A0A087XUM3_POEFO Loading...

Parvin, alpha a

AlphaFold DB , UniProt , Accession A0A087XUM3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 372 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
1M39.2Very low38.5Very low252 Ų252140.2 Ų140.2100%1.24184%0.844SS**  0129.30-83.9173.9155.600107.9
2A35.8Very low38.7Very low95 Ų95138.5 Ų138.579%0.78584%0.839SS**  trans-65.9167.8-176.300000111.9
3S33.8Very low38.3Very low114 Ų114143.7 Ų143.780%0.79784%0.843SS**  cis-168.3151.620.9-20000109.4
4S34.6Very low37.8Very low116 Ų116141.6 Ų141.681%0.81184%0.84SS**  trans-82.9-159.9172.9-540000112.4
5P59.3Low37.8Very low115 Ų115140.5 Ų140.575%0.74784%0.838SS**  -129.9-176.7-8539.2-21.3000112.2
6Q34.9Very low37.9Very low200 Ų200140.2 Ų140.294%0.93584%0.838SS**  trans-167.7155.5144.1-112171.5-0.500116.7
7K34.9Very low37.9Very low196 Ų196139.7 Ų139.785%0.85284%0.839SS**  trans-87.6160.3-164.8-74.1168.7167175.80115
8S34.9Very low37.7Very low103 Ų103143.4 Ų143.472%0.7284%0.842SS**  trans-30163.7149.551.60000116.1
9P44.7Very low37.7Very low118 Ų118141.7 Ų141.777%0.76684%0.839SS**  cis-158.3-171.347.841.1-15.9000119.1
10S38.4Very low37.7Very low116 Ų116141.2 Ų141.281%0.81184%0.839SS**  trans-42154.417254.40000119.8
11S33.4Very low37.5Very low117 Ų117139.5 Ų139.582%0.81884%0.835SS**  trans-155.3165.2168.481.80000111.3
12P41.1Very low37.5Very low120 Ų120132.7 Ų132.778%0.77981%0.812SS**  -133.9178.7-120.731.8-7.9000117.8
13K32.9Very low37.3Very low206 Ų206140.4 Ų140.490%0.89682%0.821SS**  trans1.5140.8160.5-69.8176.7176.4177.60122
14S31.8Very low37.5Very low115 Ų115144.6 Ų144.680%0.80482%0.824SS**  trans-64150.7172.446.20000117.2
15P38Very low37.3Very low125 Ų125148.9 Ų148.981%0.81283%0.828SS**  trans-107.4137.4165.834.9-23.6000114
16T38.2Very low36.3Very low135 Ų135150.1 Ų150.183%0.82883%0.829SS**PPolyproline II helixtrans-71147.1166.428.70000113.1
17P37.9Very low36.1Very low132 Ų132148.6 Ų148.686%0.85783%0.827SS**PPolyproline II helixtrans-89.9143.4169.5-0.419.7000113.5
18K34.9Very low36.3Very low206 Ų206144.1 Ų144.190%0.89682%0.821SS**PPolyproline II helixtrans-83.8146.4-179.8-67.8172.1175.3175.20112.4
19S38.3Very low36.3Very low111 Ų111148.4 Ų148.478%0.77683%0.827SS**PPolyproline II helixtrans-71.3154.8161.353.70000112.9
20P37.7Very low36.1Very low131 Ų131151 Ų15185%0.85183%0.833SS**  trans-109.8147157.715.83.9000113.5
21S33.5Very low35.9Very low107 Ų107148.9 Ų148.975%0.74883%0.829SS**  trans-106.2137.2-177.855.40000113.7
22S37.9Very low36.7Very low109 Ų109153.2 Ų153.276%0.76283%0.834SS**  trans56132.214174.20000122.8
23R32.2Very low36.7Very low256 Ų256156 Ų15697%0.96684%0.841SS**  -158.5137.3129.1-107.8172-164.7-175.94.1112.3
24K38.4Very low37.1Very low202 Ų202149.1 Ų149.188%0.87883%0.829SS**  trans-81.5152.9-177.7-69.2172.8167.5-179.80112.9
25K30.7Very low37.6Very low206 Ų206146.5 Ų146.590%0.89682%0.82SS**  -171.4145119.4-125.9178.8176.7-177.20113.1
26D37Very low37.9Very low141 Ų141146.1 Ų146.175%0.75482%0.815SS**  trans-68.2151.1-178.1-55.8-67.2000114.3
27D32.1Very low38Very low169 Ų169146.3 Ų146.390%0.90481%0.81SS**  -170.1138.7118.6-97.2-24.7000111.1
28S38.3Very low38.2Very low102 Ų102143.4 Ų143.471%0.71380%0.797SS**  trans-91.2162.5-180-69.20000112.1
29F35.9Very low38.7Very low193 Ų193143.7 Ų143.785%0.84679%0.793SS**  trans94.4116.8158.4-76.9-91000119.9
30L39.1Very low39.2Very low172 Ų172148 Ų14890%0.90179%0.792SS**  trans83.989.8153-66.2165000118.9
31G35.6Very low39.7Very low71 Ų71149.5 Ų149.573%0.73279%0.785SS**  trans-171.731.1162.100000114.8L33G31-L33 PolarHBondContact O-N 2.94Å
32K48.5Very low40.5Very low209 Ų209151.6 Ų151.691%0.90978%0.781SS**THydrogen-bonded Turntrans-60.397.1166-97.4177.9170.7175.90107.8
33L42.8Very low41.1Very low179 Ų179149.4 Ų149.494%0.93777%0.769SS**THydrogen-bonded Turntrans-179.515.8143.5-115.5109.8000116.2G31G31-L33 PolarHBondContact O-N 2.94Å
34G40.5Very low42.2Very low61 Ų61143.7 Ų143.763%0.62975%0.751SS**SBendtrans-117.5-4.9-175.300000118.3
35G41.2Very low42.8Very low60 Ų60139.4 Ų139.462%0.61973%0.734SS**Hα-helixtrans-88.9-9.7-159.800000118.2
36T44.5Very low43.9Very low116 Ų116133.7 Ų133.771%0.71272%0.717SS**Hα-helixtrans-97-19.6-171.5480000114.3
37L41.4Very low44.7Very low140 Ų140130.1 Ų130.173%0.73370%0.703SS**Hα-helixtrans-88.5-39.2-179.8-85.3157.7000113.3R39 R40 K41L37-R39 PolarHBondContact O-N 3Å; L37-R40 PolarHBondContact O-N 3.43Å; L37-K41 PolarHBondContact O-N 3.26Å; L37-K41 VanDerWaalsContact O-N 3.08Å
38A41.8Very low45.8Very low70 Ų70126.7 Ų126.758%0.57968%0.681SS**Hα-helixtrans-69.6-32179.100000112.9K42A38-K42 PolarHBondContact O-N 3.08Å
39R46.1Very low46.6Very low212 Ų212127 Ų12780%0.868%0.675SS**Hα-helixtrans-74.6-33.4177.2-154.6175.3-172.4-179.81.3112.3L37 A43L37-R39 PolarHBondContact O-N 3Å; R39-A43 WeakPolarHBondContact O-CB 3.38Å; R39-A43 PolarHBondContact O-N 3.08Å; R39-A43 VanDerWaalsContact O-N 3.13Å
40R48.8Very low47.3Very low201 Ų201124 Ų12476%0.75866%0.663SS**Hα-helixtrans-69.8-38.2172.4-99.6-178168.8176-3.2112.3L37 A43 K44L37-R40 PolarHBondContact O-N 3.43Å; R40-A43 PolarHBondContact O-N 3.43Å; R40-K44 WeakPolarHBondContact O-CB 3.33Å; R40-K44 PolarHBondContact O-N 3.47Å
41K48.4Very low48.1Very low164 Ų164121.6 Ų121.671%0.71365%0.647SS**Hα-helixtrans-67.2-43.8180-153.3176.6-178.2-174.70112L37 K44 E45L37-K41 PolarHBondContact O-N 3.26Å; L37-K41 VanDerWaalsContact O-N 3.08Å; K41-K44 PolarHBondContact O-N 3.32Å; K41-E45 WeakPolarHBondContact O-CB 3.4Å; K41-E45 PolarHBondContact O-N 3.23Å
42K49.4Very low49.1Very low151 Ų151124.5 Ų124.566%0.65764%0.642SS**Hα-helixtrans-67.7-35.1173.7-82-171.1172.9-173.70113.8A38 K44 V46A38-K42 PolarHBondContact O-N 3.08Å; K42-K44 VanDerWaalsContact C-N 3.33Å; K42-V46 WeakPolarHBondContact O-CB 3.4Å; K42-V46 WeakPolarHBondContact O-CG2 3.21Å; K42-V46 PolarHBondContact O-N 3.25Å
43A50.3Low49.2Very low63 Ų63116.1 Ų116.152%0.52162%0.615SS.*Hα-helixtrans-68.3-35.6176.200000112.1R39 R40 S47R39-A43 WeakPolarHBondContact O-CB 3.38Å; R39-A43 PolarHBondContact O-N 3.08Å; R39-A43 VanDerWaalsContact O-N 3.13Å; R40-A43 PolarHBondContact O-N 3.43Å; A43-S47 WeakPolarHBondContact O-CB 3.33Å; A43-S47 PolarHBondContact O-N 3.39Å
44K54.4Low49.7Very low135 Ų135112.3 Ų112.359%0.58759%0.594SS**Hα-helixtrans-71.9-40.9177.1-152.5-175.9-179.6-157.90111.9R40 K41 K42 S47 E48R40-K44 WeakPolarHBondContact O-CB 3.33Å; R40-K44 PolarHBondContact O-N 3.47Å; K41-K44 PolarHBondContact O-N 3.32Å; K42-K44 VanDerWaalsContact C-N 3.33Å; K44-S47 WeakPolarHBondContact O-CB 3.17Å; K44-S47 PolarHBondContact O-N 2.97Å; K44-E48 WeakPolarHBondContact CE-OE1 3.39Å; K44-E48 IonicContact NZ-OE1 3.68Å; K44-E48 WeakPolarHBondContact O-CB 3.37Å; K44-E48 WeakPolarHBondContact O-CG 3.49Å; K44-E48 PolarHBondContact O-N 2.83Å
45E52.5Low50.2Low112 Ų112114.4 Ų114.452%0.52359%0.591SS.*Hα-helixtrans-66.3-36.9176.4-163.9172.5-160.900112.1K41 L49K41-E45 WeakPolarHBondContact O-CB 3.4Å; K41-E45 PolarHBondContact O-N 3.23Å; E45-L49 HydrophobicContact CG-CD1 4.44Å; E45-L49 WeakPolarHBondContact O-CB 3.38Å; E45-L49 WeakPolarHBondContact O-CD1 3.3Å; E45-L49 WeakPolarHBondContact O-CG 2.89Å; E45-L49 PolarHBondContact O-N 3.4Å
46V53Low50.6Low87 Ų87114.8 Ų114.853%0.52759%0.588SS.*Hα-helixtrans-70.1-35.5172.91740000111.8K42 Q50K42-V46 WeakPolarHBondContact O-CB 3.4Å; K42-V46 WeakPolarHBondContact O-CG2 3.21Å; K42-V46 PolarHBondContact O-N 3.25Å; V46-Q50 VanDerWaalsContact O-CB 3.23Å; V46-Q50 WeakPolarHBondContact O-CB 3.35Å; V46-Q50 PolarHBondContact O-N 3.13Å
47S54.6Low50.8Low66 Ų66116 Ų11646%0.46259%0.589SS.*Hα-helixtrans-68.2-43.9174.8-1680000111.6A43 K44 Q50 E51A43-S47 WeakPolarHBondContact O-CB 3.33Å; A43-S47 PolarHBondContact O-N 3.39Å; K44-S47 WeakPolarHBondContact O-CB 3.17Å; K44-S47 PolarHBondContact O-N 2.97Å; S47-Q50 PolarHBondContact O-N 3.03Å; S47-E51 VanDerWaalsContact O-CB 3.25Å; S47-E51 WeakPolarHBondContact O-CB 3.5Å; S47-E51 PolarHBondContact O-N 3.02Å
48E55.2Low51Low97 Ų97115 Ų11545%0.45358%0.584SS.*Hα-helixtrans-65.2-41.1178-75.2168.4-170.400110.5K44 Q50 E51 E52K44-E48 WeakPolarHBondContact CE-OE1 3.39Å; K44-E48 IonicContact NZ-OE1 3.68Å; K44-E48 WeakPolarHBondContact O-CB 3.37Å; K44-E48 WeakPolarHBondContact O-CG 3.49Å; K44-E48 PolarHBondContact O-N 2.83Å; E48-Q50 VanDerWaalsContact C-N 3.33Å; E48-Q50 PolarHBondContact O-N 3.01Å; E48-E51 PolarHBondContact O-N 2.87Å; E48-E52 WeakPolarHBondContact O-CB 3.44Å; E48-E52 PolarHBondContact O-N 3.49Å
49L54.6Low50.8Low109 Ų109118.1 Ų118.157%0.57159%0.591SS**Hα-helixtrans-68.3-29.2174.3-72.9167.5000113.5E45 G53E45-L49 HydrophobicContact CG-CD1 4.44Å; E45-L49 WeakPolarHBondContact O-CB 3.38Å; E45-L49 WeakPolarHBondContact O-CD1 3.3Å; E45-L49 WeakPolarHBondContact O-CG 2.89Å; E45-L49 PolarHBondContact O-N 3.4Å; L49-G53 PolarHBondContact O-N 2.76Å
50Q50.9Low50.7Low130 Ų130113.6 Ų113.661%0.60759%0.589SS**Hα-helixtrans-79.2-35.9176.9-166.6161600111.5V46 S47 E48 G53 I54V46-Q50 VanDerWaalsContact O-CB 3.23Å; V46-Q50 WeakPolarHBondContact O-CB 3.35Å; V46-Q50 PolarHBondContact O-N 3.13Å; S47-Q50 PolarHBondContact O-N 3.03Å; E48-Q50 VanDerWaalsContact C-N 3.33Å; E48-Q50 PolarHBondContact O-N 3.01Å; Q50-G53 PolarHBondContact O-N 3.23Å; Q50-I54 WeakPolarHBondContact O-CD1 3.45Å; Q50-I54 WeakPolarHBondContact O-CG1 3.33Å; Q50-I54 PolarHBondContact O-N 3.34Å
51E56.3Low50.2Low120 Ų120112 Ų11256%0.56159%0.594SS**Hα-helixtrans-72.3-38.3174.4-164.3169.7-162.100111.5S47 E48 I54 N55S47-E51 VanDerWaalsContact O-CB 3.25Å; S47-E51 WeakPolarHBondContact O-CB 3.5Å; S47-E51 PolarHBondContact O-N 3.02Å; E48-E51 PolarHBondContact O-N 2.87Å; E51-I54 PolarHBondContact O-N 3.35Å; E51-N55 WeakPolarHBondContact O-CB 3.29Å; E51-N55 PolarHBondContact O-N 3.25Å
52E56.4Low49.7Very low133 Ų133109.8 Ų109.862%0.62160%0.6SS**Hα-helixtrans-69.6-34.2171.8-162.2173.3-154.400111.4E48 N55 A56E48-E52 WeakPolarHBondContact O-CB 3.44Å; E48-E52 PolarHBondContact O-N 3.49Å; E52-N55 PolarHBondContact O-N 2.81Å; E52-A56 WeakPolarHBondContact O-CB 3.49Å; E52-A56 PolarHBondContact O-N 3.25Å
53G49.9Very low49.2Very low33 Ų33108.1 Ų108.134%0.3460%0.604SS.*Hα-helixtrans-64.8-39.1169.700000113.5L49 Q50 I57L49-G53 PolarHBondContact O-N 2.76Å; Q50-G53 PolarHBondContact O-N 3.23Å; G53-I57 WeakPolarHBondContact O-CD1 3.5Å; G53-I57 VanDerWaalsContact O-CG1 3.29Å; G53-I57 WeakPolarHBondContact O-CG1 3.43Å; G53-I57 PolarHBondContact O-N 2.92Å
54I52.6Low48.5Very low98 Ų98109.1 Ų109.150%0.50361%0.607SS.*Hα-helixtrans-69.1-40.4174.5-70.3162.7000110.7Q50 E51 N58Q50-I54 WeakPolarHBondContact O-CD1 3.45Å; Q50-I54 WeakPolarHBondContact O-CG1 3.33Å; Q50-I54 PolarHBondContact O-N 3.34Å; E51-I54 PolarHBondContact O-N 3.35Å; I54-N58 PolarHBondContact O-ND2 3Å
55N52.4Low47.6Very low106 Ų106111.9 Ų111.957%0.56762%0.622SS**Hα-helixtrans-73-30.7177.3-82.8-15.8000113.3E51 E52 N58E51-N55 WeakPolarHBondContact O-CB 3.29Å; E51-N55 PolarHBondContact O-N 3.25Å; E52-N55 PolarHBondContact O-N 2.81Å; N55-N58 CarbonylContact O-C 3.14Å; N55-N58 PolarHBondContact O-N 3.43Å
56A49.2Very low47.2Very low68 Ų68111.3 Ų111.356%0.56262%0.616SS**Hα-helixtrans-74.6-25.8177.100000113.4E52E52-A56 WeakPolarHBondContact O-CB 3.49Å; E52-A56 PolarHBondContact O-N 3.25Å
57I49.3Very low46.6Very low141 Ų141116.3 Ų116.372%0.72363%0.633SS**Hα-helixtrans-71.9-24.6170.5-66166.7000110.6G53 L59G53-I57 WeakPolarHBondContact O-CD1 3.5Å; G53-I57 VanDerWaalsContact O-CG1 3.29Å; G53-I57 WeakPolarHBondContact O-CG1 3.43Å; G53-I57 PolarHBondContact O-N 2.92Å; I57-L59 PolarHBondContact O-N 3.45Å
58N44.9Very low46Very low119 Ų119117 Ų11764%0.63663%0.632SS**  trans-98.862.5178.7-68.9-36.5000112.3I54 N55I54-N58 PolarHBondContact O-ND2 3Å; N55-N58 CarbonylContact O-C 3.14Å; N55-N58 PolarHBondContact O-N 3.43Å
59L37.3Very low45.4Very low136 Ų136117.9 Ų117.971%0.71264%0.639SS**SBendtrans-109.3153161.2-88.4157.1000109.7I57 L61I57-L59 PolarHBondContact O-N 3.45Å; L59-L61 PolarHBondContact O-N 3.49Å; L59-L61 VanDerWaalsContact O-N 3.1Å
60P45Very low44.7Very low117 Ų117117.2 Ų117.276%0.7664%0.641SS**SBend-92.783.3-123.635.1-34.6000112.1
61L38.6Very low44.5Very low166 Ų166118.8 Ų118.887%0.86965%0.649SS**  trans-14360.1168.1-81166.6000109.9L59L59-L61 PolarHBondContact O-N 3.49Å; L59-L61 VanDerWaalsContact O-N 3.1Å
62S36.4Very low44Very low119 Ų119115.3 Ų115.383%0.83263%0.634SS**SBendtrans-155142.4164.4-71.30000110.9
63P39.4Very low43.5Very low116 Ų116112.2 Ų112.275%0.75362%0.624SS**  trans-84.2137.2-158.723.4-12.7000112.5
64S36Very low43.3Very low83 Ų83117.9 Ų117.958%0.5864%0.643SS**  trans44.5104.8162.450.80000117.4Y66S64-Y66 PolarHBondContact O-N 2.95Å
65H35.6Very low43.2Very low193 Ų193113.5 Ų113.589%0.89462%0.621SS**  trans-57.4114.8166.7-116.3-97.3000110.1
66Y43Very low43.4Very low100 Ų100115.8 Ų115.839%0.39263%0.628SS.*  trans-76.4114163.7-70.9-88.9000107.6S64 L68 D85 V216 Q229S64-Y66 PolarHBondContact O-N 2.95Å; Y66-L68 PolarHBondContact O-N 3.1Å; Y66-D85 PolarHBondContact OH-OD2 2.89Å; Y66-V216 HydrophobicContact CE1-CG2 4.38Å; Y66-Q229 PolarHBondContact OH-NE2 3.24Å; Y66-Q229 VanDerWaalsContact OH-NE2 3.07Å
67E40.8Very low43Very low193 Ų193118.5 Ų118.590%0.90263%0.629SS**  trans-79.698.6164.5-75.9-178.2168.300107.5
68L42Very low43Very low81 Ų81116.9 Ų116.942%0.42462%0.622SS.*  trans-84.6133.8173.6-64.2170.9000109.1Y66 T73 M83Y66-L68 PolarHBondContact O-N 3.1Å; L68-T73 HydrophobicContact CB-CG2 4.43Å; L68-M83 HydrophobicContact CD2-SD 4.14Å
