å; L134-I139 HydrophobicContact CD1-CG1 4.06Å; L134-I139 HydrophobicContact CG-CG1 4.47Å; L134-M142 HydrophobicContact CD1-CE 3.55Å
135E88.3Confident71.8Confident143 Ų14382.5 Ų82.567%0.66845%0.449SS*.  trans-73.1158173.6-65-168.1168.400111.4A137 E138 I139E135-A137 VanDerWaalsContact C-N 3.28Å; E135-A137 PolarHBondContact O-N 3.26Å; E135-E138 HydrophobicContact CB-CB 4.16Å; E135-E138 PolarHBondContact N-OE2 3.23Å; E135-E138 WeakPolarHBondContact O-CB 3.32Å; E135-E138 PolarHBondContact O-N 3.38Å; E135-I139 VanDerWaalsContact O-CG1 3.29Å; E135-I139 WeakPolarHBondContact O-CG1 3.47Å; E135-I139 PolarHBondContact O-N 2.92Å
136K88.7Confident73.6Confident123 Ų12379.5 Ų79.554%0.53544%0.435SS..Hα-helixtrans-60.9-37.5-178.7178.7170.9173.5177.50112.8L74 L140L74-K136 HydrophobicContact CD1-CD 3.72Å; L74-K136 HydrophobicContact CD1-CG 3.89Å; L74-K136 HydrophobicContact CD2-CG 4.42Å; K136-L140 HydrophobicContact CG-CD1 4.5Å; K136-L140 VanDerWaalsContact O-CG 3.3Å; K136-L140 WeakPolarHBondContact O-CG 3.36Å; K136-L140 PolarHBondContact O-N 3.31Å
137A89.1Confident75.4Confident69 Ų6978.3 Ų78.357%0.5743%0.429SS*.Hα-helixtrans-68.6-43.917800000111E135 L140 E141E135-A137 VanDerWaalsContact C-N 3.28Å; E135-A137 PolarHBondContact O-N 3.26Å; A137-L140 PolarHBondContact O-N 3.32Å; A137-E141 WeakPolarHBondContact O-CB 2.93Å; A137-E141 PolarHBondContact O-N 2.9Å
138E86Confident77.1Confident41 Ų4180.7 Ų80.719%0.19243%0.429CS..Hα-helixtrans-62.3-44.1178-175.8-173.7-177.300112.6L128 L134 E135 L140 E141 M142L128-E138 HydrophobicContact CD1-CG 4.33Å; L128-E138 WeakPolarHBondContact CD1-OE1 3.46Å; L128-E138 HydrophobicContact CD2-CG 4.42Å; L128-E138 WeakPolarHBondContact CG-OE1 3.14Å; L134-E138 WeakPolarHBondContact CA-OE2 3.37Å; L134-E138 HydrophobicContact CD2-CG 4.28Å; L134-E138 WeakPolarHBondContact CD2-OE1 3.31Å; E135-E138 HydrophobicContact CB-CB 4.16Å; E135-E138 PolarHBondContact N-OE2 3.23Å; E135-E138 WeakPolarHBondContact O-CB 3.32Å; E135-E138 PolarHBondContact O-N 3.38Å; E138-L140 VanDerWaalsContact C-N 3.28Å; E138-L140 PolarHBondContact O-N 3.31Å; E138-E141 PolarHBondContact O-N 3.44Å; E138-M142 VanDerWaalsContact O-CB 3.24Å; E138-M142 WeakPolarHBondContact O-CB 3.33Å; E138-M142 PolarHBondContact O-N 3.43Å
139I87Confident78.4Confident12 Ų1278.5 Ų78.56%0.06242%0.42CS..Hα-helixtrans-56.1-46.3173.6-67.5167.7000110.2L74 L77 L134 E135 T143L74-I139 HydrophobicContact CD2-CG2 4.24Å; L77-I139 HydrophobicContact CB-CG2 4.06Å; L77-I139 HydrophobicContact CD2-CG2 3.84Å; L77-I139 HydrophobicContact CG-CG2 3.93Å; L134-I139 HydrophobicContact CB-CD1 4.07Å; L134-I139 HydrophobicContact CB-CG1 3.52Å; L134-I139 HydrophobicContact CD1-CG1 4.06Å; L134-I139 HydrophobicContact CG-CG1 4.47Å; E135-I139 VanDerWaalsContact O-CG1 3.29Å; E135-I139 WeakPolarHBondContact O-CG1 3.47Å; E135-I139 PolarHBondContact O-N 2.92Å; I139-T143 VanDerWaalsContact O-CB 3.3Å; I139-T143 WeakPolarHBondContact O-CB 3.31Å; I139-T143 PolarHBondContact O-N 3.4Å; I139-T143 PolarHBondContact O-OG1 3.31Å
140L93.3Very high79.6Confident82 Ų8274.9 Ų74.943%0.42940%0.404SS..Hα-helixtrans-69.2-44.1-178.3-68.5174.8000111.7L74 K136 A137 E138 T143 V144L74-L140 HydrophobicContact CD2-CD2 3.95Å; L74-L140 HydrophobicContact CD2-CG 4.29Å; K136-L140 HydrophobicContact CG-CD1 4.5Å; K136-L140 VanDerWaalsContact O-CG 3.3Å; K136-L140 WeakPolarHBondContact O-CG 3.36Å; K136-L140 PolarHBondContact O-N 3.31Å; A137-L140 PolarHBondContact O-N 3.32Å; E138-L140 VanDerWaalsContact C-N 3.28Å; E138-L140 PolarHBondContact O-N 3.31Å; L140-T143 PolarHBondContact O-N 3.36Å; L140-V144 VanDerWaalsContact O-CG2 3.32Å; L140-V144 WeakPolarHBondContact O-CG2 3.13Å; L140-V144 PolarHBondContact O-N 2.85Å
141E87.3Confident80.9Confident120 Ų12076.4 Ų76.456%0.56140%0.401SS*.Hα-helixtrans-60.3-52.4178.4177.2171.2-147.600111.4A137 E138 T143 V144 Q145A137-E141 WeakPolarHBondContact O-CB 2.93Å; A137-E141 PolarHBondContact O-N 2.9Å; E138-E141 PolarHBondContact O-N 3.44Å; E141-T143 VanDerWaalsContact C-N 3.27Å; E141-T143 PolarHBondContact O-N 2.89Å; E141-V144 PolarHBondContact O-N 3.46Å; E141-V144 VanDerWaalsContact O-N 3.14Å; E141-Q145 WeakPolarHBondContact O-CG 3.16Å; E141-Q145 PolarHBondContact O-N 3.38Å
142M82.8Confident82.1Confident12 Ų1276.6 Ų76.66%0.05940%0.402CS..Hα-helixtrans-60.9-37.4177.9-177.3-170.444.200111.5V81 P82 L85 L128 L134 E138 Q145 Y146V81-M142 HydrophobicContact CB-CE 3.96Å; V81-M142 HydrophobicContact CB-SD 4.49Å; V81-M142 HydrophobicContact CG1-CE 3.91Å; V81-M142 HydrophobicContact CG1-CG 3.69Å; V81-M142 HydrophobicContact CG1-SD 3.94Å; P82-M142 HydrophobicContact CB-SD 4.25Å; P82-M142 HydrophobicContact CG-CE 3.55Å; P82-M142 HydrophobicContact CG-SD 3.65Å; L85-M142 HydrophobicContact CD1-CG 3.82Å; L85-M142 HydrophobicContact CD1-SD 4.14Å; L128-M142 HydrophobicContact CD2-SD 4.49Å; L134-M142 HydrophobicContact CD1-CE 3.55Å; E138-M142 VanDerWaalsContact O-CB 3.24Å; E138-M142 WeakPolarHBondContact O-CB 3.33Å; E138-M142 PolarHBondContact O-N 3.43Å; M142-Q145 PolarHBondContact O-N 3.39Å; M142-Y146 WeakPolarHBondContact O-CB 3.27Å; M142-Y146 PolarHBondContact O-N 2.79Å
143T89.2Confident82.3Confident17 Ų1774.4 Ų74.410%0.10438%0.375CS..Hα-helixtrans-64.7-43.9174.7-58.90000111.9L77 V81 I139 L140 E141 Q145 Y146 L147L77-T143 HydrophobicContact CD1-CG2 3.79Å; L77-T143 HydrophobicContact CD2-CG2 3.94Å; L77-T143 VanDerWaalsContact CD2-OG1 3.23Å; L77-T143 WeakPolarHBondContact CD2-OG1 3.35Å; L77-T143 HydrophobicContact CG-CG2 4.21Å; L77-T143 WeakPolarHBondContact CG-OG1 3.47Å; V81-T143 HydrophobicContact CG2-CG2 4.43Å; I139-T143 VanDerWaalsContact O-CB 3.3Å; I139-T143 WeakPolarHBondContact O-CB 3.31Å; I139-T143 PolarHBondContact O-N 3.4Å; I139-T143 PolarHBondContact O-OG1 3.31Å; L140-T143 PolarHBondContact O-N 3.36Å; E141-T143 VanDerWaalsContact C-N 3.27Å; E141-T143 PolarHBondContact O-N 2.89Å; T143-Q145 VanDerWaalsContact C-N 3.3Å; T143-Q145 PolarHBondContact O-N 3.43Å; T143-Y146 PolarHBondContact O-N 2.79Å; T143-L147 HydrophobicContact CG2-CD1 4.03Å; T143-L147 HydrophobicContact CG2-CG 4.28Å; T143-L147 WeakPolarHBondContact O-CB 3.28Å; T143-L147 VanDerWaalsContact O-CG 3.31Å; T143-L147 WeakPolarHBondContact O-CG 3.42Å; T143-L147 PolarHBondContact O-N 3.12Å
144V90Very high81.4Confident66 Ų6672.2 Ų72.240%0.437%0.372SS..Hα-helixtrans-62.3-42.5177.1169.30000110.3L140 E141 L147 R148L140-V144 VanDerWaalsContact O-CG2 3.32Å; L140-V144 WeakPolarHBondContact O-CG2 3.13Å; L140-V144 PolarHBondContact O-N 2.85Å; E141-V144 PolarHBondContact O-N 3.46Å; E141-V144 VanDerWaalsContact O-N 3.14Å; V144-L147 PolarHBondContact O-N 3.04Å; V144-R148 HydrophobicContact CG1-CG 4.43Å; V144-R148 WeakPolarHBondContact O-CB 3.45Å; V144-R148 VanDerWaalsContact O-CG 3.25Å; V144-R148 WeakPolarHBondContact O-CG 3.27Å; V144-R148 PolarHBondContact O-N 2.97Å
145Q82Confident80.1Confident71 Ų7175.6 Ų75.633%0.33239%0.385SS..Hα-helixtrans-61.7-44.3175-68.7179.420.300111.6E141 M142 T143 R148 A149E141-Q145 WeakPolarHBondContact O-CG 3.16Å; E141-Q145 PolarHBondContact O-N 3.38Å; M142-Q145 PolarHBondContact O-N 3.39Å; T143-Q145 VanDerWaalsContact C-N 3.3Å; T143-Q145 PolarHBondContact O-N 3.43Å; Q145-R148 PolarHBondContact O-N 3.48Å; Q145-A149 WeakPolarHBondContact O-CB 3.22Å; Q145-A149 PolarHBondContact O-N 2.88Å