69D42.1Very low43Very low115 Ų115114.6 Ų114.662%0.61561%0.608SS**  trans-65.9148.2174.1-131.6-24.1000109.7E71 D72D69-E71 PolarHBondContact O-N 2.87Å; D69-E71 VanDerWaalsContact O-N 3.11Å; D69-D72 VanDerWaalsContact O-CB 3.31Å; D69-D72 WeakPolarHBondContact O-CB 3.47Å; D69-D72 PolarHBondContact O-N 3.2Å
70P40.8Very low43.8Very low94 Ų94111.5 Ų111.561%0.6160%0.595SS**G310 helixtrans-58.5-29.2-176-25.435.1000114.2D72 T73P70-D72 VanDerWaalsContact C-N 3.29Å; P70-D72 PolarHBondContact O-N 3.06Å; P70-T73 PolarHBondContact O-N 2.86Å; P70-T73 PolarHBondContact O-OG1 3.31Å
71E46.7Very low44.4Very low164 Ų164111 Ų11177%0.76658%0.577SS**G310 helixtrans-71-22.2174.5-68.1-166.6161.800113.3D69 T73D69-E71 PolarHBondContact O-N 2.87Å; D69-E71 VanDerWaalsContact O-N 3.11Å; E71-T73 VanDerWaalsContact C-N 3.28Å; E71-T73 PolarHBondContact O-N 2.89Å
72D46.4Very low45.3Very low47 Ų47106.5 Ų106.525%0.25156%0.557SS.*G310 helixtrans-80.1-7.7177.7-77.9-31.8000113.4D69 P70 R81 M83D69-D72 VanDerWaalsContact O-CB 3.31Å; D69-D72 WeakPolarHBondContact O-CB 3.47Å; D69-D72 PolarHBondContact O-N 3.2Å; P70-D72 VanDerWaalsContact C-N 3.29Å; P70-D72 PolarHBondContact O-N 3.06Å; D72-R81 IonicContact OD1-CZ 3.98Å; D72-R81 IonicContact OD1-NE 3.99Å; D72-R81 IonicContact OD1-NH2 3.57Å; D72-M83 HydrophobicContact CB-CE 3.62Å; D72-M83 VanDerWaalsContact OD1-CE 3.25Å; D72-M83 WeakPolarHBondContact OD1-CE 3.24Å
73T45.7Very low46.4Very low67 Ų67102.8 Ų102.841%0.41153%0.527SS..G310 helixtrans-96.4-9179.8660000114.1L68 P70 E71 L75L68-T73 HydrophobicContact CB-CG2 4.43Å; P70-T73 PolarHBondContact O-N 2.86Å; P70-T73 PolarHBondContact O-OG1 3.31Å; E71-T73 VanDerWaalsContact C-N 3.28Å; E71-T73 PolarHBondContact O-N 2.89Å; T73-L75 PolarHBondContact O-N 3.14Å
74M44.2Very low47.6Very low152 Ų15298.6 Ų98.675%0.74950%0.499SS*.  trans-91.465.6-177.6-64.3-166.868.600112
75L52Low48.8Very low6 Ų695 Ų953%0.03147%0.473CS..PPolyproline II helixtrans-86.5135.8169.6-64.4177.8000111T73 E79 R81 V218 K220 L225T73-L75 PolarHBondContact O-N 3.14Å; L75-E79 WeakPolarHBondContact CA-OE2 3.34Å; L75-E79 HydrophobicContact CB-CB 4.23Å; L75-E79 HydrophobicContact CD2-CB 4.34Å; L75-E79 HydrophobicContact CD2-CG 4.03Å; L75-R81 HydrophobicContact CD1-CB 4.34Å; L75-R81 HydrophobicContact CD2-CB 3.65Å; L75-R81 HydrophobicContact CD2-CG 4.41Å; L75-V218 HydrophobicContact CD1-CB 4.2Å; L75-V218 HydrophobicContact CD1-CG1 3.84Å; L75-K220 HydrophobicContact CB-CB 4.09Å; L75-K220 HydrophobicContact CB-CD 4.27Å; L75-K220 WeakPolarHBondContact O-CD 3.2Å; L75-K220 PolarHBondContact O-NZ 2.9Å; L75-L225 HydrophobicContact CB-CD2 4.49Å; L75-L225 HydrophobicContact CD1-CD2 3.99Å
76E55.3Low49.9Very low155 Ų15589.5 Ų89.572%0.72446%0.455SS*.PPolyproline II helixtrans-68.9160.9167-66.3-169.217400110.9N78 E79E76-N78 PolarHBondContact O-N 2.74Å; E76-E79 HydrophobicContact CB-CB 4.23Å; E76-E79 PolarHBondContact N-OE2 2.75Å; E76-E79 VanDerWaalsContact O-CB 3.25Å; E76-E79 WeakPolarHBondContact O-CB 3.45Å; E76-E79 PolarHBondContact O-N 2.97Å
77E40.8Very low50.6Low124 Ų12490.4 Ų90.458%0.57947%0.467SS*.THydrogen-bonded Turntrans-67.5122.6-176.9-171.7149.4-145.100110.9E79 E222E77-E79 VanDerWaalsContact C-N 3.35Å; E77-E222 WeakPolarHBondContact OE1-CA 3.11Å; E77-E222 PolarHBondContact OE1-N 3.31Å
78N49.2Very low51.6Low107 Ų10781.8 Ų81.857%0.57243%0.428SS*.THydrogen-bonded Turntrans76.13.6-168.5-48.7-70.2000116.6E76 K220E76-N78 PolarHBondContact O-N 2.74Å; N78-K220 WeakPolarHBondContact CA-O 3.24Å; N78-K220 PolarHBondContact N-O 2.95Å
79E46.3Very low52.5Low71 Ų7184 Ų8433%0.33243%0.434SS..  trans-67.3137.4173.4-164.4-176.9166.700110.5L75 E76 E77 Q219 K220L75-E79 WeakPolarHBondContact CA-OE2 3.34Å; L75-E79 HydrophobicContact CB-CB 4.23Å; L75-E79 HydrophobicContact CD2-CB 4.34Å; L75-E79 HydrophobicContact CD2-CG 4.03Å; E76-E79 HydrophobicContact CB-CB 4.23Å; E76-E79 PolarHBondContact N-OE2 2.75Å; E76-E79 VanDerWaalsContact O-CB 3.25Å; E76-E79 WeakPolarHBondContact O-CB 3.45Å; E76-E79 PolarHBondContact O-N 2.97Å; E77-E79 VanDerWaalsContact C-N 3.35Å; E79-Q219 WeakPolarHBondContact O-CA 3.42Å; E79-K220 PolarHBondContact O-N 2.66Å
80V53Low53.7Low72 Ų7284 Ų8444%0.43643%0.434SS..EExtended strand (participates in β ladder)trans-117.5117.5-179.5-179.40000107.4V217 V218 Q219V80-V217 HydrophobicContact CG1-CG1 3.34Å; V80-V218 WeakPolarHBondContact CA-O 3.25Å; V80-Q219 HydrophobicContact CG2-CB 4.22Å; V80-Q219 HydrophobicContact CG2-CG 3.86Å
81R57.5Low55.5Low105 Ų10582.3 Ų82.340%0.39642%0.42SS..EExtended strand (participates in β ladder)trans-115.9139.3176.4-163.5162.7178.7149.4-12.3110.6D72 L75 M83 V217 V218D72-R81 IonicContact OD1-CZ 3.98Å; D72-R81 IonicContact OD1-NE 3.99Å; D72-R81 IonicContact OD1-NH2 3.57Å; L75-R81 HydrophobicContact CD1-CB 4.34Å; L75-R81 HydrophobicContact CD2-CB 3.65Å; L75-R81 HydrophobicContact CD2-CG 4.41Å; R81-M83 HydrophobicContact CG-CE 4.24Å; R81-V217 WeakPolarHBondContact O-CA 3.31Å; R81-V218 PolarHBondContact N-O 3.44Å; R81-V218 PolarHBondContact O-N 3.27Å
82T58.1Low57.2Low72 Ų7284.7 Ų84.744%0.44242%0.422SS..EExtended strand (participates in β ladder)trans-117.2107.3-168.6-60.60000107.3V215 V217T82-V215 HydrophobicContact CG2-CB 4.45Å; T82-V215 HydrophobicContact CG2-CG1 3.04Å; T82-V217 HydrophobicContact CG2-CG2 4.49Å
83M60.1Low58.9Low41 Ų4187 Ų8720%0.20243%0.429CS..EExtended strand (participates in β ladder)trans-109.6136.4-179.3-67.3170.8176.400109.3L68 D72 R81 V215 V216L68-M83 HydrophobicContact CD2-SD 4.14Å; D72-M83 HydrophobicContact CB-CE 3.62Å; D72-M83 VanDerWaalsContact OD1-CE 3.25Å; D72-M83 WeakPolarHBondContact OD1-CE 3.24Å; R81-M83 HydrophobicContact CG-CE 4.24Å; M83-V215 CarbonylContact O-C 3.55Å; M83-V215 WeakPolarHBondContact O-CA 3.25Å; M83-V215 WeakPolarHBondContact O-CG1 3.23Å; M83-V216 PolarHBondContact N-O 3.01Å; M83-V216 PolarHBondContact O-N 3.42Å
84V63.8Low60.8Low29 Ų2984 Ų8418%0.17641%0.411CS..EExtended strand (participates in β ladder)trans-77.9131.3174.8176.70000109.1K89 I187 V188 I213V84-K89 HydrophobicContact CG1-CG 4.06Å; V84-I187 HydrophobicContact CG2-CG2 3.6Å; V84-V188 HydrophobicContact CG2-CG2 3.87Å; V84-I213 HydrophobicContact CG1-CG2 3.67Å; V84-I213 HydrophobicContact CG2-CG2 4.3Å
85D61Low62.9Low6 Ų681.6 Ų81.63%0.03240%0.398CS..  trans-61.6127.2175.8-167.5-68.8000109.8Y66 N87 S88 K89 Q214Y66-D85 PolarHBondContact OH-OD2 2.89Å; D85-N87 PolarHBondContact O-N 2.88Å; D85-N87 VanDerWaalsContact O-N 3.1Å; D85-N87 VanDerWaalsContact OD1-CB 3.23Å; D85-N87 WeakPolarHBondContact OD1-CB 3.42Å; D85-N87 PolarHBondContact OD1-N 2.81Å; D85-N87 PolarHBondContact OD1-ND2 3.18Å; D85-S88 WeakPolarHBondContact O-CB 3.14Å; D85-S88 PolarHBondContact O-N 3.11Å; D85-K89 PolarHBondContact O-N 2.81Å; D85-Q214 HydrophobicContact CB-CB 4.17Å; D85-Q214 PolarHBondContact N-O 3.48Å
86P58.1Low64.6Low78 Ų7886.7 Ų86.751%0.50642%0.422SS..THydrogen-bonded Turntrans-54.6-29.3179.1-26.634.5000113.9S88 K89P86-S88 VanDerWaalsContact C-N 3.34Å; P86-K89 PolarHBondContact O-N 2.86Å
87N58.4Low66.2Low120 Ų12079.3 Ų79.364%0.64239%0.387SS*.THydrogen-bonded Turntrans-72-29.1176.9-59.4-57.6000112.3D85 K89 N90D85-N87 PolarHBondContact O-N 2.88Å; D85-N87 VanDerWaalsContact O-N 3.1Å; D85-N87 VanDerWaalsContact OD1-CB 3.23Å; D85-N87 WeakPolarHBondContact OD1-CB 3.42Å; D85-N87 PolarHBondContact OD1-N 2.81Å; D85-N87 PolarHBondContact OD1-ND2 3.18Å; N87-K89 VanDerWaalsContact C-N 3.32Å; N87-N90 PolarHBondContact O-N 3.43Å
88S61Low68.6Low12 Ų1275.4 Ų75.48%0.08437%0.37CS..G310 helixtrans-70.8-28.2174.6-660000112.4D85 P86 N90 D91 L94 Q214D85-S88 WeakPolarHBondContact O-CB 3.14Å; D85-S88 PolarHBondContact O-N 3.11Å; P86-S88 VanDerWaalsContact C-N 3.34Å; S88-N90 PolarHBondContact O-N 3.25Å; S88-D91 WeakPolarHBondContact O-CB 3.2Å; S88-D91 PolarHBondContact O-N 3.01Å; S88-D91 VanDerWaalsContact O-N 3.14Å; S88-L94 VanDerWaalsContact O-CD2 3.29Å; S88-L94 WeakPolarHBondContact O-CD2 3.33Å; S88-Q214 VanDerWaalsContact OG-CB 3.25Å; S88-Q214 WeakPolarHBondContact OG-CB 3.42Å; S88-Q214 PolarHBondContact OG-N 3.48Å
89K61.6Low70.6Confident127 Ų12776.5 Ų76.555%0.55237%0.369SS*.G310 helixtrans-63.9-21.5174.1-65.2-173.8177.6-177.70113V84 D85 P86 N87 Q95V84-K89 HydrophobicContact CG1-CG 4.06Å; D85-K89 PolarHBondContact O-N 2.81Å; P86-K89 PolarHBondContact O-N 2.86Å; N87-K89 VanDerWaalsContact C-N 3.32Å; K89-Q95 PolarHBondContact O-NE2 3.49Å
90N67.2Low72.7Confident114 Ų11474.6 Ų74.661%0.6136%0.362SS*.G310 helixtrans-93.52.4178.2-66.2-32.4000113.4N87 S88 R92N87-N90 PolarHBondContact O-N 3.43Å; S88-N90 PolarHBondContact O-N 3.25Å; N90-R92 PolarHBondContact O-N 3.44Å
91D79.9Confident74.7Confident60 Ų6071.1 Ų71.132%0.32134%0.342SS..  trans-66.9124.2174.6-171.7-16.1000110.3S88 K93 L94 Q95S88-D91 WeakPolarHBondContact O-CB 3.2Å; S88-D91 PolarHBondContact O-N 3.01Å; S88-D91 VanDerWaalsContact O-N 3.14Å; D91-K93 VanDerWaalsContact C-N 3.26Å; D91-K93 PolarHBondContact O-N 3.03Å; D91-K93 PolarHBondContact OD1-N 2.93Å; D91-L94 HydrophobicContact CB-CB 4.08Å; D91-L94 PolarHBondContact O-N 2.86Å; D91-Q95 WeakPolarHBondContact O-CG 3.3Å; D91-Q95 PolarHBondContact O-N 3.36Å
92R82.4Confident76.5Confident213 Ų21367.1 Ų67.180%0.80433%0.328SS*.Hα-helixtrans-58.2-38.1179-67.2-177.565.8174.8-0.3112.2N90 Q95 E96N90-R92 PolarHBondContact O-N 3.44Å; R92-Q95 PolarHBondContact O-N 2.97Å; R92-E96 WeakPolarHBondContact O-CB 3.49Å; R92-E96 PolarHBondContact O-N 3.2Å
93K80.6Confident78.1Confident95 Ų9567.2 Ų67.241%0.41333%0.325SS..Hα-helixtrans-68.9-38.3-179.9-75.3-169.3169.8-163.40112D91 E96 L97 D209 V211D91-K93 VanDerWaalsContact C-N 3.26Å; D91-K93 PolarHBondContact O-N 3.03Å; D91-K93 PolarHBondContact OD1-N 2.93Å; K93-E96 PolarHBondContact O-N 3.31Å; K93-L97 PolarHBondContact O-N 2.9Å; K93-D209 PolarHBondContact NZ-O 3.11Å; K93-V211 HydrophobicContact CB-CG2 4.13Å
94L85.9Confident79.7Confident5 Ų565.4 Ų65.43%0.02632%0.316CS..Hα-helixtrans-66.6-42.5176.4-18061.3000111.1S88 D91 E96 L97 I98 L191 V211 I213S88-L94 VanDerWaalsContact O-CD2 3.29Å; S88-L94 WeakPolarHBondContact O-CD2 3.33Å; D91-L94 HydrophobicContact CB-CB 4.08Å; D91-L94 PolarHBondContact O-N 2.86Å; L94-E96 VanDerWaalsContact C-N 3.33Å; L94-E96 PolarHBondContact O-N 3.35Å; L94-L97 WeakPolarHBondContact O-CB 3.32Å; L94-L97 PolarHBondContact O-N 3.27Å; L94-I98 HydrophobicContact CD1-CD1 4.28Å; L94-I98 HydrophobicContact CD1-CG1 4.47Å; L94-I98 HydrophobicContact CG-CD1 4.01Å; L94-I98 WeakPolarHBondContact O-CG1 3.42Å; L94-I98 PolarHBondContact O-N 2.84Å; L94-L191 HydrophobicContact CD1-CD1 3.63Å; L94-V211 HydrophobicContact CB-CG1 4.26Å; L94-V211 HydrophobicContact CD1-CG1 4.02Å; L94-I213 HydrophobicContact CD1-CD1 3.56Å; L94-I213 HydrophobicContact CD1-CG1 3.81Å; L94-I213 HydrophobicContact CD2-CD1 4.03Å; L94-I213 HydrophobicContact CD2-CG1 3.98Å; L94-I213 HydrophobicContact CG-CD1 4.46Å; L94-I213 HydrophobicContact CG-CG1 4.5Å
95Q87.8Confident81.2Confident102 Ų10264 Ų6448%0.47731%0.308SS..Hα-helixtrans-63.3-39.7176-69.9-174.9-7.100112.2K89 D91 R92 I98 K99K89-Q95 PolarHBondContact O-NE2 3.49Å; D91-Q95 WeakPolarHBondContact O-CG 3.3Å; D91-Q95 PolarHBondContact O-N 3.36Å; R92-Q95 PolarHBondContact O-N 2.97Å; Q95-I98 PolarHBondContact O-N 3.18Å; Q95-K99 WeakPolarHBondContact O-CB 3.18Å; Q95-K99 PolarHBondContact O-N 3.35Å
96E87.8Confident82.8Confident113 Ų11365.3 Ų65.353%0.52832%0.315SS..Hα-helixtrans-61.8-46173.1-176174.2-167.200111.6R92 K93 L94 I98 K99 V100R92-E96 WeakPolarHBondContact O-CB 3.49Å; R92-E96 PolarHBondContact O-N 3.2Å; K93-E96 PolarHBondContact O-N 3.31Å; L94-E96 VanDerWaalsContact C-N 3.33Å; L94-E96 PolarHBondContact O-N 3.35Å; E96-I98 PolarHBondContact O-N 3.18Å; E96-K99 PolarHBondContact O-N 2.96Å; E96-V100 HydrophobicContact CG-CG2 4.48Å; E96-V100 WeakPolarHBondContact O-CG2 3.47Å; E96-V100 PolarHBondContact O-N 3.45Å
97L89.5Confident84.4Confident0 Ų067.6 Ų67.60%032%0.323CS..Hα-helixtrans-58.3-49.5176177.361.7000111.8K93 L94 K99 V100 L101 L191 V195 L207 P208 V211 I234 T235K93-L97 PolarHBondContact O-N 2.9Å; L94-L97 WeakPolarHBondContact O-CB 3.32Å; L94-L97 PolarHBondContact O-N 3.27Å; L97-K99 VanDerWaalsContact C-N 3.29Å; L97-K99 PolarHBondContact O-N 3.14Å; L97-V100 PolarHBondContact O-N 3.33Å; L97-L101 HydrophobicContact CD1-CD1 3.95Å; L97-L101 HydrophobicContact CD1-CG 4.15Å; L97-L101 HydrophobicContact CG-CD1 4.03Å; L97-L101 WeakPolarHBondContact O-CG 3.35Å; L97-L101 PolarHBondContact O-N 2.91Å; L97-L191 HydrophobicContact CD2-CD2 4.36Å; L97-L191 HydrophobicContact CG-CD2 4.42Å; L97-V195 HydrophobicContact CD1-CG2 4.3Å; L97-L207 HydrophobicContact CD1-CD2 3.74Å; L97-P208 HydrophobicContact CB-CG 3.62Å; L97-P208 HydrophobicContact CD1-CG 4.05Å; L97-P208 HydrophobicContact CG-CG 4.39Å; L97-V211 HydrophobicContact CB-CG2 4.44Å; L97-V211 HydrophobicContact CD2-CB 4.15Å; L97-V211 HydrophobicContact CD2-CG1 3.93Å; L97-V211 HydrophobicContact CD2-CG2 4.37Å; L97-I234 HydrophobicContact CD2-CB 4.3Å; L97-I234 HydrophobicContact CD2-CG2 3.59Å; L97-T235 HydrophobicContact CD1-CG2 3.99Å; L97-T235 HydrophobicContact CD2-CG2 4.01Å
98I92.2Very high86Confident42 Ų4263.4 Ų63.422%0.21530%0.302CS..Hα-helixtrans-57.7-46.7178.6-71.7166.3000109.8L94 Q95 E96 L101 I102 L119 I187 L191L94-I98 HydrophobicContact CD1-CD1 4.28Å; L94-I98 HydrophobicContact CD1-CG1 4.47Å; L94-I98 HydrophobicContact CG-CD1 4.01Å; L94-I98 WeakPolarHBondContact O-CG1 3.42Å; L94-I98 PolarHBondContact O-N 2.84Å; Q95-I98 PolarHBondContact O-N 3.18Å; E96-I98 PolarHBondContact O-N 3.18Å; I98-L101 PolarHBondContact O-N 3.44Å; I98-I102 HydrophobicContact CG2-CD1 3.67Å; I98-I102 HydrophobicContact CG2-CG1 4.39Å; I98-I102 VanDerWaalsContact O-CG1 3.29Å; I98-I102 WeakPolarHBondContact O-CG1 3.3Å; I98-I102 PolarHBondContact O-N 3.14Å; I98-L119 HydrophobicContact CB-CD1 4.42Å; I98-L119 HydrophobicContact CG1-CD1 4.37Å; I98-L119 HydrophobicContact CG2-CD1 4.01Å; I98-L119 HydrophobicContact CG2-CG 4.35Å; I98-I187 HydrophobicContact CD1-CD1 4.47Å; I98-L191 HydrophobicContact CG1-CD1 4.49Å; I98-L191 HydrophobicContact CG1-CD2 4.05Å
99K91.1Very high87.6Confident130 Ų13062.9 Ų62.957%0.56530%0.298SS*.Hα-helixtrans-60.7-49.5178.9-179.7175.2177.91750112Q95 E96 L97 L101 I102 D103Q95-K99 WeakPolarHBondContact O-CB 3.18Å; Q95-K99 PolarHBondContact O-N 3.35Å; E96-K99 PolarHBondContact O-N 2.96Å; L97-K99 VanDerWaalsContact C-N 3.29Å; L97-K99 PolarHBondContact O-N 3.14Å; K99-L101 VanDerWaalsContact C-N 3.27Å; K99-L101 PolarHBondContact O-N 3.48Å; K99-I102 PolarHBondContact O-N 3.48Å; K99-I102 VanDerWaalsContact O-N 3.15Å; K99-D103 WeakPolarHBondContact CE-OD2 3.34Å; K99-D103 WeakPolarHBondContact O-CB 3.47Å; K99-D103 PolarHBondContact O-N 3.12Å
100V90.3Very high89Confident30 Ų3061.8 Ų61.818%0.18230%0.302CS..Hα-helixtrans-58.4-40.9179.2168.10000111.3E96 L97 W104 I205E96-V100 HydrophobicContact CG-CG2 4.48Å; E96-V100 WeakPolarHBondContact O-CG2 3.47Å; E96-V100 PolarHBondContact O-N 3.45Å; L97-V100 PolarHBondContact O-N 3.33Å; V100-W104 WeakPolarHBondContact O-CB 3.42Å; V100-W104 PolarHBondContact O-N 3.41Å; V100-I205 HydrophobicContact CG1-CB 3.88Å; V100-I205 HydrophobicContact CG1-CD1 4.16Å; V100-I205 HydrophobicContact CG1-CG1 4.33Å; V100-I205 HydrophobicContact CG1-CG2 4.45Å
101L94.5Very high89.9Confident0 Ų059.8 Ų59.80%031%0.308CS..Hα-helixtrans-69.6-38.5177.1-68.9173.4000112.5L97 I98 K99 W104 I105 L119 L191 L194 V195 I205 L207L97-L101 HydrophobicContact CD1-CD1 3.95Å; L97-L101 HydrophobicContact CD1-CG 4.15Å; L97-L101 HydrophobicContact CG-CD1 4.03Å; L97-L101 WeakPolarHBondContact O-CG 3.35Å; L97-L101 PolarHBondContact O-N 2.91Å; I98-L101 PolarHBondContact O-N 3.44Å; K99-L101 VanDerWaalsContact C-N 3.27Å; K99-L101 PolarHBondContact O-N 3.48Å; L101-W104 HydrophobicContact CD2-CE3 4.13Å; L101-I105 WeakPolarHBondContact O-CD1 3.38Å; L101-I105 WeakPolarHBondContact O-CG1 3.49Å; L101-I105 PolarHBondContact O-N 2.9Å; L101-L119 HydrophobicContact CB-CD1 4.33Å; L101-L191 HydrophobicContact CD1-CD2 3.53Å; L101-L194 HydrophobicContact CB-CD1 4.46Å; L101-L194 HydrophobicContact CD1-CB 4.01Å; L101-L194 HydrophobicContact CD1-CD1 4.3Å; L101-L194 HydrophobicContact CD2-CB 4.15Å; L101-V195 HydrophobicContact CD1-CG2 4.37Å; L101-I205 HydrophobicContact CD2-CD1 4.08Å; L101-L207 HydrophobicContact CD2-CD2 3.92Å; L101-L207 HydrophobicContact CG-CD2 4.49Å
102I95Very high90.3Very high21 Ų2160.7 Ų60.711%0.10831%0.31CS..Hα-helixtrans-63.5-49.6174.7-72.1169.3000110.5I98 K99 W104 I105 N106 V116 K117 L119I98-I102 HydrophobicContact CG2-CD1 3.67Å; I98-I102 HydrophobicContact CG2-CG1 4.39Å; I98-I102 VanDerWaalsContact O-CG1 3.29Å; I98-I102 WeakPolarHBondContact O-CG1 3.3Å; I98-I102 PolarHBondContact O-N 3.14Å; K99-I102 PolarHBondContact O-N 3.48Å; K99-I102 VanDerWaalsContact O-N 3.15Å; I102-W104 VanDerWaalsContact C-N 3.28Å; I102-W104 PolarHBondContact O-N 3.44Å; I102-I105 PolarHBondContact O-N 3.25Å; I102-N106 WeakPolarHBondContact CG2-ND2 3.13Å; I102-N106 WeakPolarHBondContact O-CB 3.36Å; I102-N106 VanDerWaalsContact O-CG 3.28Å; I102-N106 PolarHBondContact O-N 3.32Å; I102-N106 PolarHBondContact O-ND2 2.87Å; I102-V116 HydrophobicContact CG1-CG1 4.27Å; I102-V116 WeakPolarHBondContact CG2-O 3.48Å; I102-K117 WeakPolarHBondContact CD1-O 3.44Å; I102-L119 HydrophobicContact CD1-CD2 4.48Å; I102-L119 HydrophobicContact CD1-CG 4.17Å; I102-L119 HydrophobicContact CG1-CD1 4.41Å; I102-L119 HydrophobicContact CG1-CD2 3.56Å; I102-L119 HydrophobicContact CG1-CG 3.73Å
103D91.1Very high90.7Very high73 Ų7361.5 Ų61.539%0.3931%0.313SS..Hα-helixtrans-58.6-43.5179.8-69.6-17.6000109.9K99 N106 D107K99-D103 WeakPolarHBondContact CE-OD2 3.34Å; K99-D103 WeakPolarHBondContact O-CB 3.47Å; K99-D103 PolarHBondContact O-N 3.12Å; D103-N106 PolarHBondContact O-N 2.73Å; D103-D107 WeakPolarHBondContact O-CB 3.3Å; D103-D107 VanDerWaalsContact O-CG 3.31Å; D103-D107 PolarHBondContact O-N 2.98Å
104W94.1Very high91.3Very high4 Ų458.9 Ų58.92%0.01530%0.303CS..Hα-helixtrans-58-52.1173.617447.4000113.9V100 L101 I102 N106 D107 V108 L132 L136 L194 L197 A203 I205V100-W104 WeakPolarHBondContact O-CB 3.42Å; V100-W104 PolarHBondContact O-N 3.41Å; L101-W104 HydrophobicContact CD2-CE3 4.13Å; I102-W104 VanDerWaalsContact C-N 3.28Å; I102-W104 PolarHBondContact O-N 3.44Å; W104-N106 VanDerWaalsContact C-N 3.25Å; W104-N106 PolarHBondContact O-N 3.48Å; W104-D107 PolarHBondContact O-N 3.45Å; W104-V108 WeakPolarHBondContact O-CG2 3.48Å; W104-V108 PolarHBondContact O-N 2.83Å; W104-L132 HydrophobicContact CH2-CD1 4.32Å; W104-L132 HydrophobicContact CH2-CD2 4.15Å; W104-L132 HydrophobicContact CZ2-CD1 4.3Å; W104-L132 HydrophobicContact CZ3-CD2 4.19Å; W104-L136 HydrophobicContact CH2-CD1 4Å; W104-L136 HydrophobicContact CZ2-CD1 3.82Å; W104-L136 HydrophobicContact CZ2-CD2 4.06Å; W104-L194 HydrophobicContact CZ3-CD2 4.34Å; W104-L197 HydrophobicContact CH2-CB 4.1Å; W104-A203 HydrophobicContact CD2-CB 4.03Å; W104-A203 HydrophobicContact CG-CB 4.25Å; W104-A203 HydrophobicContact CZ2-CB 3.75Å; W104-I205 HydrophobicContact CB-CD1 3.78Å; W104-I205 HydrophobicContact CB-CG2 3.65Å; W104-I205 HydrophobicContact CD2-CD1 3.88Å; W104-I205 HydrophobicContact CE3-CD1 4.12Å; W104-I205 HydrophobicContact CG-CD1 3.72Å; W104-I205 HydrophobicContact CG-CG2 3.93Å
105I96Very high91.7Very high0 Ų064.6 Ų64.60%033%0.332CS..Hα-helixtrans-61.4-41.2-178.3-65.7164.5000109.8L101 I102 V108 L109 V116 L119 L123 V128 L132 L194L101-I105 WeakPolarHBondContact O-CD1 3.38Å; L101-I105 WeakPolarHBondContact O-CG1 3.49Å; L101-I105 PolarHBondContact O-N 2.9Å; I102-I105 PolarHBondContact O-N 3.25Å; I105-V108 PolarHBondContact O-N 2.96Å; I105-L109 HydrophobicContact CG2-CD1 3.72Å; I105-L109 HydrophobicContact CG2-CG 4.33Å; I105-L109 WeakPolarHBondContact O-CB 3.2Å; I105-L109 WeakPolarHBondContact O-CG 3.18Å; I105-L109 PolarHBondContact O-N 3.23Å; I105-V116 HydrophobicContact CB-CG2 4.49Å; I105-V116 HydrophobicContact CG2-CB 4.48Å; I105-V116 HydrophobicContact CG2-CG2 3.65Å; I105-L119 HydrophobicContact CD1-CD2 3.82Å; I105-L123 HydrophobicContact CD1-CD2 4.41Å; I105-V128 HydrophobicContact CG2-CG1 3.94Å; I105-L132 HydrophobicContact CD1-CD2 4.43Å; I105-L132 HydrophobicContact CG1-CD1 4.35Å; I105-L132 HydrophobicContact CG1-CD2 3.96Å; I105-L132 HydrophobicContact CG2-CD1 4.47Å; I105-L194 HydrophobicContact CD1-CD1 3.95Å; I105-L194 HydrophobicContact CD1-CD2 3.8Å; I105-L194 HydrophobicContact CG1-CD2 4.5Å
106N95.2Very high92Very high33 Ų3359.9 Ų59.918%0.17631%0.311CS..Hα-helixtrans-62.6-43.8177-74.9-26.5000112.1I102 D103 W104 V108 L109 V110 I115 V116I102-N106 WeakPolarHBondContact CG2-ND2 3.13Å; I102-N106 WeakPolarHBondContact O-CB 3.36Å; I102-N106 VanDerWaalsContact O-CG 3.28Å; I102-N106 PolarHBondContact O-N 3.32Å; I102-N106 PolarHBondContact O-ND2 2.87Å; D103-N106 PolarHBondContact O-N 2.73Å; W104-N106 VanDerWaalsContact C-N 3.25Å; W104-N106 PolarHBondContact O-N 3.48Å; N106-V108 VanDerWaalsContact C-N 3.34Å; N106-V108 PolarHBondContact O-N 2.78Å; N106-L109 PolarHBondContact O-N 2.62Å; N106-V110 WeakPolarHBondContact O-CA 3.37Å; N106-V110 WeakPolarHBondContact O-CB 3.43Å; N106-V110 PolarHBondContact O-N 2.99Å; N106-I115 WeakPolarHBondContact OD1-CA 3.35Å; N106-V116 PolarHBondContact ND2-O 3.22Å; N106-V116 PolarHBondContact OD1-N 3.3Å; N106-V116 PolarHBondContact OD1-O 3.43Å
107D91.6Very high92.3Very high126 Ų12662.7 Ų62.767%0.67432%0.321SS*.Hα-helixtrans-63.6-39.8177.2-75.1-16000111.9D103 W104 V110D103-D107 WeakPolarHBondContact O-CB 3.3Å; D103-D107 VanDerWaalsContact O-CG 3.31Å; D103-D107 PolarHBondContact O-N 2.98Å; W104-D107 PolarHBondContact O-N 3.45Å; D107-V110 WeakPolarHBondContact O-CG1 3.31Å
108V91.7Very high92.5Very high32 Ų3266.1 Ų66.119%0.19434%0.339CS..Hα-helixtrans-68.7-38.9177.7174.50000111.5W104 I105 N106 L132 K135 L136W104-V108 WeakPolarHBondContact O-CG2 3.48Å; W104-V108 PolarHBondContact O-N 2.83Å; I105-V108 PolarHBondContact O-N 2.96Å; N106-V108 VanDerWaalsContact C-N 3.34Å; N106-V108 PolarHBondContact O-N 2.78Å; V108-L132 HydrophobicContact CB-CD1 4.16Å; V108-L132 HydrophobicContact CG1-CD1 3.9Å; V108-K135 HydrophobicContact CG1-CB 3.88Å; V108-K135 HydrophobicContact CG1-CG 3.48Å; V108-K135 VanDerWaalsContact CG1-CG 3.48Å; V108-L136 HydrophobicContact CG1-CD2 4.49Å
109L93.9Very high92.6Very high1 Ų164.2 Ų64.21%0.00533%0.33CS..Hα-helixtrans-99.64-172.8-60-177.9000115I105 N106 G111 E112 R113 I114 V128 K131 L132 K135I105-L109 HydrophobicContact CG2-CD1 3.72Å; I105-L109 HydrophobicContact CG2-CG 4.33Å; I105-L109 WeakPolarHBondContact O-CB 3.2Å; I105-L109 WeakPolarHBondContact O-CG 3.18Å; I105-L109 PolarHBondContact O-N 3.23Å; N106-L109 PolarHBondContact O-N 2.62Å; L109-G111 PolarHBondContact O-N 3.21Å; L109-G111 VanDerWaalsContact O-N 3.14Å; L109-E112 WeakPolarHBondContact O-CA 3.5Å; L109-E112 PolarHBondContact O-N 2.76Å; L109-R113 PolarHBondContact O-N 2.86Å; L109-I114 HydrophobicContact CB-CB 3.99Å; L109-I114 HydrophobicContact CD1-CB 4.3Å; L109-I114 HydrophobicContact CD1-CD1 4.23Å; L109-I114 HydrophobicContact CD1-CG2 4.03Å; L109-V128 HydrophobicContact CD1-CG1 4.05Å; L109-K131 HydrophobicContact CD1-CB 4.29Å; L109-K131 HydrophobicContact CD2-CB 3.98Å; L109-L132 HydrophobicContact CD1-CB 4.38Å; L109-K135 HydrophobicContact CD2-CB 4.31Å
110V90.8Very high92.7Very high104 Ų10459.2 Ų59.263%0.6331%0.31SS*.G310 helixtrans-54.5-36.117969.10000112.5N106 D107 E112 R113N106-V110 WeakPolarHBondContact O-CA 3.37Å; N106-V110 WeakPolarHBondContact O-CB 3.43Å; N106-V110 PolarHBondContact O-N 2.99Å; D107-V110 WeakPolarHBondContact O-CG1 3.31Å; V110-E112 VanDerWaalsContact C-N 3.26Å; V110-E112 PolarHBondContact O-N 2.98Å; V110-R113 PolarHBondContact O-N 3.18Å; V110-R113 VanDerWaalsContact O-N 3.1Å
111G85.7Confident92.9Very high72 Ų7262.3 Ų62.374%0.74232%0.323SS*.G310 helixtrans-66-26.4177.500000113.8L109L109-G111 PolarHBondContact O-N 3.21Å; L109-G111 VanDerWaalsContact O-N 3.14Å
112E88.5Confident92.9Very high79 Ų7964.7 Ų64.737%0.36934%0.336SS..G310 helixtrans-920.7176.3-62.8-165.8-15200112.6L109 V110 I114 K131L109-E112 WeakPolarHBondContact O-CA 3.5Å; L109-E112 PolarHBondContact O-N 2.76Å; V110-E112 VanDerWaalsContact C-N 3.26Å; V110-E112 PolarHBondContact O-N 2.98Å; E112-I114 HydrophobicContact CB-CD1 3.9Å; E112-I114 HydrophobicContact CB-CG1 4.09Å; E112-I114 PolarHBondContact O-N 3.25Å; E112-K131 WeakPolarHBondContact OE2-CD 3.02Å; E112-K131 WeakPolarHBondContact OE2-CE 3.35Å; E112-K131 IonicContact OE2-NZ 3.65Å
113R91.6Very high92.9Very high230 Ų23063.7 Ų63.787%0.86833%0.33SS*.THydrogen-bonded Turntrans58.931.1-177.6-53.8176.9176.5157.8-0.9113.2L109 V110L109-R113 PolarHBondContact O-N 2.86Å; V110-R113 PolarHBondContact O-N 3.18Å; V110-R113 VanDerWaalsContact O-N 3.1Å
114I92.4Very high93Very high39 Ų3963.1 Ų63.120%0.232%0.323CS..  trans-91.8134.7174.2-61.2169.5000107.8L109 E112 V128 K131L109-I114 HydrophobicContact CB-CB 3.99Å; L109-I114 HydrophobicContact CD1-CB 4.3Å; L109-I114 HydrophobicContact CD1-CD1 4.23Å; L109-I114 HydrophobicContact CD1-CG2 4.03Å; E112-I114 HydrophobicContact CB-CD1 3.9Å; E112-I114 HydrophobicContact CB-CG1 4.09Å; E112-I114 PolarHBondContact O-N 3.25Å; I114-V128 HydrophobicContact CG2-CG2 4.14Å; I114-K131 HydrophobicContact CD1-CB 3.78Å; I114-K131 HydrophobicContact CD1-CG 3.68Å
115I94.3Very high92.8Very high125 Ų12564.7 Ų64.764%0.64133%0.332SS*.  trans-130.1113.9177.8-58173.9000107.9N106 K117N106-I115 WeakPolarHBondContact OD1-CA 3.35Å; I115-K117 HydrophobicContact CG2-CG 4.45Å
116V95.8Very high92.6Very high3 Ų364.7 Ų64.72%0.01833%0.332CS..  trans-88.4134.2172.5-179.90000109.1I102 I105 N106 L119 D122 L123 V128I102-V116 HydrophobicContact CG1-CG1 4.27Å; I102-V116 WeakPolarHBondContact CG2-O 3.48Å; I105-V116 HydrophobicContact CB-CG2 4.49Å; I105-V116 HydrophobicContact CG2-CB 4.48Å; I105-V116 HydrophobicContact CG2-CG2 3.65Å; N106-V116 PolarHBondContact ND2-O 3.22Å; N106-V116 PolarHBondContact OD1-N 3.3Å; N106-V116 PolarHBondContact OD1-O 3.43Å; V116-L119 HydrophobicContact CG1-CD2 4.09Å; V116-D122 WeakPolarHBondContact CA-OD2 3.37Å; V116-D122 HydrophobicContact CG1-CB 4.03Å; V116-D122 HydrophobicContact CG2-CB 4.46Å; V116-L123 HydrophobicContact CG1-CD1 4.1Å; V116-L123 HydrophobicContact CG2-CD1 4.49Å; V116-V128 HydrophobicContact CG2-CG1 3.62Å; V116-V128 HydrophobicContact CG2-CG2 4.32Å
117K93.3Very high92.5Very high172 Ų17265 Ų6575%0.74833%0.332SS*.SBendtrans-122.1-33.3175.8-65-179.5-178.4175.50112I102 I115 D122I102-K117 WeakPolarHBondContact CD1-O 3.44Å; I115-K117 HydrophobicContact CG2-CG 4.45Å; K117-D122 PolarHBondContact N-OD2 2.82Å
118D94.5Very high92.7Very high72 Ų7259.7 Ų59.739%0.38530%0.304SS..  trans-137.1119.2179.6-174.5-66.2000109.7T120 E121 D122D118-T120 PolarHBondContact O-N 2.89Å; D118-T120 WeakPolarHBondContact OD1-CA 3.37Å; D118-T120 WeakPolarHBondContact OD1-CB 3.39Å; D118-T120 PolarHBondContact OD1-N 3.33Å; D118-T120 PolarHBondContact OD1-OG1 3.43Å; D118-E121 HydrophobicContact CB-CB 4.08Å; D118-E121 HydrophobicContact CB-CG 4.26Å; D118-E121 PolarHBondContact O-N 2.95Å; D118-E121 PolarHBondContact OD1-N 3.45Å; D118-D122 PolarHBondContact N-OD2 3.44Å; D118-D122 VanDerWaalsContact O-CB 3.24Å; D118-D122 WeakPolarHBondContact O-CB 3.43Å; D118-D122 VanDerWaalsContact O-CG 3.31Å; D118-D122 PolarHBondContact O-N 2.95Å; D118-D122 VanDerWaalsContact O-OD2 3.13Å