146Y81.5Confident78.6Confident49 Ų4971.5 Ų71.519%0.19237%0.372CS..Hα-helixtrans-61.6-45175.8177.1-115000112.5V81 A84 L85 M142 T143 R148 A149 L150V81-Y146 HydrophobicContact CG1-CD1 4.38Å; V81-Y146 HydrophobicContact CG1-CG 4.11Å; V81-Y146 HydrophobicContact CG2-CD1 4.38Å; A84-Y146 HydrophobicContact CB-CE2 4.16Å; L85-Y146 HydrophobicContact CD2-CD2 3.73Å; L85-Y146 HydrophobicContact CD2-CE2 4.49Å; L85-Y146 HydrophobicContact CG-CD2 4.11Å; M142-Y146 WeakPolarHBondContact O-CB 3.27Å; M142-Y146 PolarHBondContact O-N 2.79Å; T143-Y146 PolarHBondContact O-N 2.79Å; Y146-R148 PolarHBondContact O-N 2.81Å; Y146-A149 WeakPolarHBondContact O-CB 3.47Å; Y146-A149 PolarHBondContact O-N 3.1Å; Y146-L150 HydrophobicContact CD1-CD1 3.98Å; Y146-L150 HydrophobicContact CD2-CG 4.39Å; Y146-L150 HydrophobicContact CE1-CD1 3.43Å; Y146-L150 VanDerWaalsContact CE1-CD1 3.43Å; Y146-L150 HydrophobicContact CE1-CG 4.16Å; Y146-L150 HydrophobicContact CE2-CD1 4.18Å; Y146-L150 HydrophobicContact CE2-CD2 4.11Å; Y146-L150 HydrophobicContact CE2-CG 4.02Å; Y146-L150 WeakPolarHBondContact O-CG 3.3Å; Y146-L150 PolarHBondContact O-N 3.26Å
147L85.4Confident76.9Confident79 Ų7976 Ų7641%0.41439%0.385SS..Hα-helixtrans-64.3-40.9176.7-69.7173.6000112T143 V144 A149 L150 H151T143-L147 HydrophobicContact CG2-CD1 4.03Å; T143-L147 HydrophobicContact CG2-CG 4.28Å; T143-L147 WeakPolarHBondContact O-CB 3.28Å; T143-L147 VanDerWaalsContact O-CG 3.31Å; T143-L147 WeakPolarHBondContact O-CG 3.42Å; T143-L147 PolarHBondContact O-N 3.12Å; V144-L147 PolarHBondContact O-N 3.04Å; L147-A149 VanDerWaalsContact C-N 3.33Å; L147-L150 HydrophobicContact CD2-CD1 4.5Å; L147-L150 PolarHBondContact O-N 2.87Å; L147-H151 WeakPolarHBondContact O-CB 3.38Å; L147-H151 PolarHBondContact O-CD2 3.21Å; L147-H151 VanDerWaalsContact O-CG 3.25Å; L147-H151 PolarHBondContact O-N 3Å
148R82.2Confident75.1Confident173 Ų17375.1 Ų75.165%0.65338%0.382SS*.Hα-helixtrans-61.8-42.5173.7-73.9175.2-176.9-159.72.4111.3V144 Q145 Y146 H151 S152V144-R148 HydrophobicContact CG1-CG 4.43Å; V144-R148 WeakPolarHBondContact O-CB 3.45Å; V144-R148 VanDerWaalsContact O-CG 3.25Å; V144-R148 WeakPolarHBondContact O-CG 3.27Å; V144-R148 PolarHBondContact O-N 2.97Å; Q145-R148 PolarHBondContact O-N 3.48Å; Y146-R148 PolarHBondContact O-N 2.81Å; R148-H151 PolarHBondContact O-N 3.4Å; R148-S152 WeakPolarHBondContact O-CB 3.15Å; R148-S152 PolarHBondContact O-N 2.87Å; R148-S152 PolarHBondContact O-OG 3.38Å
149A76.1Confident73.5Confident15 Ų1581.4 Ų81.412%0.12441%0.405CS..Hα-helixtrans-60.8-47.117500000111.8I98 Q145 Y146 L147 H151 S152 A153I98-A149 HydrophobicContact CD1-CB 3.43Å; I98-A149 VanDerWaalsContact CD1-CB 3.43Å; I98-A149 HydrophobicContact CG1-CB 4.19Å; Q145-A149 WeakPolarHBondContact O-CB 3.22Å; Q145-A149 PolarHBondContact O-N 2.88Å; Y146-A149 WeakPolarHBondContact O-CB 3.47Å; Y146-A149 PolarHBondContact O-N 3.1Å; L147-A149 VanDerWaalsContact C-N 3.33Å; A149-H151 VanDerWaalsContact C-N 3.31Å; A149-H151 PolarHBondContact O-N 3.46Å; A149-S152 WeakPolarHBondContact CA-OG 3.05Å; A149-S152 PolarHBondContact O-N 2.74Å; A149-S152 PolarHBondContact O-OG 3.26Å; A149-A153 WeakPolarHBondContact O-CB 3.47Å; A149-A153 PolarHBondContact O-N 2.98Å
150L76.1Confident72.2Confident44 Ų4486.1 Ų86.123%0.2343%0.426CS..Hα-helixtrans-61.4-37.9176.4-73.3179.1000112.8Y146 L147 F155Y146-L150 HydrophobicContact CD1-CD1 3.98Å; Y146-L150 HydrophobicContact CD2-CG 4.39Å; Y146-L150 HydrophobicContact CE1-CD1 3.43Å; Y146-L150 VanDerWaalsContact CE1-CD1 3.43Å; Y146-L150 HydrophobicContact CE1-CG 4.16Å; Y146-L150 HydrophobicContact CE2-CD1 4.18Å; Y146-L150 HydrophobicContact CE2-CD2 4.11Å; Y146-L150 HydrophobicContact CE2-CG 4.02Å; Y146-L150 WeakPolarHBondContact O-CG 3.3Å; Y146-L150 PolarHBondContact O-N 3.26Å; L147-L150 HydrophobicContact CD2-CD1 4.5Å; L147-L150 PolarHBondContact O-N 2.87Å; L150-F155 HydrophobicContact CD2-CE2 4.28Å
151H73.6Confident70.4Confident121 Ų12190 Ų9056%0.5644%0.44SS*.Hα-helixtrans-76.4-37.4178.4-69.4-174.9000112L147 R148 A149 A153 D154L147-H151 WeakPolarHBondContact O-CB 3.38Å; L147-H151 PolarHBondContact O-CD2 3.21Å; L147-H151 VanDerWaalsContact O-CG 3.25Å; L147-H151 PolarHBondContact O-N 3Å; R148-H151 PolarHBondContact O-N 3.4Å; A149-H151 VanDerWaalsContact C-N 3.31Å; A149-H151 PolarHBondContact O-N 3.46Å; H151-A153 VanDerWaalsContact C-N 3.31Å; H151-D154 PolarHBondContact O-N 3.25Å
152S73.8Confident69.4Low70 Ų7087.2 Ų87.249%0.4944%0.437SS..Hα-helixtrans-73.7-24.9176.161.90000113.3R148 A149 D154R148-S152 WeakPolarHBondContact O-CB 3.15Å; R148-S152 PolarHBondContact O-N 2.87Å; R148-S152 PolarHBondContact O-OG 3.38Å; A149-S152 WeakPolarHBondContact CA-OG 3.05Å; A149-S152 PolarHBondContact O-N 2.74Å; A149-S152 PolarHBondContact O-OG 3.26Å; S152-D154 PolarHBondContact O-N 3.3Å
153A62.3Low68.7Low42 Ų4292.2 Ų92.235%0.34746%0.46SS..THydrogen-bonded Turntrans-71.8-3.2176.100000112.1A149 H151 F155A149-A153 WeakPolarHBondContact O-CB 3.47Å; A149-A153 PolarHBondContact O-N 2.98Å; H151-A153 VanDerWaalsContact C-N 3.31Å; A153-F155 HydrophobicContact CB-CD2 4.42Å; A153-F155 PolarHBondContact O-N 3.01Å
154D55.1Low67.9Low134 Ų13496.3 Ų96.372%0.71748%0.481SS*.THydrogen-bonded Turntrans27.459.8-178-83-39.2000110.2H151 S152 P156H151-D154 PolarHBondContact O-N 3.25Å; S152-D154 PolarHBondContact O-N 3.3Å; D154-P156 WeakPolarHBondContact O-CD 3.48Å
155F52.3Low67.3Low104 Ų10498.6 Ų98.646%0.45649%0.49SS..  trans-48.4122.1166.3-93.8-84.2000104.3L150 A153 R157L150-F155 HydrophobicContact CD2-CE2 4.28Å; A153-F155 HydrophobicContact CB-CD2 4.42Å; A153-F155 PolarHBondContact O-N 3.01Å; F155-R157 WeakPolarHBondContact O-CA 3.37Å; F155-R157 WeakPolarHBondContact O-CB 3.18Å; F155-R157 PolarHBondContact O-N 2.79Å
156P55.9Low67.2Low58 Ų5897.5 Ų97.538%0.37749%0.494SS..  trans-67.988.4-168.526.4-33.8000107.4D154 G158 R159 E160D154-P156 WeakPolarHBondContact O-CD 3.48Å; P156-G158 PolarHBondContact O-N 2.98Å; P156-R159 HydrophobicContact CB-CB 3.78Å; P156-R159 HydrophobicContact CB-CG 3.86Å; P156-R159 HydrophobicContact CG-CB 4.16Å; P156-R159 PolarHBondContact O-N 2.59Å; P156-E160 HydrophobicContact CG-CG 4.43Å; P156-E160 PolarHBondContact O-N 2.91Å
157R54.3Low67Low217 Ų21799 Ų9982%0.81950%0.503SS*.THydrogen-bonded Turntrans-66.50.8-164.9-171.8169.1-77.2-110.1-0.2112.6F155F155-R157 WeakPolarHBondContact O-CA 3.37Å; F155-R157 WeakPolarHBondContact O-CB 3.18Å; F155-R157 PolarHBondContact O-N 2.79Å
158G51.5Low66.9Low50 Ų50101.3 Ų101.352%0.51551%0.509SS..THydrogen-bonded Turntrans-131.4-13.5170.300000115.4P156 A162P156-G158 PolarHBondContact O-N 2.98Å; G158-A162 PolarHBondContact O-N 3.39Å
159R52Low67Low174 Ų17494.9 Ų94.966%0.65749%0.493SS*.Hα-helixtrans-77.5-41.8177.5-63.8-166.3-170.8-162.75111.4P156 K161 A162 E163P156-R159 HydrophobicContact CB-CB 3.78Å; P156-R159 HydrophobicContact CB-CG 3.86Å; P156-R159 HydrophobicContact CG-CB 4.16Å; P156-R159 PolarHBondContact O-N 2.59Å; R159-K161 PolarHBondContact O-N 2.91Å; R159-A162 PolarHBondContact O-N 3.42Å; R159-A162 VanDerWaalsContact O-N 3.1Å; R159-E163 WeakPolarHBondContact O-CB 3.13Å; R159-E163 VanDerWaalsContact O-CG 3.31Å; R159-E163 WeakPolarHBondContact O-CG 3.43Å; R159-E163 PolarHBondContact O-N 3.36Å
160E58.6Low67.4Low110 Ų11098.6 Ų98.651%0.51451%0.511SS..Hα-helixtrans-64.2-31.3178-63-169.3-178.500112P156 L164P156-E160 HydrophobicContact CG-CG 4.43Å; P156-E160 PolarHBondContact O-N 2.91Å; E160-L164 WeakPolarHBondContact O-CA 3.26Å; E160-L164 WeakPolarHBondContact O-CB 3.4Å; E160-L164 PolarHBondContact O-N 2.81Å