119L94.1Very high92.8Very high2 Ų258.1 Ų58.11%0.0130%0.295CS..Hα-helixtrans-60.9-32.4-176.3-64.6179.9000112.8I98 L101 I102 I105 V116 L123 I187 I190 L191 L194I98-L119 HydrophobicContact CB-CD1 4.42Å; I98-L119 HydrophobicContact CG1-CD1 4.37Å; I98-L119 HydrophobicContact CG2-CD1 4.01Å; I98-L119 HydrophobicContact CG2-CG 4.35Å; L101-L119 HydrophobicContact CB-CD1 4.33Å; I102-L119 HydrophobicContact CD1-CD2 4.48Å; I102-L119 HydrophobicContact CD1-CG 4.17Å; I102-L119 HydrophobicContact CG1-CD1 4.41Å; I102-L119 HydrophobicContact CG1-CD2 3.56Å; I102-L119 HydrophobicContact CG1-CG 3.73Å; I105-L119 HydrophobicContact CD1-CD2 3.82Å; V116-L119 HydrophobicContact CG1-CD2 4.09Å; L119-L123 HydrophobicContact CD2-CD1 4.29Å; L119-L123 HydrophobicContact CD2-CD2 4.37Å; L119-L123 VanDerWaalsContact O-CB 3.31Å; L119-L123 WeakPolarHBondContact O-CB 3.21Å; L119-L123 PolarHBondContact O-N 2.96Å; L119-I187 HydrophobicContact CB-CD1 4.27Å; L119-I187 HydrophobicContact CD1-CD1 4.47Å; L119-I190 HydrophobicContact CB-CG2 4.11Å; L119-L191 HydrophobicContact CD1-CD2 3.89Å; L119-L194 HydrophobicContact CD1-CD1 3.92Å; L119-L194 HydrophobicContact CD2-CD1 3.8Å; L119-L194 HydrophobicContact CG-CD1 4.38Å
120T92.6Very high92.8Very high26 Ų2658.3 Ų58.316%0.1630%0.295CS..Hα-helixtrans-80.7-35.5-17960.10000112.6D118 Y124 I187 I190D118-T120 PolarHBondContact O-N 2.89Å; D118-T120 WeakPolarHBondContact OD1-CA 3.37Å; D118-T120 WeakPolarHBondContact OD1-CB 3.39Å; D118-T120 PolarHBondContact OD1-N 3.33Å; D118-T120 PolarHBondContact OD1-OG1 3.43Å; T120-Y124 WeakPolarHBondContact O-CB 3.43Å; T120-I187 HydrophobicContact CG2-CB 3.75Å; T120-I187 HydrophobicContact CG2-CD1 3.86Å; T120-I187 HydrophobicContact CG2-CG1 4.31Å; T120-I190 HydrophobicContact CG2-CD1 4.24Å
121E93.2Very high93Very high95 Ų9555 Ų5544%0.44427%0.273SS..Hα-helixtrans-83.7-27179.9-62.4-61.5128.800113.3D118 Y124 K185D118-E121 HydrophobicContact CB-CB 4.08Å; D118-E121 HydrophobicContact CB-CG 4.26Å; D118-E121 PolarHBondContact O-N 2.95Å; D118-E121 PolarHBondContact OD1-N 3.45Å; E121-Y124 WeakPolarHBondContact O-CD1 3.25Å; E121-Y124 WeakPolarHBondContact O-CE1 3.03Å; E121-K185 WeakPolarHBondContact OE1-CD 3.41Å; E121-K185 WeakPolarHBondContact OE1-CE 3.2Å; E121-K185 IonicContact OE1-NZ 2.75Å; E121-K185 PolarHBondContact OE1-NZ 2.88Å; E121-K185 IonicContact OE2-NZ 2.66Å; E121-K185 PolarHBondContact OE2-NZ 3.33Å
122D95Very high93.4Very high50 Ų5051.5 Ų51.527%0.26724%0.237SC..Hα-helixtrans-97.5-20.9-174.3-62.9-41000113.4V116 K117 D118 V128V116-D122 WeakPolarHBondContact CA-OD2 3.37Å; V116-D122 HydrophobicContact CG1-CB 4.03Å; V116-D122 HydrophobicContact CG2-CB 4.46Å; K117-D122 PolarHBondContact N-OD2 2.82Å; D118-D122 PolarHBondContact N-OD2 3.44Å; D118-D122 VanDerWaalsContact O-CB 3.24Å; D118-D122 WeakPolarHBondContact O-CB 3.43Å; D118-D122 VanDerWaalsContact O-CG 3.31Å; D118-D122 PolarHBondContact O-N 2.95Å; D118-D122 VanDerWaalsContact O-OD2 3.13Å; D122-V128 HydrophobicContact CB-CG2 4.41Å; D122-V128 WeakPolarHBondContact O-CB 3.24Å; D122-V128 WeakPolarHBondContact O-CG2 3.48Å
123L94.8Very high93.7Very high0 Ų047.8 Ų47.80%022%0.22CC..Hα-helixtrans-104.4-14.3-176.2-74.758.5000114.1I105 V116 L119 D125 G126 V128 L129 I190 L194I105-L123 HydrophobicContact CD1-CD2 4.41Å; V116-L123 HydrophobicContact CG1-CD1 4.1Å; V116-L123 HydrophobicContact CG2-CD1 4.49Å; L119-L123 HydrophobicContact CD2-CD1 4.29Å; L119-L123 HydrophobicContact CD2-CD2 4.37Å; L119-L123 VanDerWaalsContact O-CB 3.31Å; L119-L123 WeakPolarHBondContact O-CB 3.21Å; L119-L123 PolarHBondContact O-N 2.96Å; L123-D125 VanDerWaalsContact C-N 3.25Å; L123-D125 PolarHBondContact O-N 3.39Å; L123-G126 PolarHBondContact O-N 2.93Å; L123-G126 VanDerWaalsContact O-N 3.12Å; L123-V128 HydrophobicContact CD1-CB 4.12Å; L123-V128 HydrophobicContact CD1-CG1 3.81Å; L123-V128 HydrophobicContact CG-CB 4.26Å; L123-V128 HydrophobicContact CG-CG1 4.14Å; L123-L129 HydrophobicContact CB-CD1 4.31Å; L123-L129 HydrophobicContact CB-CG 4.07Å; L123-L129 HydrophobicContact CD2-CD2 3.83Å; L123-L129 HydrophobicContact CD2-CG 4.22Å; L123-L129 HydrophobicContact CG-CD2 4.21Å; L123-L129 HydrophobicContact CG-CG 4.08Å; L123-I190 HydrophobicContact CD2-CG2 3.75Å; L123-L194 HydrophobicContact CD2-CD1 3.77Å; L123-L194 HydrophobicContact CD2-CD2 3.96Å; L123-L194 HydrophobicContact CD2-CG 4.15Å
124Y93.5Very high93.8Very high61 Ų6137.5 Ų37.524%0.23918%0.182CC..THydrogen-bonded Turntrans-64.6-24.3-17081.8-79.4000114.6T120 E121 L157 K185T120-Y124 WeakPolarHBondContact O-CB 3.43Å; E121-Y124 WeakPolarHBondContact O-CD1 3.25Å; E121-Y124 WeakPolarHBondContact O-CE1 3.03Å; Y124-L157 WeakPolarHBondContact O-CD1 3.19Å; Y124-K185 HydrophobicContact CG-CG 4.17Å
125D90.3Very high93.7Very high36 Ų3641.7 Ų41.719%0.19320%0.198CC..THydrogen-bonded Turntrans-90.9-4.7-17973.2-4.3000112.9L123 Q127 Q153L123-D125 VanDerWaalsContact C-N 3.25Å; L123-D125 PolarHBondContact O-N 3.39Å; D125-Q127 VanDerWaalsContact C-N 3.33Å; D125-Q127 VanDerWaalsContact OD1-CB 3.29Å; D125-Q127 WeakPolarHBondContact OD1-CB 3.48Å; D125-Q127 PolarHBondContact OD1-N 3.47Å; D125-Q153 HydrophobicContact CB-CG 4.03Å
126G92.1Very high93.5Very high0 Ų037.7 Ų37.70%018%0.178CC..SBendtrans81.3-1.3-179.900000115.5L123 Q130 L157L123-G126 PolarHBondContact O-N 2.93Å; L123-G126 VanDerWaalsContact O-N 3.12Å; G126-Q130 WeakPolarHBondContact O-CB 3.23Å; G126-Q130 PolarHBondContact O-N 3.13Å; G126-L157 VanDerWaalsContact CA-CD2 3.47Å
127Q92.9Very high93.1Very high40 Ų4040.8 Ų40.819%0.18719%0.192CC..Hα-helixtrans-69.1-52.1-176.7-176.159.535.100112.2D125 L129 Q130 K131 E145D125-Q127 VanDerWaalsContact C-N 3.33Å; D125-Q127 VanDerWaalsContact OD1-CB 3.29Å; D125-Q127 WeakPolarHBondContact OD1-CB 3.48Å; D125-Q127 PolarHBondContact OD1-N 3.47Å; Q127-L129 VanDerWaalsContact C-N 3.31Å; Q127-L129 PolarHBondContact O-N 3.19Å; Q127-Q130 WeakPolarHBondContact O-CB 3.33Å; Q127-Q130 PolarHBondContact O-N 3.01Å; Q127-K131 PolarHBondContact O-N 3.48Å; Q127-K131 VanDerWaalsContact O-N 3.14Å; Q127-E145 VanDerWaalsContact CD-O 3.27Å; Q127-E145 PolarHBondContact NE2-O 2.71Å; Q127-E145 PolarHBondContact OE1-O 3.38Å
128V95.1Very high92.8Very high14 Ų1435.8 Ų35.89%0.08519%0.19CC..Hα-helixtrans-64.9-39.9178.9173.60000110.5I105 L109 I114 V116 D122 L123 Q130 K131 L132I105-V128 HydrophobicContact CG2-CG1 3.94Å; L109-V128 HydrophobicContact CD1-CG1 4.05Å; I114-V128 HydrophobicContact CG2-CG2 4.14Å; V116-V128 HydrophobicContact CG2-CG1 3.62Å; V116-V128 HydrophobicContact CG2-CG2 4.32Å; D122-V128 HydrophobicContact CB-CG2 4.41Å; D122-V128 WeakPolarHBondContact O-CB 3.24Å; D122-V128 WeakPolarHBondContact O-CG2 3.48Å; L123-V128 HydrophobicContact CD1-CB 4.12Å; L123-V128 HydrophobicContact CD1-CG1 3.81Å; L123-V128 HydrophobicContact CG-CB 4.26Å; L123-V128 HydrophobicContact CG-CG1 4.14Å; V128-Q130 PolarHBondContact O-N 3.25Å; V128-K131 PolarHBondContact O-N 2.98Å; V128-L132 VanDerWaalsContact O-CB 3.3Å; V128-L132 WeakPolarHBondContact O-CB 3.31Å; V128-L132 PolarHBondContact O-N 2.93Å
129L95.1Very high92.3Very high0 Ų037.9 Ų37.90%020%0.197CC..Hα-helixtrans-61.6-42.3176.7-74.4174.5000112.4L123 Q127 F133 L157 V160 V182 L193 L194L123-L129 HydrophobicContact CB-CD1 4.31Å; L123-L129 HydrophobicContact CB-CG 4.07Å; L123-L129 HydrophobicContact CD2-CD2 3.83Å; L123-L129 HydrophobicContact CD2-CG 4.22Å; L123-L129 HydrophobicContact CG-CD2 4.21Å; L123-L129 HydrophobicContact CG-CG 4.08Å; Q127-L129 VanDerWaalsContact C-N 3.31Å; Q127-L129 PolarHBondContact O-N 3.19Å; L129-F133 WeakPolarHBondContact O-CB 3.33Å; L129-F133 PolarHBondContact O-N 2.83Å; L129-L157 HydrophobicContact CD1-CD2 4.07Å; L129-V160 HydrophobicContact CB-CG1 4.06Å; L129-V182 HydrophobicContact CD1-CG1 4.03Å; L129-L193 HydrophobicContact CD1-CD2 3.77Å; L129-L193 HydrophobicContact CD2-CD2 3.79Å; L129-L193 HydrophobicContact CG-CD2 4.45Å; L129-L194 HydrophobicContact CD2-CD2 4.23Å
130Q93.9Very high91.9Very high4 Ų446.7 Ų46.72%0.01924%0.235CC..Hα-helixtrans-56.6-54.8173.3177.8-161.9-15.800110.2G126 Q127 V128 L132 F133 E134 L141 V143 V160G126-Q130 WeakPolarHBondContact O-CB 3.23Å; G126-Q130 PolarHBondContact O-N 3.13Å; Q127-Q130 WeakPolarHBondContact O-CB 3.33Å; Q127-Q130 PolarHBondContact O-N 3.01Å; V128-Q130 PolarHBondContact O-N 3.25Å; Q130-L132 VanDerWaalsContact C-N 3.35Å; Q130-L132 PolarHBondContact O-N 3.28Å; Q130-F133 PolarHBondContact O-N 3.03Å; Q130-E134 HydrophobicContact CG-CG 4.22Å; Q130-E134 PolarHBondContact NE2-OE1 3.34Å; Q130-E134 WeakPolarHBondContact O-CG 3.25Å; Q130-E134 PolarHBondContact O-N 3.49Å; Q130-L141 HydrophobicContact CG-CB 4.34Å; Q130-L141 HydrophobicContact CG-CD1 4.11Å; Q130-V143 HydrophobicContact CG-CG2 3.7Å; Q130-V143 VanDerWaalsContact OE1-CG2 3.24Å; Q130-V160 HydrophobicContact CB-CG2 3.85Å; Q130-V160 HydrophobicContact CG-CG2 4.35Å
131K94.1Very high91.7Very high34 Ų3446 Ų4615%0.14823%0.23CC..Hα-helixtrans-63.3-41.4-175.5-67.4-48.7-161.1172.80112.9L109 E112 I114 Q127 V128 F133 E134 K135L109-K131 HydrophobicContact CD1-CB 4.29Å; L109-K131 HydrophobicContact CD2-CB 3.98Å; E112-K131 WeakPolarHBondContact OE2-CD 3.02Å; E112-K131 WeakPolarHBondContact OE2-CE 3.35Å; E112-K131 IonicContact OE2-NZ 3.65Å; I114-K131 HydrophobicContact CD1-CB 3.78Å; I114-K131 HydrophobicContact CD1-CG 3.68Å; Q127-K131 PolarHBondContact O-N 3.48Å; Q127-K131 VanDerWaalsContact O-N 3.14Å; V128-K131 PolarHBondContact O-N 2.98Å; K131-F133 VanDerWaalsContact C-N 3.34Å; K131-F133 PolarHBondContact O-N 3.48Å; K131-E134 VanDerWaalsContact CD-OE2 3.3Å; K131-E134 WeakPolarHBondContact CD-OE2 3.38Å; K131-E134 IonicContact NZ-OE2 2.87Å; K131-E134 PolarHBondContact NZ-OE2 2.87Å; K131-E134 PolarHBondContact O-N 2.96Å; K131-K135 WeakPolarHBondContact O-CB 3.34Å; K131-K135 PolarHBondContact O-N 3Å
132L94.9Very high91.3Very high0 Ų049.3 Ų49.30%025%0.251CS..Hα-helixtrans-56.8-50.8173.3-179.663.7000110.5W104 I105 V108 L109 V128 Q130 K135 L136 L194 L197W104-L132 HydrophobicContact CH2-CD1 4.32Å; W104-L132 HydrophobicContact CH2-CD2 4.15Å; W104-L132 HydrophobicContact CZ2-CD1 4.3Å; W104-L132 HydrophobicContact CZ3-CD2 4.19Å; I105-L132 HydrophobicContact CD1-CD2 4.43Å; I105-L132 HydrophobicContact CG1-CD1 4.35Å; I105-L132 HydrophobicContact CG1-CD2 3.96Å; I105-L132 HydrophobicContact CG2-CD1 4.47Å; V108-L132 HydrophobicContact CB-CD1 4.16Å; V108-L132 HydrophobicContact CG1-CD1 3.9Å; L109-L132 HydrophobicContact CD1-CB 4.38Å; V128-L132 VanDerWaalsContact O-CB 3.3Å; V128-L132 WeakPolarHBondContact O-CB 3.31Å; V128-L132 PolarHBondContact O-N 2.93Å; Q130-L132 VanDerWaalsContact C-N 3.35Å; Q130-L132 PolarHBondContact O-N 3.28Å; L132-K135 PolarHBondContact O-N 3.47Å; L132-L136 HydrophobicContact CD1-CD1 3.96Å; L132-L136 HydrophobicContact CD1-CG 4.3Å; L132-L136 HydrophobicContact CG-CD1 3.86Å; L132-L136 WeakPolarHBondContact O-CG 3.21Å; L132-L136 PolarHBondContact O-N 2.75Å; L132-L194 HydrophobicContact CD2-CD2 3.89Å; L132-L197 HydrophobicContact CD2-CD1 4.38Å
133F94.1Very high90.7Very high0 Ų048.2 Ų48.20%025%0.246CC..Hα-helixtrans-66.2-43.6-178.4-174.3-104.6000112.9L129 Q130 K131 K135 L136 E137 L141 R163 I164 L197 F201L129-F133 WeakPolarHBondContact O-CB 3.33Å; L129-F133 PolarHBondContact O-N 2.83Å; Q130-F133 PolarHBondContact O-N 3.03Å; K131-F133 VanDerWaalsContact C-N 3.34Å; K131-F133 PolarHBondContact O-N 3.48Å; F133-K135 PolarHBondContact O-N 3.05Å; F133-L136 PolarHBondContact O-N 3.21Å; F133-L136 VanDerWaalsContact O-N 3.13Å; F133-E137 HydrophobicContact CE1-CB 4.4Å; F133-E137 WeakPolarHBondContact CE1-OE2 3.46Å; F133-E137 HydrophobicContact CZ-CB 4.31Å; F133-E137 HydrophobicContact CZ-CG 4.48Å; F133-E137 WeakPolarHBondContact CZ-OE2 3.2Å; F133-E137 WeakPolarHBondContact O-CB 3.49Å; F133-E137 PolarHBondContact O-N 2.91Å; F133-L141 HydrophobicContact CD1-CD1 3.79Å; F133-L141 HydrophobicContact CD1-CD2 4.26Å; F133-L141 HydrophobicContact CD1-CG 4.18Å; F133-L141 HydrophobicContact CE1-CD1 4.44Å; F133-L141 HydrophobicContact CE1-CD2 4.16Å; F133-R163 HydrophobicContact CE1-CB 3.85Å; F133-R163 HydrophobicContact CZ-CB 4.29Å; F133-I164 HydrophobicContact CB-CD1 4.45Å; F133-I164 HydrophobicContact CB-CG1 4.26Å; F133-I164 HydrophobicContact CD1-CG1 4.36Å; F133-I164 HydrophobicContact CD2-CB 4.44Å; F133-I164 HydrophobicContact CD2-CD1 4.38Å; F133-I164 HydrophobicContact CD2-CG1 3.43Å; F133-I164 VanDerWaalsContact CD2-CG1 3.43Å; F133-I164 HydrophobicContact CE2-CB 4.33Å; F133-I164 HydrophobicContact CE2-CG1 3.75Å; F133-I164 HydrophobicContact CG-CD1 4.45Å; F133-I164 HydrophobicContact CG-CG1 3.75Å; F133-I164 HydrophobicContact CZ-CG1 4.33Å; F133-L197 HydrophobicContact CD2-CD2 4.15Å; F133-F201 HydrophobicContact CD2-CE2 4.15Å; F133-F201 HydrophobicContact CD2-CZ 4.24Å; F133-F201 HydrophobicContact CE2-CE2 4.02Å; F133-F201 AromaticContact CE2-CZ 3.85Å; F133-F201 HydrophobicContact CE2-CZ 3.85Å
134E93.1Very high90Very high15 Ų1551.2 Ų51.27%0.0727%0.271CS..Hα-helixtrans-56.5-38.5175-71.2-178.7161.400111.7Q130 K131 G138 E139 L141Q130-E134 HydrophobicContact CG-CG 4.22Å; Q130-E134 PolarHBondContact NE2-OE1 3.34Å; Q130-E134 WeakPolarHBondContact O-CG 3.25Å; Q130-E134 PolarHBondContact O-N 3.49Å; K131-E134 VanDerWaalsContact CD-OE2 3.3Å; K131-E134 WeakPolarHBondContact CD-OE2 3.38Å; K131-E134 IonicContact NZ-OE2 2.87Å; K131-E134 PolarHBondContact NZ-OE2 2.87Å; K131-E134 PolarHBondContact O-N 2.96Å; E134-G138 VanDerWaalsContact O-CA 3.31Å; E134-G138 WeakPolarHBondContact O-CA 3.22Å; E134-G138 PolarHBondContact O-N 2.95Å; E134-E139 VanDerWaalsContact CA-O 3.24Å; E134-E139 WeakPolarHBondContact CA-O 3.3Å; E134-E139 WeakPolarHBondContact CB-O 3.41Å; E134-E139 WeakPolarHBondContact CG-O 3.3Å; E134-L141 HydrophobicContact CG-CB 4.29Å; E134-L141 HydrophobicContact CG-CG 4.12Å; E134-L141 PolarHBondContact OE1-N 3.36Å
135K91.7Very high89.1Confident127 Ų12755.4 Ų55.455%0.55229%0.293SS*.Hα-helixtrans-73.3-35.5179.2-169.559.6174.3178.60112.9V108 L109 K131 L132 F133V108-K135 HydrophobicContact CG1-CB 3.88Å; V108-K135 HydrophobicContact CG1-CG 3.48Å; V108-K135 VanDerWaalsContact CG1-CG 3.48Å; L109-K135 HydrophobicContact CD2-CB 4.31Å; K131-K135 WeakPolarHBondContact O-CB 3.34Å; K131-K135 PolarHBondContact O-N 3Å; L132-K135 PolarHBondContact O-N 3.47Å; F133-K135 PolarHBondContact O-N 3.05Å
136L89.1Confident88.5Confident41 Ų4159 Ų5922%0.21532%0.316CS..Hα-helixtrans-77.3-41.9-179.7-69173000112.6W104 V108 L132 F133 F201W104-L136 HydrophobicContact CH2-CD1 4Å; W104-L136 HydrophobicContact CZ2-CD1 3.82Å; W104-L136 HydrophobicContact CZ2-CD2 4.06Å; V108-L136 HydrophobicContact CG1-CD2 4.49Å; L132-L136 HydrophobicContact CD1-CD1 3.96Å; L132-L136 HydrophobicContact CD1-CG 4.3Å; L132-L136 HydrophobicContact CG-CD1 3.86Å; L132-L136 WeakPolarHBondContact O-CG 3.21Å; L132-L136 PolarHBondContact O-N 2.75Å; F133-L136 PolarHBondContact O-N 3.21Å; F133-L136 VanDerWaalsContact O-N 3.13Å; L136-F201 HydrophobicContact CB-CB 4.43Å; L136-F201 HydrophobicContact CB-CD1 3.81Å; L136-F201 HydrophobicContact CB-CD2 3.99Å; L136-F201 HydrophobicContact CB-CE1 3.98Å; L136-F201 HydrophobicContact CB-CE2 4.15Å; L136-F201 HydrophobicContact CB-CG 3.82Å; L136-F201 HydrophobicContact CB-CZ 4.15Å; L136-F201 HydrophobicContact CD1-CB 4.36Å; L136-F201 HydrophobicContact CD1-CD2 3.8Å; L136-F201 HydrophobicContact CD1-CE2 4.34Å; L136-F201 HydrophobicContact CD1-CG 4.13Å; L136-F201 HydrophobicContact CD2-CB 4.06Å; L136-F201 HydrophobicContact CD2-CG 4.37Å; L136-F201 HydrophobicContact CG-CD2 4.42Å; L136-F201 HydrophobicContact CG-CG 4.33Å
137E88Confident88.1Confident68 Ų6859.8 Ų59.832%0.31832%0.321SS..Hα-helixtrans-82.4-24.7179-166.3172.4-142.100112F133 E139 F201F133-E137 HydrophobicContact CE1-CB 4.4Å; F133-E137 WeakPolarHBondContact CE1-OE2 3.46Å; F133-E137 HydrophobicContact CZ-CB 4.31Å; F133-E137 HydrophobicContact CZ-CG 4.48Å; F133-E137 WeakPolarHBondContact CZ-OE2 3.2Å; F133-E137 WeakPolarHBondContact O-CB 3.49Å; F133-E137 PolarHBondContact O-N 2.91Å; E137-E139 HydrophobicContact CG-CB 4.4Å; E137-E139 HydrophobicContact CG-CG 4.4Å; E137-E139 PolarHBondContact O-N 3.1Å; E137-F201 HydrophobicContact CB-CE1 4.45Å; E137-F201 HydrophobicContact CB-CZ 4.43Å
138G85.8Confident87.5Confident67 Ų6766.8 Ų66.869%0.69135%0.353SS*.SBendtrans77.55-175.200000113.6E134E134-G138 VanDerWaalsContact O-CA 3.31Å; E134-G138 WeakPolarHBondContact O-CA 3.22Å; E134-G138 PolarHBondContact O-N 2.95Å
139E85.1Confident87.3Confident116 Ų11669.1 Ų69.154%0.54237%0.37SS..  trans-108.9144.6176.2-65.3-162.3167.200111.5E134 E137E134-E139 VanDerWaalsContact CA-O 3.24Å; E134-E139 WeakPolarHBondContact CA-O 3.3Å; E134-E139 WeakPolarHBondContact CB-O 3.41Å; E134-E139 WeakPolarHBondContact CG-O 3.3Å; E137-E139 HydrophobicContact CG-CB 4.4Å; E137-E139 HydrophobicContact CG-CG 4.4Å; E137-E139 PolarHBondContact O-N 3.1Å
140K86.4Confident87Confident186 Ų18674.6 Ų74.681%0.80940%0.396SS*.  trans-85.7135.2175-71.1-167175.5-1710111
141L87.5Confident86.7Confident12 Ų1280.1 Ų80.16%0.06342%0.424CS..  trans-83.9141174.6-68.9-178.3000110.5Q130 F133 E134 V143 V160 R163Q130-L141 HydrophobicContact CG-CB 4.34Å; Q130-L141 HydrophobicContact CG-CD1 4.11Å; F133-L141 HydrophobicContact CD1-CD1 3.79Å; F133-L141 HydrophobicContact CD1-CD2 4.26Å; F133-L141 HydrophobicContact CD1-CG 4.18Å; F133-L141 HydrophobicContact CE1-CD1 4.44Å; F133-L141 HydrophobicContact CE1-CD2 4.16Å; E134-L141 HydrophobicContact CG-CB 4.29Å; E134-L141 HydrophobicContact CG-CG 4.12Å; E134-L141 PolarHBondContact OE1-N 3.36Å; L141-V143 VanDerWaalsContact C-N 3.27Å; L141-V143 HydrophobicContact CB-CG2 4.09Å; L141-V143 PolarHBondContact O-N 2.79Å; L141-V160 HydrophobicContact CD1-CB 4.49Å; L141-V160 HydrophobicContact CD1-CG2 3.98Å; L141-R163 HydrophobicContact CD2-CB 3.93Å; L141-R163 HydrophobicContact CD2-CG 3.69Å
142N84.8Confident86.5Confident165 Ų16579.7 Ų79.788%0.88243%0.427SS*.  trans-84.671175.8-171.516.2000110.8
143V83.2Confident86.3Confident26 Ų2680.8 Ų80.816%0.15843%0.432CS..SBendtrans-132.6155.9177.6-64.30000110.5Q130 L141 E145 T159Q130-V143 HydrophobicContact CG-CG2 3.7Å; Q130-V143 VanDerWaalsContact OE1-CG2 3.24Å; L141-V143 VanDerWaalsContact C-N 3.27Å; L141-V143 HydrophobicContact CB-CG2 4.09Å; L141-V143 PolarHBondContact O-N 2.79Å; V143-E145 PolarHBondContact O-N 3.38Å; V143-T159 HydrophobicContact CG1-CG2 3.49Å; V143-T159 VanDerWaalsContact CG1-CG2 3.49Å
144A79Confident86.3Confident63 Ų6383.8 Ų83.852%0.52145%0.445SS..  trans-64.5133.5-179.200000111.6V146 T147 K156A144-V146 VanDerWaalsContact C-N 3.25Å; A144-V146 PolarHBondContact O-N 3.23Å; A144-T147 HydrophobicContact CB-CG2 4.35Å; A144-K156 WeakPolarHBondContact O-CE 3.48Å; A144-K156 PolarHBondContact O-NZ 2.91Å
145E75.3Confident86.2Confident149 Ų14989 Ų8970%0.69647%0.47SS*.SBendtrans-63.6-27.8-177.4-66.4-171.2166.700113.9Q127 V143Q127-E145 VanDerWaalsContact CD-O 3.27Å; Q127-E145 PolarHBondContact NE2-O 2.71Å; Q127-E145 PolarHBondContact OE1-O 3.38Å; V143-E145 PolarHBondContact O-N 3.38Å
146V78.2Confident86.2Confident112 Ų11283.3 Ų83.368%0.67945%0.445SS*.  trans-139.4138.2178.8-176.50000109.1A144A144-V146 VanDerWaalsContact C-N 3.25Å; A144-V146 PolarHBondContact O-N 3.23Å
147T82.9Confident86.5Confident16 Ų1681.3 Ų81.310%0.09844%0.435CS..  trans-131117-178.240.60000109.5A144 A152 K156A144-T147 HydrophobicContact CB-CG2 4.35Å; T147-A152 HydrophobicContact CG2-CB 3.87Å; T147-K156 HydrophobicContact CG2-CB 4.32Å; T147-K156 HydrophobicContact CG2-CD 4.35Å; T147-K156 PolarHBondContact OG1-NZ 3.37Å
148Q79.8Confident86.8Confident187 Ų18782.3 Ų82.387%0.87444%0.439SS*.  trans-100-25.2-178-67.5-161.2-1500114.1
149S90.5Very high87.1Confident63 Ų6381.6 Ų81.644%0.44142%0.422SS..SBendtrans-95.5148.6179.168.10000111.4I151 A152 Q153S149-I151 VanDerWaalsContact C-N 3.26Å; S149-I151 PolarHBondContact O-N 3.23Å; S149-A152 PolarHBondContact O-N 3.01Å; S149-A152 VanDerWaalsContact O-N 3.08Å; S149-A152 WeakPolarHBondContact OG-CB 3.47Å; S149-A152 PolarHBondContact OG-N 3.38Å; S149-Q153 WeakPolarHBondContact O-CG 3.08Å; S149-Q153 PolarHBondContact O-N 2.94Å
150E89.1Confident87.5Confident116 Ų11676.1 Ų76.154%0.54240%0.396SS..Hα-helixtrans-55.5-43176.4-163.9-170.215100111.9A152 Q153 K154 H183E150-A152 VanDerWaalsContact C-N 3.32Å; E150-A152 PolarHBondContact O-N 3Å; E150-Q153 WeakPolarHBondContact O-CB 3.29Å; E150-Q153 PolarHBondContact O-N 3.27Å; E150-K154 PolarHBondContact O-N 3.01Å; E150-H183 WeakPolarHBondContact CG-CE1 3.48Å; E150-H183 IonicContact OE1-CE1 3.79Å
151I88.9Confident87.8Confident120 Ų12067.5 Ų67.562%0.61536%0.359SS*.Hα-helixtrans-60.8-42.2178-62164000110.8S149 K154 Q155S149-I151 VanDerWaalsContact C-N 3.26Å; S149-I151 PolarHBondContact O-N 3.23Å; I151-K154 PolarHBondContact O-N 2.94Å; I151-Q155 WeakPolarHBondContact O-CB 3.28Å; I151-Q155 VanDerWaalsContact O-CG 3.3Å; I151-Q155 WeakPolarHBondContact O-CG 3.49Å; I151-Q155 PolarHBondContact O-N 3.33Å
152A89.3Confident88Confident25 Ų2571.2 Ų71.221%0.20738%0.376CS..Hα-helixtrans-70.4-36.2178.900000112.3T147 S149 E150 Q155 K156T147-A152 HydrophobicContact CG2-CB 3.87Å; S149-A152 PolarHBondContact O-N 3.01Å; S149-A152 VanDerWaalsContact O-N 3.08Å; S149-A152 WeakPolarHBondContact OG-CB 3.47Å; S149-A152 PolarHBondContact OG-N 3.38Å; E150-A152 VanDerWaalsContact C-N 3.32Å; E150-A152 PolarHBondContact O-N 3Å; A152-Q155 PolarHBondContact O-N 3.15Å; A152-K156 WeakPolarHBondContact O-CB 3.46Å; A152-K156 PolarHBondContact O-N 3.19Å
153Q91.3Very high88.3Confident22 Ų2268.3 Ų68.310%0.10335%0.352CS..Hα-helixtrans-62.2-47.3173.6-67.6168.7-6.700111D125 S149 E150 Q155 K156 L157 H183D125-Q153 HydrophobicContact CB-CG 4.03Å; S149-Q153 WeakPolarHBondContact O-CG 3.08Å; S149-Q153 PolarHBondContact O-N 2.94Å; E150-Q153 WeakPolarHBondContact O-CB 3.29Å; E150-Q153 PolarHBondContact O-N 3.27Å; Q153-Q155 PolarHBondContact O-N 2.91Å; Q153-K156 PolarHBondContact O-N 3.11Å; Q153-L157 PolarHBondContact O-N 3.45Å; Q153-H183 PolarHBondContact OE1-NE2 2.96Å
154K92.8Very high88.6Confident64 Ų6467.1 Ų67.128%0.27835%0.345SS..Hα-helixtrans-62.4-40.5176.4-71-166.4178.5-157.80112.5E150 I151 L157 Q158 V179 D180 H183E150-K154 PolarHBondContact O-N 3.01Å; I151-K154 PolarHBondContact O-N 2.94Å; K154-L157 PolarHBondContact O-N 2.95Å; K154-Q158 WeakPolarHBondContact O-CB 3.42Å; K154-Q158 PolarHBondContact O-N 3.46Å; K154-V179 HydrophobicContact CB-CG1 3.86Å; K154-V179 HydrophobicContact CG-CG1 4.01Å; K154-D180 IonicContact NZ-OD1 2.86Å; K154-D180 PolarHBondContact NZ-OD1 2.86Å; K154-H183 WeakPolarHBondContact CE-ND1 3.41Å; K154-H183 HydrophobicContact CG-CB 4.5Å
155Q91.6Very high89.2Confident125 Ų12566.1 Ų66.158%0.58433%0.331SS*.Hα-helixtrans-63.2-42.8174.4-75.4174.8-600112.3I151 A152 Q153 Q158 T159I151-Q155 WeakPolarHBondContact O-CB 3.28Å; I151-Q155 VanDerWaalsContact O-CG 3.3Å; I151-Q155 WeakPolarHBondContact O-CG 3.49Å; I151-Q155 PolarHBondContact O-N 3.33Å; A152-Q155 PolarHBondContact O-N 3.15Å; Q153-Q155 PolarHBondContact O-N 2.91Å; Q155-Q158 WeakPolarHBondContact O-CB 3.17Å; Q155-Q158 PolarHBondContact O-N 3.34Å; Q155-T159 PolarHBondContact O-N 2.94Å; Q155-T159 PolarHBondContact O-OG1 2.76Å
156K92.8Very high89.7Confident6 Ų665.1 Ų65.13%0.02633%0.326CS..Hα-helixtrans-60.3-50.8174.5172.1179.6-73.3178.40111.2A144 T147 A152 Q153 Q158 T159 V160A144-K156 WeakPolarHBondContact O-CE 3.48Å; A144-K156 PolarHBondContact O-NZ 2.91Å; T147-K156 HydrophobicContact CG2-CB 4.32Å; T147-K156 HydrophobicContact CG2-CD 4.35Å; T147-K156 PolarHBondContact OG1-NZ 3.37Å; A152-K156 WeakPolarHBondContact O-CB 3.46Å; A152-K156 PolarHBondContact O-N 3.19Å; Q153-K156 PolarHBondContact O-N 3.11Å; K156-Q158 VanDerWaalsContact C-N 3.25Å; K156-Q158 PolarHBondContact O-N 2.93Å; K156-T159 PolarHBondContact O-N 3.26Å; K156-V160 HydrophobicContact CG-CG2 4.19Å; K156-V160 VanDerWaalsContact O-CG2 3.3Å; K156-V160 WeakPolarHBondContact O-CG2 3.34Å; K156-V160 PolarHBondContact O-N 2.89Å
157L94.1Very high90Very high0 Ų060.7 Ų60.70%030%0.3CS..Hα-helixtrans-56.9-40.7176.9-86.2176000111.8Y124 G126 L129 Q153 K154 T159 V160 L161 V179 V182 H183Y124-L157 WeakPolarHBondContact O-CD1 3.19Å; G126-L157 VanDerWaalsContact CA-CD2 3.47Å; L129-L157 HydrophobicContact CD1-CD2 4.07Å; Q153-L157 PolarHBondContact O-N 3.45Å; K154-L157 PolarHBondContact O-N 2.95Å; L157-T159 PolarHBondContact O-N 3.48Å; L157-V160 PolarHBondContact O-N 2.75Å; L157-L161 VanDerWaalsContact O-CB 3.25Å; L157-L161 WeakPolarHBondContact O-CB 3.33Å; L157-L161 VanDerWaalsContact O-CG 3.22Å; L157-L161 WeakPolarHBondContact O-CG 3.48Å; L157-L161 PolarHBondContact O-N 3.37Å; L157-V179 HydrophobicContact CB-CB 4.49Å; L157-V179 HydrophobicContact CB-CG1 3.97Å; L157-V179 HydrophobicContact CB-CG2 4.15Å; L157-V179 HydrophobicContact CD1-CG1 4.3Å; L157-V182 HydrophobicContact CD1-CB 4.37Å; L157-V182 HydrophobicContact CD1-CG1 4.18Å; L157-V182 HydrophobicContact CD2-CB 4.41Å; L157-V182 HydrophobicContact CD2-CG1 3.75Å; L157-H183 HydrophobicContact CD1-CB 3.77Å
158Q93.7Very high90Very high88 Ų8860.3 Ų60.341%0.41130%0.298SS..Hα-helixtrans-56.1-53.3176.5-174.466.833.100110.7K154 Q155 K156 V160 L161 E162 V179K154-Q158 WeakPolarHBondContact O-CB 3.42Å; K154-Q158 PolarHBondContact O-N 3.46Å; Q155-Q158 WeakPolarHBondContact O-CB 3.17Å; Q155-Q158 PolarHBondContact O-N 3.34Å; K156-Q158 VanDerWaalsContact C-N 3.25Å; K156-Q158 PolarHBondContact O-N 2.93Å; Q158-V160 PolarHBondContact O-N 2.8Å; Q158-L161 PolarHBondContact O-N 2.9Å; Q158-E162 PolarHBondContact NE2-OE1 3.23Å; Q158-E162 WeakPolarHBondContact O-CB 3.46Å; Q158-E162 VanDerWaalsContact O-CG 3.23Å; Q158-E162 WeakPolarHBondContact O-CG 3.41Å; Q158-E162 PolarHBondContact O-N 3.16Å; Q158-V179 HydrophobicContact CB-CG2 3.95Å
159T92.6Very high89.9Confident53 Ų5360.3 Ų60.333%0.32530%0.295SS..Hα-helixtrans-63.9-42-179.7-54.80000112.5V143 Q155 K156 L157 R163V143-T159 HydrophobicContact CG1-CG2 3.49Å; V143-T159 VanDerWaalsContact CG1-CG2 3.49Å; Q155-T159 PolarHBondContact O-N 2.94Å; Q155-T159 PolarHBondContact O-OG1 2.76Å; K156-T159 PolarHBondContact O-N 3.26Å; L157-T159 PolarHBondContact O-N 3.48Å; T159-R163 WeakPolarHBondContact O-CG 3.44Å; T159-R163 PolarHBondContact O-N 2.87Å
160V93.6Very high88.9Confident0 Ų059 Ų590%028%0.283CS..Hα-helixtrans-65-48.4179.4172.60000110.8L129 Q130 L141 K156 L157 Q158 R163 I164L129-V160 HydrophobicContact CB-CG1 4.06Å; Q130-V160 HydrophobicContact CB-CG2 3.85Å; Q130-V160 HydrophobicContact CG-CG2 4.35Å; L141-V160 HydrophobicContact CD1-CB 4.49Å; L141-V160 HydrophobicContact CD1-CG2 3.98Å; K156-V160 HydrophobicContact CG-CG2 4.19Å; K156-V160 VanDerWaalsContact O-CG2 3.3Å; K156-V160 WeakPolarHBondContact O-CG2 3.34Å; K156-V160 PolarHBondContact O-N 2.89Å; L157-V160 PolarHBondContact O-N 2.75Å; Q158-V160 PolarHBondContact O-N 2.8Å; V160-R163 PolarHBondContact O-N 3.3Å; V160-I164 HydrophobicContact CG1-CD1 3.69Å; V160-I164 HydrophobicContact CG1-CG1 4.49Å; V160-I164 VanDerWaalsContact O-CG1 3.3Å; V160-I164 WeakPolarHBondContact O-CG1 3.43Å; V160-I164 PolarHBondContact O-N 2.9Å