161K56.6Low68Low164 Ų164103.4 Ų103.471%0.71353%0.527SS*.Hα-helixtrans-69.9-38.8175.2-170.4179.3177.6-175.60111.9R159 L165R159-K161 PolarHBondContact O-N 2.91Å; K161-L165 WeakPolarHBondContact O-CB 3.36Å; K161-L165 PolarHBondContact O-N 3.48Å
162A65.7Low68.8Low61 Ų61104.2 Ų104.250%0.50453%0.529SS..Hα-helixtrans-73.3-40.6177.200000111.7G158 R159 L165 A166G158-A162 PolarHBondContact O-N 3.39Å; R159-A162 PolarHBondContact O-N 3.42Å; R159-A162 VanDerWaalsContact O-N 3.1Å; A162-L165 PolarHBondContact O-N 2.98Å; A162-A166 VanDerWaalsContact O-CB 3.31Å; A162-A166 WeakPolarHBondContact O-CB 3.14Å; A162-A166 PolarHBondContact O-N 3.36Å
163E67.8Low69.6Low117 Ų117102.6 Ų102.655%0.54751%0.514SS..Hα-helixtrans-67-43.2175.2-72.3168.2-166.200111.2R159 L165 A166 E167R159-E163 WeakPolarHBondContact O-CB 3.13Å; R159-E163 VanDerWaalsContact O-CG 3.31Å; R159-E163 WeakPolarHBondContact O-CG 3.43Å; R159-E163 PolarHBondContact O-N 3.36Å; E163-L165 VanDerWaalsContact C-N 3.33Å; E163-L165 PolarHBondContact O-N 3.44Å; E163-A166 PolarHBondContact O-N 2.88Å; E163-E167 VanDerWaalsContact O-CB 3.28Å; E163-E167 WeakPolarHBondContact O-CB 3.36Å; E163-E167 PolarHBondContact O-N 3.31Å
164L72.6Confident71Confident103 Ų103108.3 Ų108.354%0.53953%0.528SS..Hα-helixtrans-66.7-36.1174.7-165.375.8000111.3E160 E167 F168E160-L164 WeakPolarHBondContact O-CA 3.26Å; E160-L164 WeakPolarHBondContact O-CB 3.4Å; E160-L164 PolarHBondContact O-N 2.81Å; L164-E167 PolarHBondContact O-N 3.07Å; L164-F168 HydrophobicContact CD1-CE2 4.31Å; L164-F168 HydrophobicContact CD2-CE2 3.8Å; L164-F168 HydrophobicContact CG-CD2 3.96Å; L164-F168 HydrophobicContact CG-CE2 3.6Å; L164-F168 WeakPolarHBondContact O-CB 3.3Å; L164-F168 WeakPolarHBondContact O-CD2 3.46Å; L164-F168 WeakPolarHBondContact O-CG 3.25Å; L164-F168 PolarHBondContact O-N 2.84Å
165L78.1Confident72.9Confident114 Ų114103.7 Ų103.760%0.59751%0.512SS*.Hα-helixtrans-70.4-36.9175-166.667.8000111.9K161 A162 E163 E167 F168 A169K161-L165 WeakPolarHBondContact O-CB 3.36Å; K161-L165 PolarHBondContact O-N 3.48Å; A162-L165 PolarHBondContact O-N 2.98Å; E163-L165 VanDerWaalsContact C-N 3.33Å; E163-L165 PolarHBondContact O-N 3.44Å; L165-E167 VanDerWaalsContact C-N 3.33Å; L165-F168 PolarHBondContact O-N 3.35Å; L165-A169 WeakPolarHBondContact O-CB 3.41Å; L165-A169 PolarHBondContact O-N 3.38Å
166A78.9Confident74.9Confident49 Ų49101.3 Ų101.341%0.40550%0.5SS..Hα-helixtrans-64.3-40.7171.400000110.9A162 E163 A169 N170A162-A166 VanDerWaalsContact O-CB 3.31Å; A162-A166 WeakPolarHBondContact O-CB 3.14Å; A162-A166 PolarHBondContact O-N 3.36Å; E163-A166 PolarHBondContact O-N 2.88Å; A166-A169 CarbonylContact O-C 3.59Å; A166-A169 WeakPolarHBondContact O-CB 3.29Å; A166-A169 PolarHBondContact O-N 3.33Å; A166-N170 PolarHBondContact O-N 3.37Å; A166-N170 PolarHBondContact O-ND2 3.28Å; A166-N170 PolarHBondContact O-OD1 2.99Å
167E78.6Confident76.8Confident81 Ų81103.2 Ų103.238%0.37950%0.504SS..Hα-helixtrans-65.6-43.2175.3-174.362.5-166.700111.7E163 L164 L165 A169 N170 Y171E163-E167 VanDerWaalsContact O-CB 3.28Å; E163-E167 WeakPolarHBondContact O-CB 3.36Å; E163-E167 PolarHBondContact O-N 3.31Å; L164-E167 PolarHBondContact O-N 3.07Å; L165-E167 VanDerWaalsContact C-N 3.33Å; E167-A169 VanDerWaalsContact C-N 3.32Å; E167-A169 PolarHBondContact O-N 3.02Å; E167-N170 WeakPolarHBondContact O-CB 3.46Å; E167-N170 PolarHBondContact O-N 2.75Å; E167-N170 VanDerWaalsContact O-N 3.15Å; E167-Y171 HydrophobicContact CG-CD2 4.2Å; E167-Y171 HydrophobicContact CG-CE2 3.61Å; E167-Y171 WeakPolarHBondContact O-CD2 3.23Å; E167-Y171 PolarHBondContact O-N 3.43Å; E167-Y171 WeakPolarHBondContact OE1-CE2 3.21Å; E167-Y171 VanDerWaalsContact OE1-CZ 3.25Å; E167-Y171 PolarHBondContact OE1-OH 3.19Å
168F82.7Confident78.8Confident127 Ų12796.2 Ų96.256%0.55748%0.48SS*.Hα-helixtrans-61.9-38.7171-80.1-60.2000112.6L164 L165 N170 Y171 F172L164-F168 HydrophobicContact CD1-CE2 4.31Å; L164-F168 HydrophobicContact CD2-CE2 3.8Å; L164-F168 HydrophobicContact CG-CD2 3.96Å; L164-F168 HydrophobicContact CG-CE2 3.6Å; L164-F168 WeakPolarHBondContact O-CB 3.3Å; L164-F168 WeakPolarHBondContact O-CD2 3.46Å; L164-F168 WeakPolarHBondContact O-CG 3.25Å; L164-F168 PolarHBondContact O-N 2.84Å; L165-F168 PolarHBondContact O-N 3.35Å; F168-N170 VanDerWaalsContact C-N 3.32Å; F168-Y171 PolarHBondContact O-N 3.45Å; F168-F172 PolarHBondContact O-N 3.29Å
169A83.6Confident80.9Confident38 Ų3897.7 Ų97.731%0.31448%0.482SS..Hα-helixtrans-63.1-41173.300000110.8L165 A166 E167 Y171 F172 H173L165-A169 WeakPolarHBondContact O-CB 3.41Å; L165-A169 PolarHBondContact O-N 3.38Å; A166-A169 CarbonylContact O-C 3.59Å; A166-A169 WeakPolarHBondContact O-CB 3.29Å; A166-A169 PolarHBondContact O-N 3.33Å; E167-A169 VanDerWaalsContact C-N 3.32Å; E167-A169 PolarHBondContact O-N 3.02Å; A169-Y171 PolarHBondContact O-N 2.94Å; A169-F172 PolarHBondContact O-N 3.23Å; A169-H173 WeakPolarHBondContact O-CB 3.41Å; A169-H173 PolarHBondContact O-CD2 3.44Å; A169-H173 PolarHBondContact O-N 2.9Å
170N85.2Confident83Confident92 Ų9290.6 Ų90.649%0.49246%0.456SS..Hα-helixtrans-61.2-43.7175.4-66.2-28000111.7A166 E167 F168 H173 Y174A166-N170 PolarHBondContact O-N 3.37Å; A166-N170 PolarHBondContact O-ND2 3.28Å; A166-N170 PolarHBondContact O-OD1 2.99Å; E167-N170 WeakPolarHBondContact O-CB 3.46Å; E167-N170 PolarHBondContact O-N 2.75Å; E167-N170 VanDerWaalsContact O-N 3.15Å; F168-N170 VanDerWaalsContact C-N 3.32Å; N170-H173 PolarHBondContact O-N 3.06Å; N170-Y174 WeakPolarHBondContact O-CB 3.3Å; N170-Y174 PolarHBondContact O-N 3.49Å
171Y88.9Confident84.8Confident145 Ų14590.7 Ų90.757%0.56946%0.455SS*.Hα-helixtrans-63.6-42.1175.1-74.8-62.6000112.8E167 F168 A169 Y174 G175E167-Y171 HydrophobicContact CG-CD2 4.2Å; E167-Y171 HydrophobicContact CG-CE2 3.61Å; E167-Y171 WeakPolarHBondContact O-CD2 3.23Å; E167-Y171 PolarHBondContact O-N 3.43Å; E167-Y171 WeakPolarHBondContact OE1-CE2 3.21Å; E167-Y171 VanDerWaalsContact OE1-CZ 3.25Å; E167-Y171 PolarHBondContact OE1-OH 3.19Å; F168-Y171 PolarHBondContact O-N 3.45Å; A169-Y171 PolarHBondContact O-N 2.94Å; Y171-Y174 PolarHBondContact O-N 2.95Å; Y171-G175 PolarHBondContact O-N 3.35Å
172F90.5Very high86.8Confident139 Ų13987.1 Ų87.161%0.6144%0.444SS*.Hα-helixtrans-60.5-47.9175.2174.6-93.6000111.1F168 A169 Y174 G175 Y176F168-F172 PolarHBondContact O-N 3.29Å; A169-F172 PolarHBondContact O-N 3.23Å; F172-Y174 PolarHBondContact O-N 2.86Å; F172-G175 PolarHBondContact O-N 3.36Å; F172-Y176 WeakPolarHBondContact O-CB 2.81Å; F172-Y176 PolarHBondContact O-N 3.3Å
173H91Very high88.3Confident35 Ų3587.2 Ų87.216%0.16244%0.435CS..Hα-helixtrans-60.5-45.9177.3-77.3-60.4000111.2A169 N170 G175 Y176 H177 G214A169-H173 WeakPolarHBondContact O-CB 3.41Å; A169-H173 PolarHBondContact O-CD2 3.44Å; A169-H173 PolarHBondContact O-N 2.9Å; N170-H173 PolarHBondContact O-N 3.06Å; H173-G175 PolarHBondContact O-N 2.91Å; H173-Y176 WeakPolarHBondContact O-CB 3.24Å; H173-Y176 PolarHBondContact O-N 3.33Å; H173-H177 PolarHBondContact O-N 3.36Å; H173-H177 PolarHBondContact O-ND1 2.86Å; H173-G214 PolarHBondContact NE2-O 2.96Å
174Y91.3Very high89.7Confident163 Ų16383.3 Ų83.364%0.63942%0.42SS*.Hα-helixtrans-58.4-49.4177-176.6-97.1000111.7N170 Y171 F172 Y176 H177 E178N170-Y174 WeakPolarHBondContact O-CB 3.3Å; N170-Y174 PolarHBondContact O-N 3.49Å; Y171-Y174 PolarHBondContact O-N 2.95Å; F172-Y174 PolarHBondContact O-N 2.86Å; Y174-Y176 VanDerWaalsContact C-N 3.31Å; Y174-Y176 PolarHBondContact O-N 3.39Å; Y174-H177 PolarHBondContact O-N 3.4Å; Y174-E178 PolarHBondContact O-N 3.25Å
175G94.3Very high90.8Very high37 Ų3783.8 Ų83.838%0.38142%0.419SS..Hα-helixtrans-62.3-3717700000113.1Y171 F172 H173 E178 C179Y171-G175 PolarHBondContact O-N 3.35Å; F172-G175 PolarHBondContact O-N 3.36Å; H173-G175 PolarHBondContact O-N 2.91Å; G175-E178 PolarHBondContact O-N 2.64Å; G175-C179 WeakPolarHBondContact O-CB 3.39Å; G175-C179 PolarHBondContact O-N 3.01Å
176Y95.3Very high91.8Very high53 Ų5383.2 Ų83.221%0.20841%0.409CS..Hα-helixtrans-64.1-45.6175.7-172.2-88.4000111.9F172 H173 Y174 E178 C179 M180 L207 A211F172-Y176 WeakPolarHBondContact O-CB 2.81Å; F172-Y176 PolarHBondContact O-N 3.3Å; H173-Y176 WeakPolarHBondContact O-CB 3.24Å; H173-Y176 PolarHBondContact O-N 3.33Å; Y174-Y176 VanDerWaalsContact C-N 3.31Å; Y174-Y176 PolarHBondContact O-N 3.39Å; Y176-E178 VanDerWaalsContact C-N 3.34Å; Y176-C179 WeakPolarHBondContact O-CB 3.43Å; Y176-C179 PolarHBondContact O-N 3.47Å; Y176-M180 WeakPolarHBondContact O-CB 3.41Å; Y176-M180 PolarHBondContact O-N 3.35Å; Y176-L207 WeakPolarHBondContact OH-CA 3.39Å; Y176-L207 VanDerWaalsContact OH-CD2 3.28Å; Y176-L207 WeakPolarHBondContact OH-CD2 3.42Å; Y176-L207 PolarHBondContact OH-O 2.89Å; Y176-A211 HydrophobicContact CD1-CB 4.06Å; Y176-A211 HydrophobicContact CE1-CB 3.84Å
177H95.1Very high92.6Very high98 Ų9881.7 Ų81.745%0.45439%0.394SS..Hα-helixtrans-65.2-39.3177.6-73.486.8000111.7H173 Y174 M180 K181H173-H177 PolarHBondContact O-N 3.36Å; H173-H177 PolarHBondContact O-ND1 2.86Å; Y174-H177 PolarHBondContact O-N 3.4Å; H177-M180 PolarHBondContact O-N 2.93Å; H177-K181 PolarHBondContact O-N 3.42Å
178E96.5Very high93.4Very high71 Ų7180.3 Ų80.333%0.33239%0.391SS..Hα-helixtrans-66.2-40.8177.5-162.765.5-176.900111.5Y174 G175 Y176 K181 N182Y174-E178 PolarHBondContact O-N 3.25Å; G175-E178 PolarHBondContact O-N 2.64Å; Y176-E178 VanDerWaalsContact C-N 3.34Å; E178-K181 VanDerWaalsContact CD-CE 3.48Å; E178-K181 VanDerWaalsContact CD-NZ 3.3Å; E178-K181 PolarHBondContact O-N 2.87Å; E178-K181 WeakPolarHBondContact OE1-CE 3.5Å; E178-K181 IonicContact OE1-NZ 2.71Å; E178-K181 PolarHBondContact OE1-NZ 3.4Å; E178-K181 VanDerWaalsContact OE2-CE 3.25Å; E178-K181 WeakPolarHBondContact OE2-CE 3.31Å; E178-K181 IonicContact OE2-NZ 3.24Å; E178-K181 PolarHBondContact OE2-NZ 2.88Å; E178-N182 PolarHBondContact O-N 3.25Å; E178-N182 PolarHBondContact O-ND2 3.5Å; E178-N182 VanDerWaalsContact O-ND2 3.16Å
179C96.5Very high94.1Very high81 Ų8177.3 Ų77.355%0.54738%0.383SS..Hα-helixtrans-60.1-46.7171.5-179.20000111.8G175 Y176 K181 N182 L183G175-C179 WeakPolarHBondContact O-CB 3.39Å; G175-C179 PolarHBondContact O-N 3.01Å; Y176-C179 WeakPolarHBondContact O-CB 3.43Å; Y176-C179 PolarHBondContact O-N 3.47Å; C179-K181 PolarHBondContact O-N 2.85Å; C179-N182 PolarHBondContact O-N 3.49Å; C179-L183 PolarHBondContact O-N 3.39Å
180M96.3Very high94.7Very high24 Ų2479.7 Ų79.712%0.11839%0.394CS..Hα-helixtrans-60.8-42.9178.2-177.4179.4163.800111.8Y176 H177 L183 V184 L204 L207 Q208Y176-M180 WeakPolarHBondContact O-CB 3.41Å; Y176-M180 PolarHBondContact O-N 3.35Å; H177-M180 PolarHBondContact O-N 2.93Å; M180-L183 PolarHBondContact O-N 2.87Å; M180-V184 WeakPolarHBondContact O-CG2 3.34Å; M180-V184 PolarHBondContact O-N 2.96Å; M180-L204 HydrophobicContact CE-CD1 3.31Å; M180-L204 HydrophobicContact CE-CG 4.19Å; M180-L207 HydrophobicContact CE-CB 4.26Å; M180-L207 HydrophobicContact CG-CB 4.12Å; M180-L207 HydrophobicContact CG-CD1 4.1Å; M180-L207 HydrophobicContact SD-CB 3.88Å; M180-Q208 HydrophobicContact CE-CG 3.39Å; M180-Q208 HydrophobicContact SD-CG 4.46Å
181K95.9Very high95.3Very high113 Ų11380.4 Ų80.449%0.49140%0.395SS..Hα-helixtrans-60.7-46.2174.5-176.9-166.158164.80111.4H177 E178 C179 L183 V184 H185H177-K181 PolarHBondContact O-N 3.42Å; E178-K181 VanDerWaalsContact CD-CE 3.48Å; E178-K181 VanDerWaalsContact CD-NZ 3.3Å; E178-K181 PolarHBondContact O-N 2.87Å; E178-K181 WeakPolarHBondContact OE1-CE 3.5Å; E178-K181 IonicContact OE1-NZ 2.71Å; E178-K181 PolarHBondContact OE1-NZ 3.4Å; E178-K181 VanDerWaalsContact OE2-CE 3.25Å; E178-K181 WeakPolarHBondContact OE2-CE 3.31Å; E178-K181 IonicContact OE2-NZ 3.24Å; E178-K181 PolarHBondContact OE2-NZ 2.88Å; C179-K181 PolarHBondContact O-N 2.85Å; K181-L183 VanDerWaalsContact C-N 3.31Å; K181-L183 PolarHBondContact O-N 3.35Å; K181-V184 PolarHBondContact O-N 2.85Å; K181-H185 WeakPolarHBondContact O-CB 3.37Å; K181-H185 PolarHBondContact O-N 3.35Å
182N97.5Very high95.6Very high88 Ų8883.5 Ų83.547%0.47141%0.405SS..Hα-helixtrans-62.5-39.2178.2-74.8-33.1000112E178 C179 H185 Y186E178-N182 PolarHBondContact O-N 3.25Å; E178-N182 PolarHBondContact O-ND2 3.5Å; E178-N182 VanDerWaalsContact O-ND2 3.16Å; C179-N182 PolarHBondContact O-N 3.49Å; N182-H185 PolarHBondContact O-N 3.41Å; N182-Y186 WeakPolarHBondContact O-CB 3.38Å; N182-Y186 PolarHBondContact O-N 3.1Å
183L97.4Very high95.9Very high63 Ų6378 Ų7833%0.3338%0.382SS..Hα-helixtrans-65.8-45175.4-178.959.5000111.5C179 M180 K181 H185 Y186 L187 I203 L207C179-L183 PolarHBondContact O-N 3.39Å; M180-L183 PolarHBondContact O-N 2.87Å; K181-L183 VanDerWaalsContact C-N 3.31Å; K181-L183 PolarHBondContact O-N 3.35Å; L183-H185 VanDerWaalsContact C-N 3.28Å; L183-H185 PolarHBondContact O-N 3.03Å; L183-Y186 PolarHBondContact O-N 3.47Å; L183-L187 HydrophobicContact CD1-CD1 4.38Å; L183-L187 HydrophobicContact CD1-CG 4.19Å; L183-L187 HydrophobicContact CG-CD1 4.19Å; L183-L187 HydrophobicContact CG-CG 4.42Å; L183-L187 WeakPolarHBondContact O-CB 3.29Å; L183-L187 VanDerWaalsContact O-CG 3.26Å; L183-L187 WeakPolarHBondContact O-CG 3.31Å; L183-L187 PolarHBondContact O-N 3.46Å; L183-I203 HydrophobicContact CD2-CG2 4.29Å; L183-L207 HydrophobicContact CD2-CD1 3.62Å
184V96.8Very high96Very high36 Ų3683 Ų8322%0.21841%0.405CS..Hα-helixtrans-58.9-42.9174.8167.80000111.2M180 K181 L187 T188 Y200 L204M180-V184 WeakPolarHBondContact O-CG2 3.34Å; M180-V184 PolarHBondContact O-N 2.96Å; K181-V184 PolarHBondContact O-N 2.85Å; V184-L187 PolarHBondContact O-N 3.39Å; V184-T188 WeakPolarHBondContact O-CG2 3.38Å; V184-T188 PolarHBondContact O-N 2.92Å; V184-T188 VanDerWaalsContact O-N 3.08Å; V184-T188 PolarHBondContact O-OG1 3.3Å; V184-Y200 HydrophobicContact CG1-CE2 4.38Å; V184-Y200 WeakPolarHBondContact CG1-OH 3.39Å; V184-L204 HydrophobicContact CG2-CD1 3.62Å
185H97.1Very high96Very high113 Ų11379.9 Ų79.952%0.52340%0.403SS..Hα-helixtrans-60-51.4175.1-175.476000111.1K181 N182 L183 L187 T188 T189K181-H185 WeakPolarHBondContact O-CB 3.37Å; K181-H185 PolarHBondContact O-N 3.35Å; N182-H185 PolarHBondContact O-N 3.41Å; L183-H185 VanDerWaalsContact C-N 3.28Å; L183-H185 PolarHBondContact O-N 3.03Å; H185-L187 VanDerWaalsContact C-N 3.34Å; H185-L187 PolarHBondContact O-N 2.81Å; H185-T188 PolarHBondContact O-N 3.34Å; H185-T188 VanDerWaalsContact O-N 3.16Å; H185-T188 PolarHBondContact O-OG1 3.36Å; H185-T188 VanDerWaalsContact O-OG1 3.07Å; H185-T189 VanDerWaalsContact CE1-CG2 3.42Å; H185-T189 WeakPolarHBondContact CE1-CG2 3.45Å; H185-T189 PolarHBondContact NE2-OG1 3.1Å; H185-T189 PolarHBondContact O-N 2.85Å; H185-T189 PolarHBondContact O-OG1 3.23Å