161L93.4Very high87.8Confident6 Ų657.2 Ų57.23%0.03128%0.283CS..Hα-helixtrans-68.4-35.2-179.3-67.1-179.5000112.3L157 Q158 I164 N165 V179 V182 L193L157-L161 VanDerWaalsContact O-CB 3.25Å; L157-L161 WeakPolarHBondContact O-CB 3.33Å; L157-L161 VanDerWaalsContact O-CG 3.22Å; L157-L161 WeakPolarHBondContact O-CG 3.48Å; L157-L161 PolarHBondContact O-N 3.37Å; Q158-L161 PolarHBondContact O-N 2.9Å; L161-I164 HydrophobicContact CD2-CD1 4.37Å; L161-I164 PolarHBondContact O-N 3.1Å; L161-N165 VanDerWaalsContact O-CB 3.27Å; L161-N165 WeakPolarHBondContact O-CB 3.39Å; L161-N165 PolarHBondContact O-N 3.02Å; L161-N165 PolarHBondContact O-ND2 3.39Å; L161-N165 VanDerWaalsContact O-ND2 3.11Å; L161-V179 HydrophobicContact CD1-CG2 4.05Å; L161-V182 HydrophobicContact CD1-CG2 4.3Å; L161-L193 HydrophobicContact CD2-CD1 4.14Å; L161-L193 HydrophobicContact CD2-CD2 3.69Å
162E90.8Very high86.5Confident89 Ų8957.3 Ų57.342%0.41629%0.289SS..Hα-helixtrans-58.3-49.2172.4-80.3172.3176.200111.2Q158 N165 E166Q158-E162 PolarHBondContact NE2-OE1 3.23Å; Q158-E162 WeakPolarHBondContact O-CB 3.46Å; Q158-E162 VanDerWaalsContact O-CG 3.23Å; Q158-E162 WeakPolarHBondContact O-CG 3.41Å; Q158-E162 PolarHBondContact O-N 3.16Å; E162-N165 PolarHBondContact O-N 3.28Å; E162-E166 WeakPolarHBondContact O-CG 3.45Å; E162-E166 PolarHBondContact O-N 2.84Å
163R90.9Very high85.1Confident105 Ų10567 Ų6740%0.39632%0.32SS..Hα-helixtrans-66-40.2178.6-69.1-52.6-16389-1.8113.4F133 L141 T159 V160 N165 E166 S167F133-R163 HydrophobicContact CE1-CB 3.85Å; F133-R163 HydrophobicContact CZ-CB 4.29Å; L141-R163 HydrophobicContact CD2-CB 3.93Å; L141-R163 HydrophobicContact CD2-CG 3.69Å; T159-R163 WeakPolarHBondContact O-CG 3.44Å; T159-R163 PolarHBondContact O-N 2.87Å; V160-R163 PolarHBondContact O-N 3.3Å; R163-N165 VanDerWaalsContact C-N 3.34Å; R163-N165 PolarHBondContact O-N 3.37Å; R163-E166 VanDerWaalsContact CD-OE2 3.28Å; R163-E166 WeakPolarHBondContact CD-OE2 3.29Å; R163-E166 IonicContact NE-OE2 3.83Å; R163-E166 PolarHBondContact O-N 3.07Å; R163-S167 PolarHBondContact O-N 3.45Å
164I91.3Very high83.9Confident0 Ų070.6 Ų70.60%034%0.341CS..Hα-helixtrans-59.3-47.9172.6-69.9165.4000110.2F133 V160 L161 E166 S167 L168 L193 L197F133-I164 HydrophobicContact CB-CD1 4.45Å; F133-I164 HydrophobicContact CB-CG1 4.26Å; F133-I164 HydrophobicContact CD1-CG1 4.36Å; F133-I164 HydrophobicContact CD2-CB 4.44Å; F133-I164 HydrophobicContact CD2-CD1 4.38Å; F133-I164 HydrophobicContact CD2-CG1 3.43Å; F133-I164 VanDerWaalsContact CD2-CG1 3.43Å; F133-I164 HydrophobicContact CE2-CB 4.33Å; F133-I164 HydrophobicContact CE2-CG1 3.75Å; F133-I164 HydrophobicContact CG-CD1 4.45Å; F133-I164 HydrophobicContact CG-CG1 3.75Å; F133-I164 HydrophobicContact CZ-CG1 4.33Å; V160-I164 HydrophobicContact CG1-CD1 3.69Å; V160-I164 HydrophobicContact CG1-CG1 4.49Å; V160-I164 VanDerWaalsContact O-CG1 3.3Å; V160-I164 WeakPolarHBondContact O-CG1 3.43Å; V160-I164 PolarHBondContact O-N 2.9Å; L161-I164 HydrophobicContact CD2-CD1 4.37Å; L161-I164 PolarHBondContact O-N 3.1Å; I164-E166 VanDerWaalsContact C-N 3.32Å; I164-E166 PolarHBondContact O-N 2.89Å; I164-S167 PolarHBondContact O-N 3.44Å; I164-L168 HydrophobicContact CG2-CD1 3.48Å; I164-L168 VanDerWaalsContact CG2-CD1 3.48Å; I164-L168 HydrophobicContact CG2-CG 3.95Å; I164-L168 WeakPolarHBondContact O-CB 3.41Å; I164-L168 WeakPolarHBondContact O-CG 3.48Å; I164-L168 PolarHBondContact O-N 2.92Å; I164-L193 HydrophobicContact CD1-CD1 4.34Å; I164-L193 HydrophobicContact CG2-CD1 3.82Å; I164-L197 HydrophobicContact CD1-CD1 4.32Å; I164-L197 HydrophobicContact CG1-CD2 4.28Å; I164-L197 HydrophobicContact CG2-CD2 3.75Å; I164-L197 HydrophobicContact CG2-CG 4.28Å
165N89.8Confident83.3Confident42 Ų4269.5 Ų69.523%0.22534%0.337CS..Hα-helixtrans-63.2-38.3-178.8-69.5-22.4000112.3L161 E162 R163 K169 I175 W177L161-N165 VanDerWaalsContact O-CB 3.27Å; L161-N165 WeakPolarHBondContact O-CB 3.39Å; L161-N165 PolarHBondContact O-N 3.02Å; L161-N165 PolarHBondContact O-ND2 3.39Å; L161-N165 VanDerWaalsContact O-ND2 3.11Å; E162-N165 PolarHBondContact O-N 3.28Å; R163-N165 VanDerWaalsContact C-N 3.34Å; R163-N165 PolarHBondContact O-N 3.37Å; N165-K169 PolarHBondContact O-N 3.39Å; N165-I175 HydrophobicContact CB-CD1 4.31Å; N165-W177 PolarHBondContact OD1-NE1 3.03Å
166E86.9Confident82.9Confident128 Ų12870 Ų7060%0.59833%0.334SS*.Hα-helixtrans-62.3-46.4173.3-74.4175.3177.500111.9E162 R163 I164 K169E162-E166 WeakPolarHBondContact O-CG 3.45Å; E162-E166 PolarHBondContact O-N 2.84Å; R163-E166 VanDerWaalsContact CD-OE2 3.28Å; R163-E166 WeakPolarHBondContact CD-OE2 3.29Å; R163-E166 IonicContact NE-OE2 3.83Å; R163-E166 PolarHBondContact O-N 3.07Å; I164-E166 VanDerWaalsContact C-N 3.32Å; I164-E166 PolarHBondContact O-N 2.89Å; E166-K169 WeakPolarHBondContact O-CG 3.23Å; E166-K169 PolarHBondContact O-N 3.22Å
167S84.6Confident82.8Confident20 Ų2070.3 Ų70.314%0.1434%0.335CS..Hα-helixtrans-63.2-46.2177.2-176.70000111.8R163 I164 K169 H200R163-S167 PolarHBondContact O-N 3.45Å; I164-S167 PolarHBondContact O-N 3.44Å; S167-K169 PolarHBondContact O-N 3.3Å; S167-H200 PolarHBondContact O-CE1 2.86Å; S167-H200 PolarHBondContact O-NE2 3.36Å; S167-H200 PolarHBondContact OG-NE2 2.93Å
168L82.2Confident82.6Confident8 Ų874.5 Ų74.54%0.04236%0.357CS..Hα-helixtrans-67.7-18.7-177.6-65.9176.8000112.9I164 L170 W177 A196 L197 H200I164-L168 HydrophobicContact CG2-CD1 3.48Å; I164-L168 VanDerWaalsContact CG2-CD1 3.48Å; I164-L168 HydrophobicContact CG2-CG 3.95Å; I164-L168 WeakPolarHBondContact O-CB 3.41Å; I164-L168 WeakPolarHBondContact O-CG 3.48Å; I164-L168 PolarHBondContact O-N 2.92Å; L168-L170 HydrophobicContact CB-CD1 3.83Å; L168-L170 HydrophobicContact CB-CG 3.78Å; L168-L170 HydrophobicContact CD1-CD1 3.78Å; L168-L170 HydrophobicContact CG-CD1 4.4Å; L168-L170 PolarHBondContact O-N 2.96Å; L168-L170 VanDerWaalsContact O-N 3.12Å; L168-W177 HydrophobicContact CD1-CH2 4.07Å; L168-W177 HydrophobicContact CD1-CZ2 3.71Å; L168-A196 HydrophobicContact CD1-CB 4.06Å; L168-L197 HydrophobicContact CD2-CD2 4.48Å; L168-H200 HydrophobicContact CD2-CB 3.26Å; L168-H200 VanDerWaalsContact CD2-CG 3.43Å
169K78.6Confident82.5Confident187 Ų18771 Ų7181%0.81334%0.342SS*.THydrogen-bonded Turntrans5132.8-177.1-61.2179.3-177.2175.10113.2N165 E166 S167N165-K169 PolarHBondContact O-N 3.39Å; E166-K169 WeakPolarHBondContact O-CG 3.23Å; E166-K169 PolarHBondContact O-N 3.22Å; S167-K169 PolarHBondContact O-N 3.3Å
170L69.4Low82.4Confident35 Ų3573.2 Ų73.218%0.18335%0.352CS..  trans-77.2139.3-178-68.5171.2000110.8L168 T172 I175 W177 F241L168-L170 HydrophobicContact CB-CD1 3.83Å; L168-L170 HydrophobicContact CB-CG 3.78Å; L168-L170 HydrophobicContact CD1-CD1 3.78Å; L168-L170 HydrophobicContact CG-CD1 4.4Å; L168-L170 PolarHBondContact O-N 2.96Å; L168-L170 VanDerWaalsContact O-N 3.12Å; L170-T172 PolarHBondContact O-N 3.47Å; L170-I175 HydrophobicContact CB-CG1 4.18Å; L170-W177 HydrophobicContact CD1-CH2 3.56Å; L170-W177 HydrophobicContact CD1-CZ2 3.93Å; L170-F241 HydrophobicContact CD2-CE1 3.9Å; L170-F241 HydrophobicContact CD2-CZ 3.74Å
171S65.1Low82.2Confident78 Ų7874.4 Ų74.455%0.54536%0.36SS..  trans-59.7138.5165.6-67.20000109.2R173 N174S171-R173 PolarHBondContact O-N 3.34Å; S171-N174 PolarHBondContact O-N 3.24Å
172T62.4Low82.1Confident123 Ų12374.1 Ų74.176%0.75536%0.358SS*.THydrogen-bonded Turntrans-53.4-24.2178.746.70000114.1L170 N174L170-T172 PolarHBondContact O-N 3.47Å; T172-N174 VanDerWaalsContact C-N 3.31Å; T172-N174 PolarHBondContact O-N 3.38Å
173R58.8Low82.2Confident227 Ų22771.1 Ų71.186%0.85735%0.345SS*.THydrogen-bonded Turntrans-71.8-20.5175.5-63.6-174.8-179-168.3-0114.5S171S171-R173 PolarHBondContact O-N 3.34Å
174N67.4Low82.2Confident99 Ų9969.8 Ų69.853%0.52936%0.356SS..THydrogen-bonded Turntrans-97.4-9-177.5-65-8000112.3S171 T172 R176S171-N174 PolarHBondContact O-N 3.24Å; T172-N174 VanDerWaalsContact C-N 3.31Å; T172-N174 PolarHBondContact O-N 3.38Å; N174-R176 PolarHBondContact O-N 2.9Å
175I79.1Confident82.1Confident40 Ų4073.1 Ų73.121%0.20537%0.37CS..  trans-77.5118.6179.9-60.6177000108.3N165 L170 W177N165-I175 HydrophobicContact CB-CD1 4.31Å; L170-I175 HydrophobicContact CB-CG1 4.18Å; I175-W177 HydrophobicContact CG2-CD2 4.01Å; I175-W177 HydrophobicContact CG2-CG 4.16Å; I175-W177 HydrophobicContact CG2-CZ2 4.31Å; I175-W177 WeakPolarHBondContact CG2-O 3.28Å
176R83.4Confident82.1Confident135 Ų13572.6 Ų72.651%0.50937%0.37SS..  trans-107.211.7-179.8-62.7-59.6-170.31206.2113.2N174 H192 E232N174-R176 PolarHBondContact O-N 2.9Å; R176-H192 HydrophobicContact CB-CB 4.09Å; R176-E232 IonicContact CZ-OE2 3.97Å; R176-E232 IonicContact NH1-OE1 3.44Å; R176-E232 PolarHBondContact NH1-OE1 2.95Å; R176-E232 IonicContact NH1-OE2 2.81Å; R176-E232 PolarHBondContact NH1-OE2 3.47Å
177W90.9Very high82.1Confident13 Ų1367.7 Ų67.75%0.04935%0.347CS..  trans-131.3150.9179.557.485.5000111.1N165 L168 L170 I175 V182 A189 H192 L193 A196N165-W177 PolarHBondContact OD1-NE1 3.03Å; L168-W177 HydrophobicContact CD1-CH2 4.07Å; L168-W177 HydrophobicContact CD1-CZ2 3.71Å; L170-W177 HydrophobicContact CD1-CH2 3.56Å; L170-W177 HydrophobicContact CD1-CZ2 3.93Å; I175-W177 HydrophobicContact CG2-CD2 4.01Å; I175-W177 HydrophobicContact CG2-CG 4.16Å; I175-W177 HydrophobicContact CG2-CZ2 4.31Å; I175-W177 WeakPolarHBondContact CG2-O 3.28Å; W177-V182 HydrophobicContact CB-CG2 4.35Å; W177-A189 HydrophobicContact CB-CB 4.08Å; W177-H192 HydrophobicContact CE3-CB 3.89Å; W177-H192 HydrophobicContact CZ3-CB 4.09Å; W177-L193 HydrophobicContact CB-CB 4.49Å; W177-L193 HydrophobicContact CD2-CB 3.98Å; W177-L193 HydrophobicContact CD2-CD1 3.98Å; W177-L193 HydrophobicContact CE3-CB 4.1Å; W177-L193 HydrophobicContact CG-CB 4.15Å; W177-L193 HydrophobicContact CG-CD1 4.19Å; W177-L193 HydrophobicContact CZ2-CD1 4.08Å; W177-A196 HydrophobicContact CH2-CB 3.63Å; W177-A196 HydrophobicContact CZ3-CB 4.06Å
178N90.1Very high82.3Confident89 Ų8967.4 Ų67.448%0.47635%0.345SS..  trans-151.6170.1171.761.447000109.3D180 S181 V182N178-D180 VanDerWaalsContact C-N 3.32Å; N178-D180 PolarHBondContact O-N 2.94Å; N178-D180 PolarHBondContact OD1-N 3.39Å; N178-S181 PolarHBondContact N-OG 2.87Å; N178-S181 PolarHBondContact O-N 2.86Å; N178-S181 PolarHBondContact O-OG 3.47Å; N178-S181 WeakPolarHBondContact OD1-CB 3.49Å; N178-S181 PolarHBondContact OD1-N 2.9Å; N178-S181 PolarHBondContact OD1-OG 3.31Å; N178-S181 VanDerWaalsContact OD1-OG 3.1Å; N178-V182 PolarHBondContact O-N 3.11Å
179V91.5Very high82.7Confident15 Ų1567.1 Ų67.19%0.09134%0.343CS..Hα-helixtrans-53.4-48.5-177.5174.40000112K154 L157 Q158 L161 S181 V182 H183K154-V179 HydrophobicContact CB-CG1 3.86Å; K154-V179 HydrophobicContact CG-CG1 4.01Å; L157-V179 HydrophobicContact CB-CB 4.49Å; L157-V179 HydrophobicContact CB-CG1 3.97Å; L157-V179 HydrophobicContact CB-CG2 4.15Å; L157-V179 HydrophobicContact CD1-CG1 4.3Å; Q158-V179 HydrophobicContact CB-CG2 3.95Å; L161-V179 HydrophobicContact CD1-CG2 4.05Å; V179-S181 PolarHBondContact O-N 2.85Å; V179-V182 PolarHBondContact O-N 2.85Å; V179-H183 WeakPolarHBondContact O-CB 3.37Å; V179-H183 PolarHBondContact O-N 3.33Å
180D89.1Confident83.4Confident99 Ų9958.2 Ų58.253%0.52931%0.305SS..Hα-helixtrans-65.6-39.3-177-65.4-51.9000111.9K154 N178 A184K154-D180 IonicContact NZ-OD1 2.86Å; K154-D180 PolarHBondContact NZ-OD1 2.86Å; N178-D180 VanDerWaalsContact C-N 3.32Å; N178-D180 PolarHBondContact O-N 2.94Å; N178-D180 PolarHBondContact OD1-N 3.39Å; D180-A184 WeakPolarHBondContact O-CB 3.27Å; D180-A184 PolarHBondContact O-N 3.44Å
181S90.1Very high84.5Confident24 Ų2456.6 Ų56.617%0.16830%0.296CS..Hα-helixtrans-67.9-39.8178.764.60000113.1N178 V179 S186 A189N178-S181 PolarHBondContact N-OG 2.87Å; N178-S181 PolarHBondContact O-N 2.86Å; N178-S181 PolarHBondContact O-OG 3.47Å; N178-S181 WeakPolarHBondContact OD1-CB 3.49Å; N178-S181 PolarHBondContact OD1-N 2.9Å; N178-S181 PolarHBondContact OD1-OG 3.31Å; N178-S181 VanDerWaalsContact OD1-OG 3.1Å; V179-S181 PolarHBondContact O-N 2.85Å; S181-S186 WeakPolarHBondContact O-CB 3.1Å; S181-S186 PolarHBondContact O-N 3.34Å; S181-A189 WeakPolarHBondContact OG-CB 3.39Å
182V92Very high85.7Confident0 Ų054.1 Ų54.10%028%0.276CS..Hα-helixtrans-72.1-44.7178175.50000110.1L129 L157 L161 W177 N178 V179 A184 K185 I190L129-V182 HydrophobicContact CD1-CG1 4.03Å; L157-V182 HydrophobicContact CD1-CB 4.37Å; L157-V182 HydrophobicContact CD1-CG1 4.18Å; L157-V182 HydrophobicContact CD2-CB 4.41Å; L157-V182 HydrophobicContact CD2-CG1 3.75Å; L161-V182 HydrophobicContact CD1-CG2 4.3Å; W177-V182 HydrophobicContact CB-CG2 4.35Å; N178-V182 PolarHBondContact O-N 3.11Å; V179-V182 PolarHBondContact O-N 2.85Å; V182-A184 VanDerWaalsContact C-N 3.32Å; V182-A184 PolarHBondContact O-N 3.04Å; V182-K185 WeakPolarHBondContact O-CA 2.87Å; V182-K185 PolarHBondContact O-N 3.48Å; V182-I190 HydrophobicContact CG1-CG1 4.29Å