186Y97.7Very high96Very high102 Ų10286.9 Ų86.940%0.442%0.423SS..Hα-helixtrans-55.5-47.2177.3176.5-92000112.4N182 L183 T188 V190 E191N182-Y186 WeakPolarHBondContact O-CB 3.38Å; N182-Y186 PolarHBondContact O-N 3.1Å; L183-Y186 PolarHBondContact O-N 3.47Å; Y186-T188 VanDerWaalsContact C-N 3.27Å; Y186-T188 PolarHBondContact O-N 3.31Å; Y186-V190 HydrophobicContact CD2-CB 3.69Å; Y186-V190 HydrophobicContact CD2-CG1 4.05Å; Y186-V190 HydrophobicContact CD2-CG2 3.71Å; Y186-V190 HydrophobicContact CE2-CB 3.69Å; Y186-V190 HydrophobicContact CE2-CG1 3.52Å; Y186-V190 HydrophobicContact CE2-CG2 4.06Å; Y186-V190 HydrophobicContact CG-CB 4.28Å; Y186-V190 HydrophobicContact CG-CG2 4.46Å; Y186-V190 WeakPolarHBondContact O-CA 3.4Å; Y186-V190 WeakPolarHBondContact O-CB 3.41Å; Y186-V190 PolarHBondContact O-N 2.89Å; Y186-E191 HydrophobicContact CD1-CG 3.95Å; Y186-E191 HydrophobicContact CE1-CG 3.29Å; Y186-E191 WeakPolarHBondContact CE1-OE1 3.48Å; Y186-E191 PolarHBondContact O-N 2.89Å; Y186-E191 PolarHBondContact OH-OE1 3.5Å
187L96.5Very high96Very high17 Ų1787.6 Ų87.69%0.08943%0.43CS..Hα-helixtrans-62.3-34.7-179.3-70.3178.5000112.4L183 V184 H185 E191 R192 M193 Y200 I203L183-L187 HydrophobicContact CD1-CD1 4.38Å; L183-L187 HydrophobicContact CD1-CG 4.19Å; L183-L187 HydrophobicContact CG-CD1 4.19Å; L183-L187 HydrophobicContact CG-CG 4.42Å; L183-L187 WeakPolarHBondContact O-CB 3.29Å; L183-L187 VanDerWaalsContact O-CG 3.26Å; L183-L187 WeakPolarHBondContact O-CG 3.31Å; L183-L187 PolarHBondContact O-N 3.46Å; V184-L187 PolarHBondContact O-N 3.39Å; H185-L187 VanDerWaalsContact C-N 3.34Å; H185-L187 PolarHBondContact O-N 2.81Å; L187-E191 HydrophobicContact CD2-CG 4.41Å; L187-R192 PolarHBondContact O-N 3.48Å; L187-M193 HydrophobicContact CB-CE 3.98Å; L187-M193 HydrophobicContact CD1-CE 3.79Å; L187-M193 HydrophobicContact CD2-CE 3.74Å; L187-M193 HydrophobicContact CG-CE 4.03Å; L187-M193 VanDerWaalsContact O-CB 3.3Å; L187-M193 WeakPolarHBondContact O-CB 3.45Å; L187-M193 PolarHBondContact O-N 2.91Å; L187-Y200 HydrophobicContact CB-CD2 4.41Å; L187-Y200 HydrophobicContact CD1-CD2 4.37Å; L187-I203 HydrophobicContact CD1-CD1 4.37Å; L187-I203 HydrophobicContact CD1-CG2 4.28Å
188T96Very high96.1Very high51 Ų5187.4 Ų87.431%0.31344%0.436SS..Hα-helixtrans-89.5-33.1-176.851.90000113.4V184 H185 Y186 R192 Y200V184-T188 WeakPolarHBondContact O-CG2 3.38Å; V184-T188 PolarHBondContact O-N 2.92Å; V184-T188 VanDerWaalsContact O-N 3.08Å; V184-T188 PolarHBondContact O-OG1 3.3Å; H185-T188 PolarHBondContact O-N 3.34Å; H185-T188 VanDerWaalsContact O-N 3.16Å; H185-T188 PolarHBondContact O-OG1 3.36Å; H185-T188 VanDerWaalsContact O-OG1 3.07Å; Y186-T188 VanDerWaalsContact C-N 3.27Å; Y186-T188 PolarHBondContact O-N 3.31Å; T188-R192 WeakPolarHBondContact O-CA 3.46Å; T188-Y200 HydrophobicContact CG2-CE2 3.91Å
189T96.7Very high96Very high64 Ų6489.6 Ų89.639%0.39345%0.445SS..Hα-helixtrans-100.5-40.4-174.865.10000113.6H185H185-T189 VanDerWaalsContact CE1-CG2 3.42Å; H185-T189 WeakPolarHBondContact CE1-CG2 3.45Å; H185-T189 PolarHBondContact NE2-OG1 3.1Å; H185-T189 PolarHBondContact O-N 2.85Å; H185-T189 PolarHBondContact O-OG1 3.23Å
190V97.1Very high96Very high88 Ų8887.1 Ų87.153%0.53342%0.424SS..THydrogen-bonded Turntrans-89.5-56.2-177.3-176.20000110.4Y186 R192Y186-V190 HydrophobicContact CD2-CB 3.69Å; Y186-V190 HydrophobicContact CD2-CG1 4.05Å; Y186-V190 HydrophobicContact CD2-CG2 3.71Å; Y186-V190 HydrophobicContact CE2-CB 3.69Å; Y186-V190 HydrophobicContact CE2-CG1 3.52Å; Y186-V190 HydrophobicContact CE2-CG2 4.06Å; Y186-V190 HydrophobicContact CG-CB 4.28Å; Y186-V190 HydrophobicContact CG-CG2 4.46Å; Y186-V190 WeakPolarHBondContact O-CA 3.4Å; Y186-V190 WeakPolarHBondContact O-CB 3.41Å; Y186-V190 PolarHBondContact O-N 2.89Å; V190-R192 PolarHBondContact O-N 2.8Å
191E96.1Very high95.9Very high108 Ų10888.4 Ų88.451%0.50544%0.439SS..SBendtrans-74.9-15.8178-67.6-75.315500112.4Y186 L187 M193Y186-E191 HydrophobicContact CD1-CG 3.95Å; Y186-E191 HydrophobicContact CE1-CG 3.29Å; Y186-E191 WeakPolarHBondContact CE1-OE1 3.48Å; Y186-E191 PolarHBondContact O-N 2.89Å; Y186-E191 PolarHBondContact OH-OE1 3.5Å; L187-E191 HydrophobicContact CD2-CG 4.41Å; E191-M193 PolarHBondContact O-N 3.05Å; E191-M193 VanDerWaalsContact O-N 3.16Å
192R95.9Very high96Very high209 Ų20991.3 Ų91.379%0.78945%0.446SS*.  trans52.233.8-177.2-58.7-177.3178.3-112.40.3113.1L187 T188 V190L187-R192 PolarHBondContact O-N 3.48Å; T188-R192 WeakPolarHBondContact O-CA 3.46Å; V190-R192 PolarHBondContact O-N 2.8Å
193M96.2Very high95.9Very high25 Ų2589.6 Ų89.612%0.12344%0.437CS..  trans-71.5133.5177.8-167.1162.160.400109.8L187 E191 D197 K199 Y200L187-M193 HydrophobicContact CB-CE 3.98Å; L187-M193 HydrophobicContact CD1-CE 3.79Å; L187-M193 HydrophobicContact CD2-CE 3.74Å; L187-M193 HydrophobicContact CG-CE 4.03Å; L187-M193 VanDerWaalsContact O-CB 3.3Å; L187-M193 WeakPolarHBondContact O-CB 3.45Å; L187-M193 PolarHBondContact O-N 2.91Å; E191-M193 PolarHBondContact O-N 3.05Å; E191-M193 VanDerWaalsContact O-N 3.16Å; M193-D197 HydrophobicContact CG-CB 3.89Å; M193-D197 HydrophobicContact SD-CB 4.49Å; M193-K199 HydrophobicContact SD-CB 4.12Å; M193-K199 HydrophobicContact SD-CD 3.95Å; M193-K199 HydrophobicContact SD-CG 4.16Å; M193-Y200 HydrophobicContact CE-CD2 3.94Å; M193-Y200 HydrophobicContact CE-CG 4.33Å
194E93.6Very high95.8Very high140 Ų14088.5 Ų88.565%0.65443%0.431SS*.  trans-70.8145.8178.4-68.9-169.1172.700111.6K196 D197E194-K196 PolarHBondContact O-N 2.91Å; E194-D197 WeakPolarHBondContact O-CB 3.3Å; E194-D197 PolarHBondContact O-N 3.19Å
195T91.9Very high95.7Very high96 Ų9689.2 Ų89.259%0.58944%0.441SS*.THydrogen-bonded Turntrans-67.8-18.4177.453.50000113.4D197 Y200T195-D197 VanDerWaalsContact C-N 3.3Å; T195-Y200 HydrophobicContact CG2-CE1 4.24Å
196K93.3Very high95.6Very high184 Ų18489.5 Ų89.580%0.844%0.441SS*.THydrogen-bonded Turntrans-82.3-7.9173.2-62.6179.5-178174.60112.8E194 T198E194-K196 PolarHBondContact O-N 2.91Å; K196-T198 PolarHBondContact O-N 3.07Å
197D96.4Very high95.5Very high68 Ų6885.9 Ų85.936%0.36443%0.428SS..  trans-66.7128.5-179.5-166.6-46.7000110.5M193 E194 T195 K199 Y200 A201M193-D197 HydrophobicContact CG-CB 3.89Å; M193-D197 HydrophobicContact SD-CB 4.49Å; E194-D197 WeakPolarHBondContact O-CB 3.3Å; E194-D197 PolarHBondContact O-N 3.19Å; T195-D197 VanDerWaalsContact C-N 3.3Å; D197-K199 PolarHBondContact O-N 3.01Å; D197-K199 WeakPolarHBondContact OD1-CB 3.44Å; D197-K199 PolarHBondContact OD1-N 3.36Å; D197-Y200 WeakPolarHBondContact O-CB 3.32Å; D197-Y200 PolarHBondContact O-N 3.23Å; D197-A201 PolarHBondContact O-N 3.2Å
198T96.3Very high95.3Very high95 Ų9589.8 Ų89.858%0.58345%0.446SS*.Hα-helixtrans-57.2-31.7177.2-50.80000112.3K196 R202K196-T198 PolarHBondContact O-N 3.07Å; T198-R202 WeakPolarHBondContact O-CB 3.41Å; T198-R202 VanDerWaalsContact O-CG 3.26Å; T198-R202 WeakPolarHBondContact O-CG 3.42Å; T198-R202 PolarHBondContact O-N 2.92Å; T198-R202 PolarHBondContact O-NE 3.34Å
199K93.8Very high95.1Very high116 Ų11690.1 Ų90.150%0.50445%0.45SS..Hα-helixtrans-67.9-45.9174.6-174.9-177.9175.4-170.50111.1M193 D197 A201 R202 I203M193-K199 HydrophobicContact SD-CB 4.12Å; M193-K199 HydrophobicContact SD-CD 3.95Å; M193-K199 HydrophobicContact SD-CG 4.16Å; D197-K199 PolarHBondContact O-N 3.01Å; D197-K199 WeakPolarHBondContact OD1-CB 3.44Å; D197-K199 PolarHBondContact OD1-N 3.36Å; K199-A201 PolarHBondContact O-N 2.9Å; K199-R202 PolarHBondContact O-N 2.9Å; K199-I203 HydrophobicContact CG-CD1 3.89Å; K199-I203 VanDerWaalsContact O-CG1 3.29Å; K199-I203 WeakPolarHBondContact O-CG1 3.31Å; K199-I203 PolarHBondContact O-N 3.09Å