183H92.9Very high87.1Confident27 Ų2748.2 Ų48.213%0.12524%0.24CC..Hα-helixtrans-65.5-35.2178-171.4-99.4000112.3E150 Q153 K154 L157 V179 K185E150-H183 WeakPolarHBondContact CG-CE1 3.48Å; E150-H183 IonicContact OE1-CE1 3.79Å; Q153-H183 PolarHBondContact OE1-NE2 2.96Å; K154-H183 WeakPolarHBondContact CE-ND1 3.41Å; K154-H183 HydrophobicContact CG-CB 4.5Å; L157-H183 HydrophobicContact CD1-CB 3.77Å; V179-H183 WeakPolarHBondContact O-CB 3.37Å; V179-H183 PolarHBondContact O-N 3.33Å; H183-K185 PolarHBondContact O-N 3.02Å; H183-K185 VanDerWaalsContact O-N 3.14Å
184A89.4Confident88.8Confident76 Ų7637.4 Ų37.463%0.62820%0.199SC*.THydrogen-bonded Turntrans-75.913.9170.800000113.8D180 V182 S186D180-A184 WeakPolarHBondContact O-CB 3.27Å; D180-A184 PolarHBondContact O-N 3.44Å; V182-A184 VanDerWaalsContact C-N 3.32Å; V182-A184 PolarHBondContact O-N 3.04Å; A184-S186 PolarHBondContact O-N 2.99Å
185K91.2Very high89.9Confident71 Ų7133 Ų3331%0.30918%0.175SC..THydrogen-bonded Turntrans59.931173.3-60.7-176.2173.1-178.80114E121 Y124 V182 H183 I187E121-K185 WeakPolarHBondContact OE1-CD 3.41Å; E121-K185 WeakPolarHBondContact OE1-CE 3.2Å; E121-K185 IonicContact OE1-NZ 2.75Å; E121-K185 PolarHBondContact OE1-NZ 2.88Å; E121-K185 IonicContact OE2-NZ 2.66Å; E121-K185 PolarHBondContact OE2-NZ 3.33Å; Y124-K185 HydrophobicContact CG-CG 4.17Å; V182-K185 WeakPolarHBondContact O-CA 2.87Å; V182-K185 PolarHBondContact O-N 3.48Å; H183-K185 PolarHBondContact O-N 3.02Å; H183-K185 VanDerWaalsContact O-N 3.14Å; K185-I187 PolarHBondContact O-N 2.85Å
186S87.9Confident90.3Very high30 Ų3031.3 Ų31.321%0.2117%0.168CC..  trans-68.6103.9176.2-178.70000110.5S181 A184 V188 A189 I190S181-S186 WeakPolarHBondContact O-CB 3.1Å; S181-S186 PolarHBondContact O-N 3.34Å; A184-S186 PolarHBondContact O-N 2.99Å; S186-V188 PolarHBondContact O-N 3.2Å; S186-A189 PolarHBondContact O-N 3.41Å; S186-A189 VanDerWaalsContact O-N 3.11Å; S186-I190 WeakPolarHBondContact O-CG1 3.5Å; S186-I190 PolarHBondContact O-N 3.48Å
187I87.9Confident90.6Very high26 Ų2624.9 Ų24.913%0.13314%0.144CC..Hα-helixtrans-56.3-33.7176.6-175.160.2000111.9V84 I98 L119 T120 K185 I190 L191V84-I187 HydrophobicContact CG2-CG2 3.6Å; I98-I187 HydrophobicContact CD1-CD1 4.47Å; L119-I187 HydrophobicContact CB-CD1 4.27Å; L119-I187 HydrophobicContact CD1-CD1 4.47Å; T120-I187 HydrophobicContact CG2-CB 3.75Å; T120-I187 HydrophobicContact CG2-CD1 3.86Å; T120-I187 HydrophobicContact CG2-CG1 4.31Å; K185-I187 PolarHBondContact O-N 2.85Å; I187-I190 PolarHBondContact O-N 2.93Å; I187-L191 HydrophobicContact CD1-CD1 4Å; I187-L191 HydrophobicContact CD1-CD2 4.26Å; I187-L191 HydrophobicContact CD1-CG 3.79Å; I187-L191 HydrophobicContact CG1-CD1 3.73Å; I187-L191 HydrophobicContact CG1-CG 4.01Å; I187-L191 VanDerWaalsContact O-CB 3.28Å; I187-L191 WeakPolarHBondContact O-CB 3.38Å; I187-L191 WeakPolarHBondContact O-CG 3.49Å; I187-L191 PolarHBondContact O-N 3.27Å
188V88.8Confident90.6Very high13 Ų1324.5 Ų24.58%0.07914%0.143CC..Hα-helixtrans-63.3-47.9177.71770000110.6V84 S186 L191 H192 I213 V215 E232 I234V84-V188 HydrophobicContact CG2-CG2 3.87Å; S186-V188 PolarHBondContact O-N 3.2Å; V188-L191 PolarHBondContact O-N 3.44Å; V188-H192 PolarHBondContact O-CD2 2.85Å; V188-H192 PolarHBondContact O-N 3.48Å; V188-I213 HydrophobicContact CG2-CD1 4.23Å; V188-I213 HydrophobicContact CG2-CG2 4.29Å; V188-V215 HydrophobicContact CG2-CG2 3.96Å; V188-E232 HydrophobicContact CG1-CB 4.4Å; V188-I234 HydrophobicContact CG1-CD1 4.11Å
189A90.3Very high90.3Very high2 Ų221.8 Ų21.82%0.01713%0.127CC..Hα-helixtrans-64.6-44178.500000111.6W177 S181 S186 H192 L193W177-A189 HydrophobicContact CB-CB 4.08Å; S181-A189 WeakPolarHBondContact OG-CB 3.39Å; S186-A189 PolarHBondContact O-N 3.41Å; S186-A189 VanDerWaalsContact O-N 3.11Å; A189-H192 PolarHBondContact O-N 2.76Å; A189-L193 WeakPolarHBondContact O-CB 3.32Å; A189-L193 PolarHBondContact O-N 2.79Å
190I92.8Very high89.9Confident1 Ų124.3 Ų24.31%0.00514%0.138CC..Hα-helixtrans-63.1-44.5179-67.7167.7000110.9L119 T120 L123 V182 S186 I187 L193 L194L119-I190 HydrophobicContact CB-CG2 4.11Å; T120-I190 HydrophobicContact CG2-CD1 4.24Å; L123-I190 HydrophobicContact CD2-CG2 3.75Å; V182-I190 HydrophobicContact CG1-CG1 4.29Å; S186-I190 WeakPolarHBondContact O-CG1 3.5Å; S186-I190 PolarHBondContact O-N 3.48Å; I187-I190 PolarHBondContact O-N 2.93Å; I190-L193 WeakPolarHBondContact O-CB 3.48Å; I190-L193 PolarHBondContact O-N 2.97Å; I190-L194 HydrophobicContact CG2-CD1 3.85Å; I190-L194 HydrophobicContact CG2-CG 4.36Å; I190-L194 WeakPolarHBondContact O-CB 3.26Å; I190-L194 VanDerWaalsContact O-CG 3.3Å; I190-L194 WeakPolarHBondContact O-CG 3.32Å; I190-L194 PolarHBondContact O-N 3.46Å
191L92.6Very high89.6Confident0 Ų022 Ų220%012%0.123CC..Hα-helixtrans-65.1-44.4178.1-73174000112.2L94 L97 I98 L101 L119 I187 V188 L193 L194 V195 I213 I234L94-L191 HydrophobicContact CD1-CD1 3.63Å; L97-L191 HydrophobicContact CD2-CD2 4.36Å; L97-L191 HydrophobicContact CG-CD2 4.42Å; I98-L191 HydrophobicContact CG1-CD1 4.49Å; I98-L191 HydrophobicContact CG1-CD2 4.05Å; L101-L191 HydrophobicContact CD1-CD2 3.53Å; L119-L191 HydrophobicContact CD1-CD2 3.89Å; I187-L191 HydrophobicContact CD1-CD1 4Å; I187-L191 HydrophobicContact CD1-CD2 4.26Å; I187-L191 HydrophobicContact CD1-CG 3.79Å; I187-L191 HydrophobicContact CG1-CD1 3.73Å; I187-L191 HydrophobicContact CG1-CG 4.01Å; I187-L191 VanDerWaalsContact O-CB 3.28Å; I187-L191 WeakPolarHBondContact O-CB 3.38Å; I187-L191 WeakPolarHBondContact O-CG 3.49Å; I187-L191 PolarHBondContact O-N 3.27Å; V188-L191 PolarHBondContact O-N 3.44Å; L191-L193 VanDerWaalsContact C-N 3.29Å; L191-L193 PolarHBondContact O-N 2.99Å; L191-L194 PolarHBondContact O-N 3.06Å; L191-V195 WeakPolarHBondContact O-CB 3.17Å; L191-V195 VanDerWaalsContact O-CG2 3.26Å; L191-V195 WeakPolarHBondContact O-CG2 3.34Å; L191-V195 PolarHBondContact O-N 3.33Å; L191-I213 HydrophobicContact CD1-CD1 3.65Å; L191-I234 HydrophobicContact CB-CD1 4.46Å; L191-I234 HydrophobicContact CB-CG2 3.81Å
192H90.5Very high88.8Confident26 Ų2625.2 Ų25.212%0.1213%0.132CC..Hα-helixtrans-59.1-42.1175.1-82.6-62.1000112.3R176 W177 V188 A189 A196 E233R176-H192 HydrophobicContact CB-CB 4.09Å; W177-H192 HydrophobicContact CE3-CB 3.89Å; W177-H192 HydrophobicContact CZ3-CB 4.09Å; V188-H192 PolarHBondContact O-CD2 2.85Å; V188-H192 PolarHBondContact O-N 3.48Å; A189-H192 PolarHBondContact O-N 2.76Å; H192-A196 VanDerWaalsContact O-CB 3.31Å; H192-A196 WeakPolarHBondContact O-CB 3.49Å; H192-A196 PolarHBondContact O-N 2.79Å; H192-E233 PolarHBondContact CE1-O 2.87Å; H192-E233 VanDerWaalsContact CE1-O 3.25Å
193L92.6Very high88Confident0 Ų025.8 Ų25.80%014%0.136CC..Hα-helixtrans-61.6-49.4176.917564.4000111.5L129 L161 I164 W177 A189 I190 L191 A196 L197L129-L193 HydrophobicContact CD1-CD2 3.77Å; L129-L193 HydrophobicContact CD2-CD2 3.79Å; L129-L193 HydrophobicContact CG-CD2 4.45Å; L161-L193 HydrophobicContact CD2-CD1 4.14Å; L161-L193 HydrophobicContact CD2-CD2 3.69Å; I164-L193 HydrophobicContact CD1-CD1 4.34Å; I164-L193 HydrophobicContact CG2-CD1 3.82Å; W177-L193 HydrophobicContact CB-CB 4.49Å; W177-L193 HydrophobicContact CD2-CB 3.98Å; W177-L193 HydrophobicContact CD2-CD1 3.98Å; W177-L193 HydrophobicContact CE3-CB 4.1Å; W177-L193 HydrophobicContact CG-CB 4.15Å; W177-L193 HydrophobicContact CG-CD1 4.19Å; W177-L193 HydrophobicContact CZ2-CD1 4.08Å; A189-L193 WeakPolarHBondContact O-CB 3.32Å; A189-L193 PolarHBondContact O-N 2.79Å; I190-L193 WeakPolarHBondContact O-CB 3.48Å; I190-L193 PolarHBondContact O-N 2.97Å; L191-L193 VanDerWaalsContact C-N 3.29Å; L191-L193 PolarHBondContact O-N 2.99Å; L193-A196 PolarHBondContact O-N 2.93Å; L193-L197 HydrophobicContact CD1-CD1 4.23Å; L193-L197 HydrophobicContact CD1-CG 4.45Å; L193-L197 HydrophobicContact CG-CD1 4.18Å; L193-L197 WeakPolarHBondContact O-CB 3.46Å; L193-L197 WeakPolarHBondContact O-CG 3.29Å; L193-L197 PolarHBondContact O-N 3.32Å
194L93.6Very high87.2Confident0 Ų028.6 Ų28.60%016%0.157CC..Hα-helixtrans-68.7-36.9-178.7-69.3175.2000112.8L101 W104 I105 L119 L123 L129 L132 I190 L191 L197 S198L101-L194 HydrophobicContact CB-CD1 4.46Å; L101-L194 HydrophobicContact CD1-CB 4.01Å; L101-L194 HydrophobicContact CD1-CD1 4.3Å; L101-L194 HydrophobicContact CD2-CB 4.15Å; W104-L194 HydrophobicContact CZ3-CD2 4.34Å; I105-L194 HydrophobicContact CD1-CD1 3.95Å; I105-L194 HydrophobicContact CD1-CD2 3.8Å; I105-L194 HydrophobicContact CG1-CD2 4.5Å; L119-L194 HydrophobicContact CD1-CD1 3.92Å; L119-L194 HydrophobicContact CD2-CD1 3.8Å; L119-L194 HydrophobicContact CG-CD1 4.38Å; L123-L194 HydrophobicContact CD2-CD1 3.77Å; L123-L194 HydrophobicContact CD2-CD2 3.96Å; L123-L194 HydrophobicContact CD2-CG 4.15Å; L129-L194 HydrophobicContact CD2-CD2 4.23Å; L132-L194 HydrophobicContact CD2-CD2 3.89Å; I190-L194 HydrophobicContact CG2-CD1 3.85Å; I190-L194 HydrophobicContact CG2-CG 4.36Å; I190-L194 WeakPolarHBondContact O-CB 3.26Å; I190-L194 VanDerWaalsContact O-CG 3.3Å; I190-L194 WeakPolarHBondContact O-CG 3.32Å; I190-L194 PolarHBondContact O-N 3.46Å; L191-L194 PolarHBondContact O-N 3.06Å; L194-L197 PolarHBondContact O-N 3.14Å; L194-S198 VanDerWaalsContact O-CB 3.32Å; L194-S198 WeakPolarHBondContact O-CB 3.34Å; L194-S198 PolarHBondContact O-N 3.1Å; L194-S198 PolarHBondContact O-OG 3.22Å
195V90.3Very high86.6Confident5 Ų527 Ų273%0.0314%0.138CC..Hα-helixtrans-64-44.4172.9169.40000110L97 L101 L191 L197 S198 Q199 L207 I234 T235L97-V195 HydrophobicContact CD1-CG2 4.3Å; L101-V195 HydrophobicContact CD1-CG2 4.37Å; L191-V195 WeakPolarHBondContact O-CB 3.17Å; L191-V195 VanDerWaalsContact O-CG2 3.26Å; L191-V195 WeakPolarHBondContact O-CG2 3.34Å; L191-V195 PolarHBondContact O-N 3.33Å; V195-L197 PolarHBondContact O-N 3.04Å; V195-S198 WeakPolarHBondContact CA-OG 3.4Å; V195-S198 PolarHBondContact O-N 3.3Å; V195-S198 PolarHBondContact O-OG 3.3Å; V195-Q199 HydrophobicContact CG1-CG 4.38Å; V195-Q199 WeakPolarHBondContact O-CB 3.4Å; V195-Q199 WeakPolarHBondContact O-CG 3.33Å; V195-Q199 PolarHBondContact O-N 3.04Å; V195-L207 HydrophobicContact CG1-CD1 4.12Å; V195-I234 HydrophobicContact CG2-CG2 4.05Å; V195-T235 HydrophobicContact CG1-CG2 4.43Å; V195-T235 HydrophobicContact CG2-CG2 4.11Å
196A88.7Confident85.9Confident6 Ų633.7 Ų33.75%0.0516%0.161CC..Hα-helixtrans-63.3-42.1176.700000112.5L168 W177 H192 L193 H200L168-A196 HydrophobicContact CD1-CB 4.06Å; W177-A196 HydrophobicContact CH2-CB 3.63Å; W177-A196 HydrophobicContact CZ3-CB 4.06Å; H192-A196 VanDerWaalsContact O-CB 3.31Å; H192-A196 WeakPolarHBondContact O-CB 3.49Å; H192-A196 PolarHBondContact O-N 2.79Å; L193-A196 PolarHBondContact O-N 2.93Å; A196-H200 VanDerWaalsContact O-CB 3.24Å; A196-H200 WeakPolarHBondContact O-CB 3.25Å; A196-H200 PolarHBondContact O-N 3.22Å
197L90.5Very high85.5Confident0 Ų033.4 Ų33.40%016%0.157CC..Hα-helixtrans-63.5-50175.7-77171.4000112W104 L132 F133 I164 L168 L193 L194 V195 Q199 H200 F201W104-L197 HydrophobicContact CH2-CB 4.1Å; L132-L197 HydrophobicContact CD2-CD1 4.38Å; F133-L197 HydrophobicContact CD2-CD2 4.15Å; I164-L197 HydrophobicContact CD1-CD1 4.32Å; I164-L197 HydrophobicContact CG1-CD2 4.28Å; I164-L197 HydrophobicContact CG2-CD2 3.75Å; I164-L197 HydrophobicContact CG2-CG 4.28Å; L168-L197 HydrophobicContact CD2-CD2 4.48Å; L193-L197 HydrophobicContact CD1-CD1 4.23Å; L193-L197 HydrophobicContact CD1-CG 4.45Å; L193-L197 HydrophobicContact CG-CD1 4.18Å; L193-L197 WeakPolarHBondContact O-CB 3.46Å; L193-L197 WeakPolarHBondContact O-CG 3.29Å; L193-L197 PolarHBondContact O-N 3.32Å; L194-L197 PolarHBondContact O-N 3.14Å; V195-L197 PolarHBondContact O-N 3.04Å; L197-Q199 VanDerWaalsContact C-N 3.29Å; L197-Q199 PolarHBondContact O-N 3.21Å; L197-H200 PolarHBondContact O-N 3.37Å; L197-F201 HydrophobicContact CD2-CD2 4.03Å; L197-F201 HydrophobicContact CD2-CE2 3.71Å; L197-F201 WeakPolarHBondContact O-CB 3.48Å; L197-F201 WeakPolarHBondContact O-CD2 3.29Å; L197-F201 PolarHBondContact O-N 2.92Å
198S88.8Confident85Confident4 Ų433 Ų333%0.02816%0.156CC..Hα-helixtrans-62.1-36.9179.756.60000112.1L194 V195 R202 A203L194-S198 VanDerWaalsContact O-CB 3.32Å; L194-S198 WeakPolarHBondContact O-CB 3.34Å; L194-S198 PolarHBondContact O-N 3.1Å; L194-S198 PolarHBondContact O-OG 3.22Å; V195-S198 WeakPolarHBondContact CA-OG 3.4Å; V195-S198 PolarHBondContact O-N 3.3Å; V195-S198 PolarHBondContact O-OG 3.3Å; S198-R202 CarbonylContact O-C 3.3Å; S198-R202 VanDerWaalsContact O-CA 3.27Å; S198-R202 WeakPolarHBondContact O-CA 3.48Å; S198-R202 PolarHBondContact O-N 3.3Å; S198-A203 PolarHBondContact O-N 3.43Å
199Q84Confident84.3Confident32 Ų3236.9 Ų36.915%0.1518%0.176CC..Hα-helixtrans-70.6-43.5174.8-72.6175-16.400112.7V195 L197 R202 L207 F241V195-Q199 HydrophobicContact CG1-CG 4.38Å; V195-Q199 WeakPolarHBondContact O-CB 3.4Å; V195-Q199 WeakPolarHBondContact O-CG 3.33Å; V195-Q199 PolarHBondContact O-N 3.04Å; L197-Q199 VanDerWaalsContact C-N 3.29Å; L197-Q199 PolarHBondContact O-N 3.21Å; Q199-R202 PolarHBondContact O-N 3.27Å; Q199-L207 HydrophobicContact CG-CD1 4.17Å; Q199-F241 HydrophobicContact CB-CB 4.27Å; Q199-F241 HydrophobicContact CB-CG 4.24Å
200H84.6Confident83.5Confident68 Ų6842 Ų4232%0.31520%0.2SC..Hα-helixtrans-66.8-48.1-178.8-178.884.5000112.4S167 L168 A196 L197 R202S167-H200 PolarHBondContact O-CE1 2.86Å; S167-H200 PolarHBondContact O-NE2 3.36Å; S167-H200 PolarHBondContact OG-NE2 2.93Å; L168-H200 HydrophobicContact CD2-CB 3.26Å; L168-H200 VanDerWaalsContact CD2-CG 3.43Å; A196-H200 VanDerWaalsContact O-CB 3.24Å; A196-H200 WeakPolarHBondContact O-CB 3.25Å; A196-H200 PolarHBondContact O-N 3.22Å; L197-H200 PolarHBondContact O-N 3.37Å; H200-R202 PolarHBondContact O-N 3.37Å