200Y96.6Very high94.6Very high30 Ų3092.2 Ų92.212%0.11845%0.454CS..Hα-helixtrans-56.1-52174.9-179.4-96.4000110.8V184 L187 T188 M193 T195 D197 R202 I203 L204V184-Y200 HydrophobicContact CG1-CE2 4.38Å; V184-Y200 WeakPolarHBondContact CG1-OH 3.39Å; L187-Y200 HydrophobicContact CB-CD2 4.41Å; L187-Y200 HydrophobicContact CD1-CD2 4.37Å; T188-Y200 HydrophobicContact CG2-CE2 3.91Å; M193-Y200 HydrophobicContact CE-CD2 3.94Å; M193-Y200 HydrophobicContact CE-CG 4.33Å; T195-Y200 HydrophobicContact CG2-CE1 4.24Å; D197-Y200 WeakPolarHBondContact O-CB 3.32Å; D197-Y200 PolarHBondContact O-N 3.23Å; Y200-R202 PolarHBondContact O-N 3.5Å; Y200-I203 PolarHBondContact O-N 3.34Å; Y200-L204 HydrophobicContact CE1-CD2 4.12Å; Y200-L204 WeakPolarHBondContact O-CB 3.25Å; Y200-L204 PolarHBondContact O-N 2.86Å
201A96Very high94.1Very high51 Ų5188.7 Ų88.742%0.42143%0.434SS..Hα-helixtrans-59.8-43.8-179.500000112.3D197 K199 L204 A205D197-A201 PolarHBondContact O-N 3.2Å; K199-A201 PolarHBondContact O-N 2.9Å; A201-L204 PolarHBondContact O-N 3.05Å; A201-A205 VanDerWaalsContact O-CB 3.24Å; A201-A205 WeakPolarHBondContact O-CB 3.37Å; A201-A205 PolarHBondContact O-N 3.39Å
202R96.9Very high93Very high174 Ų17493.3 Ų93.366%0.65745%0.447SS*.Hα-helixtrans-65.2-42.2178.7-77.7-171.6-66.8-178.5-0.7112.9T198 K199 Y200 F206T198-R202 WeakPolarHBondContact O-CB 3.41Å; T198-R202 VanDerWaalsContact O-CG 3.26Å; T198-R202 WeakPolarHBondContact O-CG 3.42Å; T198-R202 PolarHBondContact O-N 2.92Å; T198-R202 PolarHBondContact O-NE 3.34Å; K199-R202 PolarHBondContact O-N 2.9Å; Y200-R202 PolarHBondContact O-N 3.5Å; R202-F206 WeakPolarHBondContact O-CB 3.39Å; R202-F206 PolarHBondContact O-N 3.14Å
203I95.9Very high91.5Very high52 Ų5289.2 Ų89.227%0.26744%0.44SS..Hα-helixtrans-64.4-46.6178.1-68.1166.9000110.1L183 L187 K199 Y200 F206 L207L183-I203 HydrophobicContact CD2-CG2 4.29Å; L187-I203 HydrophobicContact CD1-CD1 4.37Å; L187-I203 HydrophobicContact CD1-CG2 4.28Å; K199-I203 HydrophobicContact CG-CD1 3.89Å; K199-I203 VanDerWaalsContact O-CG1 3.29Å; K199-I203 WeakPolarHBondContact O-CG1 3.31Å; K199-I203 PolarHBondContact O-N 3.09Å; Y200-I203 PolarHBondContact O-N 3.34Å; I203-F206 PolarHBondContact O-N 3.38Å; I203-L207 HydrophobicContact CG2-CD1 3.9Å; I203-L207 WeakPolarHBondContact O-CG 3.39Å; I203-L207 PolarHBondContact O-N 2.8Å
204L94.6Very high89.5Confident39 Ų3990.1 Ų90.120%0.20446%0.456CS..Hα-helixtrans-64-45.9-179.4-169.170000111.6M180 V184 Y200 A201 F206 L207 Q208M180-L204 HydrophobicContact CE-CD1 3.31Å; M180-L204 HydrophobicContact CE-CG 4.19Å; V184-L204 HydrophobicContact CG2-CD1 3.62Å; Y200-L204 HydrophobicContact CE1-CD2 4.12Å; Y200-L204 WeakPolarHBondContact O-CB 3.25Å; Y200-L204 PolarHBondContact O-N 2.86Å; A201-L204 PolarHBondContact O-N 3.05Å; L204-F206 VanDerWaalsContact C-N 3.31Å; L204-F206 PolarHBondContact O-N 3.33Å; L204-L207 PolarHBondContact O-N 3.19Å; L204-Q208 WeakPolarHBondContact O-CB 3.33Å; L204-Q208 VanDerWaalsContact O-CG 3.27Å; L204-Q208 WeakPolarHBondContact O-CG 3.46Å; L204-Q208 PolarHBondContact O-N 2.98Å
205A95.2Very high87.5Confident52 Ų5287 Ų8743%0.4345%0.454SS..Hα-helixtrans-60.4-40.8176.700000111.9A201 S209A201-A205 VanDerWaalsContact O-CB 3.24Å; A201-A205 WeakPolarHBondContact O-CB 3.37Å; A201-A205 PolarHBondContact O-N 3.39Å; A205-S209 WeakPolarHBondContact O-CB 3.33Å; A205-S209 PolarHBondContact O-N 3.44Å
206F95.5Very high85Confident118 Ų11890 Ų9052%0.51846%0.461SS..Hα-helixtrans-61.3-49.4175.9173.7-100.7000111.7R202 I203 L204 Q208 S209 K210R202-F206 WeakPolarHBondContact O-CB 3.39Å; R202-F206 PolarHBondContact O-N 3.14Å; I203-F206 PolarHBondContact O-N 3.38Å; L204-F206 VanDerWaalsContact C-N 3.31Å; L204-F206 PolarHBondContact O-N 3.33Å; F206-Q208 PolarHBondContact O-N 3.34Å; F206-S209 PolarHBondContact O-N 3.38Å; F206-S209 PolarHBondContact O-OG 2.91Å; F206-K210 HydrophobicContact CE1-CG 4.38Å; F206-K210 HydrophobicContact CE2-CG 4.21Å; F206-K210 HydrophobicContact CZ-CG 4.07Å; F206-K210 PolarHBondContact O-N 3.27Å
207L94.6Very high82.7Confident26 Ų2685.4 Ų85.414%0.13645%0.45CS..Hα-helixtrans-64.2-41.2-179.6-65.8167.3000111.8Y176 M180 L183 I203 L204 S209 K210 A211Y176-L207 WeakPolarHBondContact OH-CA 3.39Å; Y176-L207 VanDerWaalsContact OH-CD2 3.28Å; Y176-L207 WeakPolarHBondContact OH-CD2 3.42Å; Y176-L207 PolarHBondContact OH-O 2.89Å; M180-L207 HydrophobicContact CE-CB 4.26Å; M180-L207 HydrophobicContact CG-CB 4.12Å; M180-L207 HydrophobicContact CG-CD1 4.1Å; M180-L207 HydrophobicContact SD-CB 3.88Å; L183-L207 HydrophobicContact CD2-CD1 3.62Å; I203-L207 HydrophobicContact CG2-CD1 3.9Å; I203-L207 WeakPolarHBondContact O-CG 3.39Å; I203-L207 PolarHBondContact O-N 2.8Å; L204-L207 PolarHBondContact O-N 3.19Å; L207-S209 VanDerWaalsContact C-N 3.33Å; L207-S209 PolarHBondContact O-N 3.5Å; L207-K210 PolarHBondContact O-N 2.98Å; L207-A211 PolarHBondContact O-N 3.41Å
208Q92.6Very high80.1Confident100 Ų10086.6 Ų86.647%0.46747%0.469SS..Hα-helixtrans-62.6-38.4174.7-71.9175.6-20.600112.5M180 L204 F206 K210 A211M180-Q208 HydrophobicContact CE-CG 3.39Å; M180-Q208 HydrophobicContact SD-CG 4.46Å; L204-Q208 WeakPolarHBondContact O-CB 3.33Å; L204-Q208 VanDerWaalsContact O-CG 3.27Å; L204-Q208 WeakPolarHBondContact O-CG 3.46Å; L204-Q208 PolarHBondContact O-N 2.98Å; F206-Q208 PolarHBondContact O-N 3.34Å; Q208-K210 VanDerWaalsContact C-N 3.26Å; Q208-K210 PolarHBondContact O-N 3.33Å; Q208-A211 PolarHBondContact O-N 2.77Å
209S92.5Very high77.4Confident58 Ų5890.1 Ų90.141%0.40648%0.477SS..Hα-helixtrans-64.2-33.1176.778.70000112.4A205 F206 L207A205-S209 WeakPolarHBondContact O-CB 3.33Å; A205-S209 PolarHBondContact O-N 3.44Å; F206-S209 PolarHBondContact O-N 3.38Å; F206-S209 PolarHBondContact O-OG 2.91Å; L207-S209 VanDerWaalsContact C-N 3.33Å; L207-S209 PolarHBondContact O-N 3.5Å
210K86.1Confident75Confident107 Ų10789.4 Ų89.447%0.46548%0.484SS..Hα-helixtrans-83.4-30-179.6-67.1-59-175.2-177.20113.2F206 L207 Q208 R212 L213F206-K210 HydrophobicContact CE1-CG 4.38Å; F206-K210 HydrophobicContact CE2-CG 4.21Å; F206-K210 HydrophobicContact CZ-CG 4.07Å; F206-K210 PolarHBondContact O-N 3.27Å; L207-K210 PolarHBondContact O-N 2.98Å; Q208-K210 VanDerWaalsContact C-N 3.26Å; Q208-K210 PolarHBondContact O-N 3.33Å; K210-R212 VanDerWaalsContact C-N 3.26Å; K210-R212 PolarHBondContact O-N 3.49Å; K210-L213 HydrophobicContact CD-CD1 4.05Å; K210-L213 PolarHBondContact O-N 2.67Å
211A85.8Confident72.3Confident14 Ų1494 Ų9412%0.11652%0.518CS..Hα-helixtrans-61-34.917300000112.5Y176 L207 Q208Y176-A211 HydrophobicContact CD1-CB 4.06Å; Y176-A211 HydrophobicContact CE1-CB 3.84Å; L207-A211 PolarHBondContact O-N 3.41Å; Q208-A211 PolarHBondContact O-N 2.77Å
212R73.1Confident69.6Low205 Ų205100 Ų10077%0.77454%0.541SS*.Hα-helixtrans-77.8-25.3-177.9-72.6179.7153.6166.8-5.3114.8K210 G214 A215K210-R212 VanDerWaalsContact C-N 3.26Å; K210-R212 PolarHBondContact O-N 3.49Å; R212-G214 PolarHBondContact O-N 2.82Å; R212-A215 PolarHBondContact O-N 2.92Å
213L63.8Low67Low124 Ų12494.1 Ų94.165%0.64954%0.536SS*.THydrogen-bonded Turntrans-72.5-10.6-177.1-79.1165.8000113.9K210K210-L213 HydrophobicContact CD-CD1 4.05Å; K210-L213 PolarHBondContact O-N 2.67Å
214G55.9Low64.5Low44 Ų4497.7 Ų97.745%0.45457%0.565SS.*THydrogen-bonded Turntrans-95.75.7173.100000114.6H173 R212H173-G214 PolarHBondContact NE2-O 2.96Å; R212-G214 PolarHBondContact O-N 2.82Å
215A50.1Low61.6Low74 Ų74103.1 Ų103.161%0.61259%0.593SS**SBendtrans-102.7-6179.400000113.5R212 P217R212-A215 PolarHBondContact O-N 2.92Å; A215-P217 VanDerWaalsContact O-CD 3.28Å; A215-P217 WeakPolarHBondContact O-CD 3.45Å
216E40.7Very low58.8Low158 Ų158105.9 Ų105.974%0.73861%0.607SS**SBendtrans-85.4112.3169.1-92.8-72113.200108.7A218E216-A218 PolarHBondContact O-N 2.73Å
217P44.8Very low55.8Low89 Ų89108 Ų10858%0.57862%0.619SS**  trans-63.4111.6164.127.8-30000106.6A215 F219A215-P217 VanDerWaalsContact O-CD 3.28Å; A215-P217 WeakPolarHBondContact O-CD 3.45Å; P217-F219 PolarHBondContact O-N 3.4Å
218A41.6Very low53.2Low92 Ų92111 Ų11176%0.7664%0.64SS**SBendtrans-6939.6167.200000112E216E216-A218 PolarHBondContact O-N 2.73Å
219F40Very low50.1Low170 Ų170113 Ų11375%0.74665%0.654SS**  trans-131.4103.2167.6-68-74.2000106.7P217P217-F219 PolarHBondContact O-N 3.4Å
220P43.2Very low47.4Very low101 Ų101118.2 Ų118.266%0.65667%0.669SS**  trans-56.9147.1164.525.2-31.6000108.3L222P220-L222 PolarHBondContact O-N 2.95Å
221P38.6Very low44.8Very low126 Ų126117.3 Ų117.382%0.81868%0.676SS**  trans-59.7106.6169.6-13.326.3000107.4G223P221-G223 PolarHBondContact O-N 2.98Å
222L41.1Very low42.4Very low176 Ų176126.5 Ų126.592%0.92171%0.709SS**  trans-72.366.2165.5-77.1170.3000108.1P220P220-L222 PolarHBondContact O-N 2.95Å
223G40.8Very low40.4Very low52 Ų52124.8 Ų124.854%0.53671%0.71SS.*  trans-103.411516300000107.6P221P221-G223 PolarHBondContact O-N 2.98Å
224S44.6Very low39Very low126 Ų126127 Ų12788%0.88172%0.722SS**  trans66.690.3172.664.70000117.8
225L32.9Very low37.8Very low153 Ų153133.4 Ų133.480%0.80174%0.739SS**  trans-131.7131.7144.6-163.4148.4000107.1E227L225-E227 PolarHBondContact O-N 3.15Å
226P37.2Very low37.1Very low111 Ų111134.9 Ų134.972%0.72174%0.743SS**  trans-68.7133.6-17311.7-5000111.2P228P226-P228 WeakPolarHBondContact O-CD 3.38Å
227E32.8Very low36.7Very low162 Ų162132.6 Ų132.676%0.75775%0.751SS**  trans-40.2121.5166.6-101.7-89.5113.300111.7L225 D229L225-E227 PolarHBondContact O-N 3.15Å; E227-D229 PolarHBondContact O-N 3.36Å
228P38.6Very low35.9Very low90 Ų90131.8 Ų131.858%0.58476%0.759SS**  trans-76.4102.5155.429.3-25.6000107.9P226 F230P226-P228 WeakPolarHBondContact O-CD 3.38Å; P228-F230 PolarHBondContact O-N 3.36Å
229D28.4Very low36.2Very low141 Ų141132.7 Ų132.775%0.75476%0.757SS**  trans-45.2103166.1-110.8-29.1000110E227 S231E227-D229 PolarHBondContact O-N 3.36Å; D229-S231 PolarHBondContact O-N 3.49Å; D229-S231 VanDerWaalsContact O-N 3.14Å
230F35Very low35.7Very low168 Ų168134.2 Ų134.274%0.73777%0.766SS**  trans-85.271.3160.5-84.7-82000108.4P228 Y232P228-F230 PolarHBondContact O-N 3.36Å; F230-Y232 PolarHBondContact O-N 2.94Å
231S32.8Very low35.3Very low87 Ų87139 Ų13961%0.60878%0.777SS**  trans-70.6106.1164-174.10000108.5D229 Q233D229-S231 PolarHBondContact O-N 3.49Å; D229-S231 VanDerWaalsContact O-N 3.14Å; S231-Q233 PolarHBondContact O-N 2.63Å
232Y35.2Very low35Very low207 Ų207138 Ų13881%0.81278%0.779SS**  trans-7083.1168-65.3-84.8000109.1F230 L234F230-Y232 PolarHBondContact O-N 2.94Å; Y232-L234 PolarHBondContact O-N 3.22Å
233Q31.1Very low34.4Very low170 Ų170133.2 Ų133.279%0.79477%0.773SS**  trans-71.293.9167-79.2-102.375.500109.2S231 H235S231-Q233 PolarHBondContact O-N 2.63Å; Q233-H235 PolarHBondContact O-N 3.4Å; Q233-H235 VanDerWaalsContact O-N 3.11Å
234L34.3Very low34Very low169 Ų169140 Ų14089%0.88579%0.791SS**  trans-53.6108.3159.1-82.1158.4000108.7Y232Y232-L234 PolarHBondContact O-N 3.22Å
235H30.3Very low33.6Very low179 Ų179139.2 Ų139.283%0.82979%0.785SS**PPolyproline II helixtrans-90.5135.1170.2-150.5-119.6000110.1Q233Q233-H235 PolarHBondContact O-N 3.4Å; Q233-H235 VanDerWaalsContact O-N 3.11Å
236P35.2Very low34.2Very low105 Ų105137.7 Ų137.768%0.68278%0.784SS**PPolyproline II helixtrans-82.1165.6-17520.3-8.5000113
237A31.8Very low33.9Very low110 Ų110136 Ų13691%0.90979%0.787SS**PPolyproline II helixtrans-47.6146-176.900000116.3
238G29.2Very low33.6Very low72 Ų72137.2 Ų137.274%0.74279%0.792SS**  trans-140.2127.7159.300000108.9
239P47Very low33.2Very low111 Ų111137.2 Ų137.272%0.72180%0.8SS**  trans-96.8141.6-168.835.5-28.9000111.1
240E30.2Very low33.3Very low202 Ų202134.9 Ų134.994%0.94480%0.8SS**  trans-147.9142.4149.4-74.9-145.5112.800111.2
241F34.3Very low33.3Very low202 Ų202133.5 Ų133.589%0.88681%0.805SS**  trans-92.1165.3-159.9-94-103.6000114
242A31.2Very low33.5Very low104 Ų104138.7 Ų138.786%0.8682%0.818SS**  trans97122.314400000119.3
243G29.2Very low34.1Very low77 Ų77134.8 Ų134.879%0.79482%0.817SS**  trans157.173159.300000116.9
244H32.9Very low34.2Very low195 Ų195135.8 Ų135.890%0.90382%0.822SS**  trans-37.8158.9158.2-64.2141.5000114.2
245S36.6Very low33.9Very low108 Ų108131.2 Ų131.276%0.75582%0.816SS**  cis-178.7-163.9-5.9-1510000105.3
246P45.7Very low34.2Very low121 Ų121129 Ų12979%0.78682%0.82SS**  -124.5176.9-128.131.6-6.9000117.1
247G29.4Very low34Very low76 Ų76127.6 Ų127.678%0.78483%0.825SS**  trans94149.6157.100000115.9
248E28.1Very low34.2Very low187 Ų187127.2 Ų127.287%0.87482%0.822SS**  cis-164.7154.2-4.7-159.2-174.2140.600106.1
249A29.2Very low34.4Very low91 Ų91127.1 Ų127.175%0.75282%0.821SS**  trans60.2105.1153.900000120.7
250A31.6Very low34Very low91 Ų91127.5 Ų127.575%0.75282%0.823SS**  trans-156106.2133.200000112.3
251V33.1Very low34.2Very low139 Ų139126.4 Ų126.484%0.84282%0.816SS**  trans59.6107.9133-171.90000118.8
252F38.2Very low34.7Very low197 Ų197122.8 Ų122.886%0.86481%0.812SS**  trans-60.9155.5156.4-76.9-87.4000111.4
253P46.7Very low35.5Very low124 Ų124128.3 Ų128.381%0.80581%0.811SS**  -136.6148.3104.631.4-16.1000115.3
254Q33.3Very low36.2Very low192 Ų192130.2 Ų130.290%0.89781%0.809SS**  trans-32.2139.6163.9-166.9175.9-0.900116.3
255G28.9Very low36.7Very low73 Ų73127 Ų12775%0.75381%0.806SS**  trans-177.199.3169.200000113.8
256S36.8Very low36.6Very low132 Ų132125.3 Ų125.392%0.92381%0.805SS**  trans-27.7120.9171.6-47.60000116.6
257G30.6Very low36.4Very low76 Ų76124.6 Ų124.678%0.78481%0.81SS**  trans-121.2105.7172.400000111.6
258A37.1Very low36.8Very low102 Ų102125.3 Ų125.384%0.84381%0.808SS**  trans-64.5127.2164.300000109.7
259G32.4Very low37.3Very low70 Ų70127.8 Ų127.872%0.72281%0.81SS**  trans-115.1105.417000000110.3
260P38.6Very low37.6Very low118 Ų118128.8 Ų128.877%0.76681%0.811SS**  trans-80127.1174-9.326.6000110.8
261F33.8Very low38.1Very low179 Ų179130.4 Ų130.479%0.78581%0.814SS**  trans-57.1136161.2-83.3-98000110.5W263F261-W263 PolarHBondContact O-N 2.96Å
262P45.6Very low38.4Very low126 Ų126128.5 Ų128.582%0.81881%0.813SS**  trans-8498.3173.831.3-28.4000109.9
263W47.3Very low38.7Very low221 Ų221126.9 Ų126.984%0.83781%0.812SS**PPolyproline II helixtrans-80.9138.3155.9-70.181000108.3F261 P265F261-W263 PolarHBondContact O-N 2.96Å; W263-P265 WeakPolarHBondContact O-CD 3.5Å
264P44.4Very low38.6Very low116 Ų116126.7 Ų126.775%0.75381%0.811SS**PPolyproline II helixtrans-75.9123.8168.629.6-29.4000109.3
265P44.3Very low38.6Very low128 Ų128127.2 Ų127.283%0.83181%0.806SS**PPolyproline II helixtrans-73.9131.3169.1-12.829.5000109.8W263W263-P265 WeakPolarHBondContact O-CD 3.5Å
266G34.3Very low39.1Very low72 Ų72130.9 Ų130.974%0.74281%0.808SS**PPolyproline II helixtrans-67.7149.9169.500000112.8
267A41.7Very low39.2Very low106 Ų106129.8 Ų129.888%0.87680%0.798SS**  trans38.691.4147.900000118
268A37.2Very low39.4Very low91 Ų91131.6 Ų131.675%0.75280%0.799SS**  trans-162.9139.5134.800000110.4
269R38.6Very low39.4Very low239 Ų239130.9 Ų130.990%0.90279%0.792SS**  trans84.3106.8162.3-42.3-175.390.7-153.84.6116.3
270S35.6Very low39.8Very low112 Ų112133.6 Ų133.678%0.78380%0.797SS**PPolyproline II helixtrans-48.7141.7164.9-45.40000112.3A272S270-A272 PolarHBondContact O-N 2.82Å
271P42.3Very low40Very low125 Ų125134.3 Ų134.381%0.81280%0.799SS**PPolyproline II helixtrans-72.7122.4167.5-9.525.6000109.7
272A38.3Very low40.3Very low100 Ų100131.5 Ų131.583%0.82680%0.799SS**PPolyproline II helixtrans-68.4127.5165.700000109S270S270-A272 PolarHBondContact O-N 2.82Å
273L45.3Very low39.9Very low162 Ų162133.3 Ų133.385%0.84880%0.801SS**PPolyproline II helixtrans-67.9142.1172.8-66.3172.9000110.1Y275L273-Y275 PolarHBondContact O-N 3.24Å
274P44.3Very low39.2Very low120 Ų120127.5 Ų127.578%0.77980%0.8SS**PPolyproline II helixtrans-69.5123.7174.926.7-30.6000110.7L276P274-L276 PolarHBondContact O-N 3.14Å
275Y33.5Very low38.6Very low203 Ų203126.8 Ų126.880%0.79680%0.798SS**PPolyproline II helixtrans-71.1117.4171.3178.2-95.4000109.7L273L273-Y275 PolarHBondContact O-N 3.24Å
276L39.3Very low38.8Very low151 Ų151126.6 Ų126.679%0.79180%0.797SS**PPolyproline II helixtrans-89.2137168.2-82.6169000110P274P274-L276 PolarHBondContact O-N 3.14Å
277P39.1Very low38.6Very low108 Ų108128 Ų12870%0.70180%0.801SS**PPolyproline II helixtrans-70.5132.8174.3-11.726.9000111.4
278S34Very low38.4Very low115 Ų115131 Ų13180%0.80480%0.797SS**PPolyproline II helixtrans-63.8130.2174.4-57.10000112.2
279A38.3Very low38.3Very low86 Ų86133.2 Ų133.271%0.71179%0.792SS**PPolyproline II helixtrans-84.3146162.600000110.2
280P40Very low38Very low127 Ų127130.1 Ų130.183%0.82579%0.787SS**PPolyproline II helixtrans-74.3133.5-176.328.6-32.1000111.8
281V43.2Very low37.9Very low133 Ų133129.9 Ų129.981%0.80679%0.786SS**PPolyproline II helixtrans-91.5134174.3-169.20000108.8
282P39.9Very low38Very low120 Ų120129.2 Ų129.278%0.77978%0.781SS**PPolyproline II helixtrans-71.4137175.8-11.826.9000111.5
283L37.2Very low37.8Very low164 Ų164133.6 Ų133.686%0.85978%0.782SS**PPolyproline II helixtrans-70.5126.5171.4-17178.1000110.2
284A32.4Very low37.3Very low100 Ų100134.2 Ų134.283%0.82679%0.785SS**  trans-132.7117.5162.400000109.6
285S32.2Very low36.9Very low100 Ų100134.6 Ų134.670%0.69979%0.786SS**  trans-96.4-176.5169.3-54.10000109.9
286P48.4Very low37.3Very low125 Ų125130 Ų13081%0.81278%0.781SS**  -108.6141.4-10930.2-11.1000112.9
287A30.8Very low37.2Very low101 Ų101130 Ų13084%0.83579%0.786SS**  trans-156.2109.4161.600000111.5
288Q37.4Very low37.4Very low170 Ų170133.3 Ų133.379%0.79479%0.793SS**  trans14.2126.2139.1-135.4179.99.600118.1
289Q34.8Very low38Very low136 Ų136131 Ų13164%0.63679%0.787SS**  157.5120.5116.9-77.4-73.1-43.300112.5
290H32.6Very low38.1Very low174 Ų174134.8 Ų134.881%0.80679%0.794SS**  trans63.7116.6145.6-87.3-115.5000123.1
291S33.6Very low38.3Very low108 Ų108135 Ų13576%0.75579%0.789SS**  trans-69.4158.8152.8-53.20000111.3
292P44.4Very low38.2Very low110 Ų110139.5 Ų139.571%0.71479%0.791SS**  -146.7154.183.334.9-16.2000115.1
293F33.2Very low38.6Very low192 Ų192141.9 Ų141.984%0.84279%0.792SS**  trans141.883150.4-85.9-74.7000111.6
294L35.3Very low38.6Very low175 Ų175144 Ų14492%0.91679%0.789SS**  trans-131.8116.1150.6-73.6179000107.6
295T35.4Very low39.3Very low129 Ų129145.2 Ų145.279%0.79178%0.782SS**  trans-81.2133.2166.132.20000109.3
296P42.3Very low39.6Very low107 Ų107147.4 Ų147.470%0.69579%0.785SS**  trans-91.1124.8174.931.9-27.7000110.9Q298P296-Q298 PolarHBondContact O-N 3.26Å
297V36.5Very low39.7Very low149 Ų149149.3 Ų149.390%0.90379%0.788SS**  trans-82.8100.3161.9173.10000107.7
298Q44.5Very low40.6Very low179 Ų179152.2 Ų152.284%0.83679%0.788SS**  trans-77.5123.8167.5-67.3177.8-11.700108.7P296P296-Q298 PolarHBondContact O-N 3.26Å
299G46.8Very low40.9Very low67 Ų67146.6 Ų146.669%0.69178%0.775SS**  trans154.652.2164.900000117
300L40.5Very low40.9Very low164 Ų164148.8 Ų148.886%0.85979%0.785SS**SBendtrans-162.99.3152-141.267.9000115.9
301D42.2Very low40.9Very low132 Ų132145.4 Ų145.471%0.70679%0.788SS**SBendtrans-98.2-9-174.6-153.4-110.8000113.9H303D301-H303 PolarHBondContact O-N 2.89Å
302R42.5Very low41Very low228 Ų228148.9 Ų148.986%0.8679%0.791SS**THydrogen-bonded Turntrans-89.81.2-165.5-155.5160.3141.4131.3-5.5115.3
303H48.7Very low41.2Very low170 Ų170148.2 Ų148.279%0.78779%0.787SS**THydrogen-bonded Turntrans-108-7.9-175.5-72.9-76.3000115.8D301D301-H303 PolarHBondContact O-N 2.89Å
304Y37.2Very low41.2Very low207 Ų207146.8 Ų146.881%0.81279%0.788SS**THydrogen-bonded Turntrans-106.9-14178.5-80.6-83.3000114.8N306Y304-N306 VanDerWaalsContact C-N 3.32Å; Y304-N306 PolarHBondContact O-N 3.05Å
305L45.5Very low41.1Very low127 Ų127142.6 Ų142.667%0.66578%0.779SS**THydrogen-bonded Turntrans-80.7-3-177.6-90.3158.3000115.3
306N40.3Very low41.2Very low145 Ų145144.9 Ų144.978%0.77579%0.785SS**THydrogen-bonded Turntrans-96.910.5-177.9-102.2-16.1000115.7Y304Y304-N306 VanDerWaalsContact C-N 3.32Å; Y304-N306 PolarHBondContact O-N 3.05Å
307L49.7Very low40.9Very low166 Ų166147.2 Ų147.287%0.86979%0.792SS**SBendtrans-106.52177-149.465.3000114.7
308I50Low41Very low162 Ų162147.6 Ų147.683%0.83179%0.788SS**SBendtrans-117.625.8-176.8-61.3155.6000111.6
309G42.5Very low40.8Very low52 Ų52148 Ų14854%0.53679%0.789SS.*  trans-137.931.9-165.300000118
310H35.2Very low40.6Very low182 Ų182149.6 Ų149.684%0.84379%0.786SS**  trans-14079.5168.4-73.8-64.7000112.1
311A32.4Very low40.7Very low103 Ų103147.9 Ų147.985%0.85179%0.785SS**  trans-87.8107.1158.200000108.5
312H36.9Very low40.5Very low180 Ų180150.5 Ų150.583%0.83379%0.793SS**  trans-76.7134.1164.6-111.7-84.1000109.1
313P48.1Very low40.8Very low96 Ų96148 Ų14862%0.62379%0.79SS**  trans-89.9155.3164.334.4-28000110.5
314N32.5Very low41.1Very low162 Ų162145 Ų14587%0.86679%0.787SS**  trans94.5113.1165.9-61.8-34.8000118.8
315A33.4Very low41.8Very low88 Ų88140.7 Ų140.773%0.72778%0.784SS**  135.378.712300000112.7
316L38.2Very low41.6Very low176 Ų176140.9 Ų140.992%0.92179%0.79SS**  trans-93.191.9154.4-66.6-179000107.7
317N34.9Very low41.7Very low156 Ų156145.5 Ų145.583%0.83481%0.813SS**  trans-76.1120.2164.3-127.6-75.1000107.5H319N317-H319 PolarHBondContact O-N 3.11Å
318L38.4Very low41.3Very low158 Ų158144.5 Ų144.583%0.82781%0.81SS**  trans-60.2120.1166.5-100.880.9000108.5
319H39.9Very low40.8Very low186 Ų186143.5 Ų143.586%0.86181%0.809SS**  trans-93.7114.1163.7-148.780.5000108.7N317N317-H319 PolarHBondContact O-N 3.11Å
320T44.1Very low40.7Very low101 Ų101148.6 Ų148.662%0.6283%0.825SS**  trans-69.5146.9168.731.80000110.7
321P42Very low41Very low129 Ų129146.6 Ų146.684%0.83882%0.823SS**  trans-88.5116.5167.932.6-25.5000109
322Q39.1Very low41.6Very low186 Ų186149.4 Ų149.487%0.86982%0.822SS**  trans-107.4120.5164.5-85.2-143.8-13.900110.8
323H47.3Very low41.9Very low175 Ų175147.3 Ų147.381%0.8182%0.821SS**PPolyproline II helixtrans-75.4141.1167.2-138.8-84000109.1
324P54.6Low41.5Very low109 Ų109151 Ų15171%0.70884%0.835SS**PPolyproline II helixtrans-86.1144.1171.132.1-30.5000111.2
325P52.1Low42.1Very low115 Ų115150.2 Ų150.275%0.74783%0.833SS**PPolyproline II helixtrans-94137.4163.534-26.2000111.3
326V41.1Very low42.9Very low132 Ų132155.3 Ų155.380%0.884%0.841SS**  trans6.4118.8141.8-174.60000116.4
327L42.8Very low43.3Very low241 Ų241153.5 Ų153.5100%1.26283%0.834SS**  -162.30111.9-94.5171.1000109.9

Retrieved 327 of 327 residues in 231.7 ms (Link to these results)