201F82.7Confident83Confident50 Ų5042 Ų4222%0.21920%0.2CC..THydrogen-bonded Turntrans-85.23.8178.6-68.3-77.2000113.2F133 L136 E137 L197 A203F133-F201 HydrophobicContact CD2-CE2 4.15Å; F133-F201 HydrophobicContact CD2-CZ 4.24Å; F133-F201 HydrophobicContact CE2-CE2 4.02Å; F133-F201 AromaticContact CE2-CZ 3.85Å; F133-F201 HydrophobicContact CE2-CZ 3.85Å; L136-F201 HydrophobicContact CB-CB 4.43Å; L136-F201 HydrophobicContact CB-CD1 3.81Å; L136-F201 HydrophobicContact CB-CD2 3.99Å; L136-F201 HydrophobicContact CB-CE1 3.98Å; L136-F201 HydrophobicContact CB-CE2 4.15Å; L136-F201 HydrophobicContact CB-CG 3.82Å; L136-F201 HydrophobicContact CB-CZ 4.15Å; L136-F201 HydrophobicContact CD1-CB 4.36Å; L136-F201 HydrophobicContact CD1-CD2 3.8Å; L136-F201 HydrophobicContact CD1-CE2 4.34Å; L136-F201 HydrophobicContact CD1-CG 4.13Å; L136-F201 HydrophobicContact CD2-CB 4.06Å; L136-F201 HydrophobicContact CD2-CG 4.37Å; L136-F201 HydrophobicContact CG-CD2 4.42Å; L136-F201 HydrophobicContact CG-CG 4.33Å; E137-F201 HydrophobicContact CB-CE1 4.45Å; E137-F201 HydrophobicContact CB-CZ 4.43Å; L197-F201 HydrophobicContact CD2-CD2 4.03Å; L197-F201 HydrophobicContact CD2-CE2 3.71Å; L197-F201 WeakPolarHBondContact O-CB 3.48Å; L197-F201 WeakPolarHBondContact O-CD2 3.29Å; L197-F201 PolarHBondContact O-N 2.92Å; F201-A203 VanDerWaalsContact C-N 3.32Å; F201-A203 PolarHBondContact O-N 3.37Å
202R71.7Confident82.5Confident92 Ų9243.3 Ų43.335%0.34721%0.209SC..THydrogen-bonded Turntrans49.351.9177.7-55.4-178.5-173.3180-1.8112.7S198 Q199 H200 R345 E347S198-R202 CarbonylContact O-C 3.3Å; S198-R202 VanDerWaalsContact O-CA 3.27Å; S198-R202 WeakPolarHBondContact O-CA 3.48Å; S198-R202 PolarHBondContact O-N 3.3Å; Q199-R202 PolarHBondContact O-N 3.27Å; H200-R202 PolarHBondContact O-N 3.37Å; R202-R345 VanDerWaalsContact CZ-CD 3.42Å; R202-R345 VanDerWaalsContact NH1-CD 3.26Å; R202-E347 IonicContact NH1-OE1 2.78Å; R202-E347 PolarHBondContact NH1-OE1 3.14Å; R202-E347 IonicContact NH1-OE2 3.27Å; R202-E347 PolarHBondContact NH1-OE2 3.35Å
203A77.3Confident82.2Confident12 Ų1242.1 Ų42.110%0.09920%0.203CC..  trans-48.9139.9175.100000110.9W104 S198 F201 I205W104-A203 HydrophobicContact CD2-CB 4.03Å; W104-A203 HydrophobicContact CG-CB 4.25Å; W104-A203 HydrophobicContact CZ2-CB 3.75Å; S198-A203 PolarHBondContact O-N 3.43Å; F201-A203 VanDerWaalsContact C-N 3.32Å; F201-A203 PolarHBondContact O-N 3.37Å; A203-I205 HydrophobicContact CB-CD1 3.93Å; A203-I205 HydrophobicContact CB-CG1 3.78Å; A203-I205 PolarHBondContact O-N 2.93Å
204P74.3Confident81.5Confident87 Ų8746.1 Ų46.157%0.56522%0.222SC*.SBendtrans-75.651.9-179.634.3-38.4000111.7N351P204-N351 VanDerWaalsContact CA-OD1 3.26Å; P204-N351 WeakPolarHBondContact CA-OD1 3.36Å; P204-N351 WeakPolarHBondContact CB-OD1 3.28Å
205I78Confident80.8Confident43 Ų4346.2 Ų46.222%0.22122%0.222CC..  trans-131.5146.7-175.865.1-178.4000111.5V100 L101 W104 A203 L207V100-I205 HydrophobicContact CG1-CB 3.88Å; V100-I205 HydrophobicContact CG1-CD1 4.16Å; V100-I205 HydrophobicContact CG1-CG1 4.33Å; V100-I205 HydrophobicContact CG1-CG2 4.45Å; L101-I205 HydrophobicContact CD2-CD1 4.08Å; W104-I205 HydrophobicContact CB-CD1 3.78Å; W104-I205 HydrophobicContact CB-CG2 3.65Å; W104-I205 HydrophobicContact CD2-CD1 3.88Å; W104-I205 HydrophobicContact CE3-CD1 4.12Å; W104-I205 HydrophobicContact CG-CD1 3.72Å; W104-I205 HydrophobicContact CG-CG2 3.93Å; A203-I205 HydrophobicContact CB-CD1 3.93Å; A203-I205 HydrophobicContact CB-CG1 3.78Å; A203-I205 PolarHBondContact O-N 2.93Å; I205-L207 HydrophobicContact CD1-CD2 4.03Å; I205-L207 HydrophobicContact CG1-CD2 4.38Å
206R75.8Confident80Confident211 Ų21146.7 Ų46.780%0.79623%0.225SC*.  trans-97.6103.9175.8-173.3177.3178.5-176.8-1.1109.9
207L80.6Confident79.1Confident24 Ų2446.9 Ų46.913%0.12623%0.226CC..PPolyproline II helixtrans-71.7137.1174.1-60.6174.3000110.1L97 L101 V195 Q199 I205 T235L97-L207 HydrophobicContact CD1-CD2 3.74Å; L101-L207 HydrophobicContact CD2-CD2 3.92Å; L101-L207 HydrophobicContact CG-CD2 4.49Å; V195-L207 HydrophobicContact CG1-CD1 4.12Å; Q199-L207 HydrophobicContact CG-CD1 4.17Å; I205-L207 HydrophobicContact CD1-CD2 4.03Å; I205-L207 HydrophobicContact CG1-CD2 4.38Å; L207-T235 HydrophobicContact CB-CG2 4.44Å
208P76.9Confident78.2Confident16 Ų1647.6 Ų47.610%0.10423%0.23CC..PPolyproline II helixtrans-66.3142.3172.325-34.1000112L97 V211 T235L97-P208 HydrophobicContact CB-CG 3.62Å; L97-P208 HydrophobicContact CD1-CG 4.05Å; L97-P208 HydrophobicContact CG-CG 4.39Å; P208-V211 HydrophobicContact CB-CG2 3.9Å; P208-V211 HydrophobicContact CG-CG2 3.68Å; P208-T235 WeakPolarHBondContact O-CB 3.31Å; P208-T235 PolarHBondContact O-OG1 3.27Å
209D73.3Confident77.4Confident96 Ų9649.1 Ų49.151%0.51324%0.237SC..THydrogen-bonded Turntrans-81140.1-176.9-59.8-45.8000112.8K93 V211K93-D209 PolarHBondContact NZ-O 3.11Å; D209-V211 PolarHBondContact O-N 3.43Å
210H74.8Confident76.5Confident110 Ų11050.5 Ų50.551%0.50924%0.243SC..THydrogen-bonded Turntrans54.949.1173.9-55.8-65.4000113.4E233 T235H210-E233 IonicContact ND1-OE1 2.98Å; H210-E233 PolarHBondContact ND1-OE1 2.7Å; H210-T235 WeakPolarHBondContact CA-O 3.06Å; H210-T235 PolarHBondContact N-O 3.25Å; H210-T235 PolarHBondContact N-OG1 3.21Å
211V82.6Confident75.8Confident1 Ų153.1 Ų53.11%0.00625%0.25CC..  trans-80.9122.8171.9-177.10000108.6K93 L94 L97 P208 D209 I234 T235K93-V211 HydrophobicContact CB-CG2 4.13Å; L94-V211 HydrophobicContact CB-CG1 4.26Å; L94-V211 HydrophobicContact CD1-CG1 4.02Å; L97-V211 HydrophobicContact CB-CG2 4.44Å; L97-V211 HydrophobicContact CD2-CB 4.15Å; L97-V211 HydrophobicContact CD2-CG1 3.93Å; L97-V211 HydrophobicContact CD2-CG2 4.37Å; P208-V211 HydrophobicContact CB-CG2 3.9Å; P208-V211 HydrophobicContact CG-CG2 3.68Å; D209-V211 PolarHBondContact O-N 3.43Å; V211-I234 PolarHBondContact O-N 3.27Å; V211-T235 HydrophobicContact CB-CG2 4.5Å; V211-T235 VanDerWaalsContact CB-OG1 3.26Å; V211-T235 WeakPolarHBondContact CB-OG1 3.26Å; V211-T235 WeakPolarHBondContact CG2-OG1 3.39Å; V211-T235 PolarHBondContact N-OG1 3.47Å; V211-T235 PolarHBondContact O-N 2.78Å
212S82.1Confident75.3Confident27 Ų2759.2 Ų59.219%0.18928%0.279CS..EExtended strand (participates in β ladder)trans-128143.8177.164.60000110.8Q231 E232S212-Q231 PolarHBondContact OG-NE2 3.2Å; S212-E232 CarbonylContact C-O 3.45Å; S212-E232 WeakPolarHBondContact CA-O 3.27Å
213I83.8Confident74.9Confident0 Ų057.3 Ų57.30%029%0.288CS..EExtended strand (participates in β ladder)trans-113.1131.8178.3-57.7-179.8000107.8V84 L94 V188 L191 V215 E232 I234V84-I213 HydrophobicContact CG1-CG2 3.67Å; V84-I213 HydrophobicContact CG2-CG2 4.3Å; L94-I213 HydrophobicContact CD1-CD1 3.56Å; L94-I213 HydrophobicContact CD1-CG1 3.81Å; L94-I213 HydrophobicContact CD2-CD1 4.03Å; L94-I213 HydrophobicContact CD2-CG1 3.98Å; L94-I213 HydrophobicContact CG-CD1 4.46Å; L94-I213 HydrophobicContact CG-CG1 4.5Å; V188-I213 HydrophobicContact CG2-CD1 4.23Å; V188-I213 HydrophobicContact CG2-CG2 4.29Å; L191-I213 HydrophobicContact CD1-CD1 3.65Å; I213-V215 HydrophobicContact CB-CG2 4.38Å; I213-V215 HydrophobicContact CG2-CG2 4.01Å; I213-E232 PolarHBondContact N-O 2.77Å; I213-E232 PolarHBondContact O-N 3.49Å; I213-I234 HydrophobicContact CD1-CD1 3.86Å; I213-I234 HydrophobicContact CD1-CG1 3.62Å; I213-I234 HydrophobicContact CG1-CD1 4.29Å; I213-I234 HydrophobicContact CG1-CG1 3.74Å
214Q76.3Confident74.3Confident84 Ų8462.2 Ų62.239%0.39331%0.311SS..EExtended strand (participates in β ladder)trans-81.4129.5167.9-58.5-1740.900109.9D85 S88D85-Q214 HydrophobicContact CB-CB 4.17Å; D85-Q214 PolarHBondContact N-O 3.48Å; S88-Q214 VanDerWaalsContact OG-CB 3.25Å; S88-Q214 WeakPolarHBondContact OG-CB 3.42Å; S88-Q214 PolarHBondContact OG-N 3.48Å
215V79Confident74.2Confident2 Ų261.6 Ų61.61%0.01230%0.303CS..EExtended strand (participates in β ladder)trans-127.7123.7-172.1-169.60000108.5T82 M83 V188 I213 I230 E232T82-V215 HydrophobicContact CG2-CB 4.45Å; T82-V215 HydrophobicContact CG2-CG1 3.04Å; M83-V215 CarbonylContact O-C 3.55Å; M83-V215 WeakPolarHBondContact O-CA 3.25Å; M83-V215 WeakPolarHBondContact O-CG1 3.23Å; V188-V215 HydrophobicContact CG2-CG2 3.96Å; I213-V215 HydrophobicContact CB-CG2 4.38Å; I213-V215 HydrophobicContact CG2-CG2 4.01Å; V215-I230 PolarHBondContact N-O 3.33Å; V215-I230 PolarHBondContact O-N 2.86Å; V215-E232 HydrophobicContact CG2-CB 4.1Å; V215-E232 HydrophobicContact CG2-CG 3.99Å
216V73.6Confident73.9Confident15 Ų1564.3 Ų64.39%0.09131%0.314CS..EExtended strand (participates in β ladder)trans-88.3116.6174.4-172.20000107.8Y66 M83 V218 Q229Y66-V216 HydrophobicContact CE1-CG2 4.38Å; M83-V216 PolarHBondContact N-O 3.01Å; M83-V216 PolarHBondContact O-N 3.42Å; V216-V218 HydrophobicContact CG1-CG2 4.06Å; V216-Q229 HydrophobicContact CG2-CG 4.24Å
217V71.4Confident73.7Confident10 Ų1058.6 Ų58.66%0.06131%0.307CS..EExtended strand (participates in β ladder)trans-99113.4173.7178.80000108.3V80 R81 T82 S227 R228 I230V80-V217 HydrophobicContact CG1-CG1 3.34Å; R81-V217 WeakPolarHBondContact O-CA 3.31Å; T82-V217 HydrophobicContact CG2-CG2 4.49Å; V217-S227 CarbonylContact O-C 3.57Å; V217-S227 WeakPolarHBondContact O-CA 3.45Å; V217-R228 HydrophobicContact CB-CG 3.89Å; V217-R228 HydrophobicContact CG1-CG 4.46Å; V217-R228 PolarHBondContact N-O 3.41Å; V217-R228 PolarHBondContact O-N 2.92Å; V217-I230 HydrophobicContact CB-CD1 4.09Å; V217-I230 HydrophobicContact CG2-CD1 3.41Å; V217-I230 VanDerWaalsContact CG2-CD1 3.41Å; V217-I230 HydrophobicContact CG2-CG1 4.04Å
218V71.8Confident73.4Confident16 Ų1665 Ų6510%0.09733%0.329CS..EExtended strand (participates in β ladder)trans-101.7121.3175.6-172.20000107.9L75 V80 R81 V216 L225 Q226L75-V218 HydrophobicContact CD1-CB 4.2Å; L75-V218 HydrophobicContact CD1-CG1 3.84Å; V80-V218 WeakPolarHBondContact CA-O 3.25Å; R81-V218 PolarHBondContact N-O 3.44Å; R81-V218 PolarHBondContact O-N 3.27Å; V216-V218 HydrophobicContact CG1-CG2 4.06Å; V218-L225 HydrophobicContact CG1-CB 4.19Å; V218-L225 HydrophobicContact CG1-CD2 4.04Å; V218-Q226 CarbonylContact C-O 3.47Å; V218-Q226 WeakPolarHBondContact CA-O 3.48Å
219Q71Confident73.2Confident36 Ų3670.1 Ų70.117%0.16835%0.352CS..EExtended strand (participates in β ladder)trans-121.4128.4175.9-176173.233.600109.8E79 V80 R221 Q226E79-Q219 WeakPolarHBondContact O-CA 3.42Å; V80-Q219 HydrophobicContact CG2-CB 4.22Å; V80-Q219 HydrophobicContact CG2-CG 3.86Å; Q219-R221 HydrophobicContact CG-CG 4.01Å; Q219-Q226 PolarHBondContact N-O 2.91Å; Q219-Q226 PolarHBondContact O-N 3.37Å
220K65.4Low73.3Confident61 Ų6167.5 Ų67.527%0.26534%0.338SS..EExtended strand (participates in β ladder)trans-86.1112.9171.4-167.2175.8177.5175.60110.1L75 N78 E79 I224 L225L75-K220 HydrophobicContact CB-CB 4.09Å; L75-K220 HydrophobicContact CB-CD 4.27Å; L75-K220 WeakPolarHBondContact O-CD 3.2Å; L75-K220 PolarHBondContact O-NZ 2.9Å; N78-K220 WeakPolarHBondContact CA-O 3.24Å; N78-K220 PolarHBondContact N-O 2.95Å; E79-K220 PolarHBondContact O-N 2.66Å; K220-I224 WeakPolarHBondContact CA-O 3.36Å; K220-L225 HydrophobicContact CB-CD2 3.92Å; K220-L225 HydrophobicContact CD-CD2 4.38Å; K220-L225 HydrophobicContact CG-CD2 4.1Å
221R69.8Low73.5Confident122 Ų12268.4 Ų68.446%0.4634%0.342SS..EExtended strand (participates in β ladder)trans-120.8128.2172.8-69.4-165.3-176.8-162.50109.9Q219 G223 I224Q219-R221 HydrophobicContact CG-CG 4.01Å; R221-G223 PolarHBondContact O-N 3.45Å; R221-G223 VanDerWaalsContact O-N 3.16Å; R221-I224 PolarHBondContact N-O 3.45Å; R221-I224 PolarHBondContact O-N 2.85Å
222E71.2Confident73.3Confident179 Ų17970.5 Ų70.584%0.83635%0.352SS*.THydrogen-bonded Turntrans5435.9176-55.1-179.9172.200112.7E77 I224E77-E222 WeakPolarHBondContact OE1-CA 3.11Å; E77-E222 PolarHBondContact OE1-N 3.31Å; E222-I224 VanDerWaalsContact C-N 3.3Å; E222-I224 PolarHBondContact O-N 3.48Å
223G63.4Low73.3Confident52 Ų5273.9 Ų73.954%0.53637%0.365SS..THydrogen-bonded Turntrans78.8-1.1-176.600000116.3R221R221-G223 PolarHBondContact O-N 3.45Å; R221-G223 VanDerWaalsContact O-N 3.16Å
224I66.4Low73.3Confident114 Ų11474.1 Ų74.159%0.58537%0.366SS*.EExtended strand (participates in β ladder)trans-105.7131.7178.1-56.6175.3000110.1K220 R221 E222 Q226K220-I224 WeakPolarHBondContact CA-O 3.36Å; R221-I224 PolarHBondContact N-O 3.45Å; R221-I224 PolarHBondContact O-N 2.85Å; E222-I224 VanDerWaalsContact C-N 3.3Å; E222-I224 PolarHBondContact O-N 3.48Å; I224-Q226 PolarHBondContact O-N 3.4Å
225L71.9Confident73.1Confident75 Ų7570.3 Ų70.339%0.39335%0.348SS..EExtended strand (participates in β ladder)trans-76.3112.1171.5-63.9175.8000109.5L75 V218 K220L75-L225 HydrophobicContact CB-CD2 4.49Å; L75-L225 HydrophobicContact CD1-CD2 3.99Å; V218-L225 HydrophobicContact CG1-CB 4.19Å; V218-L225 HydrophobicContact CG1-CD2 4.04Å; K220-L225 HydrophobicContact CB-CD2 3.92Å; K220-L225 HydrophobicContact CD-CD2 4.38Å; K220-L225 HydrophobicContact CG-CD2 4.1Å
226Q70.8Confident72.2Confident99 Ų9971.7 Ų71.746%0.46336%0.363SS..EExtended strand (participates in β ladder)trans-95.8113.5171.2-65.2-174.4-1600109V218 Q219 I224V218-Q226 CarbonylContact C-O 3.47Å; V218-Q226 WeakPolarHBondContact CA-O 3.48Å; Q219-Q226 PolarHBondContact N-O 2.91Å; Q219-Q226 PolarHBondContact O-N 3.37Å; I224-Q226 PolarHBondContact O-N 3.4Å
227S72.3Confident70.8Confident92 Ų9274.8 Ų74.864%0.64338%0.379SS*.EExtended strand (participates in β ladder)trans-97.8131.9172.259.40000110.7V217V217-S227 CarbonylContact O-C 3.57Å; V217-S227 WeakPolarHBondContact O-CA 3.45Å
228R73Confident69.5Low157 Ų15777.3 Ų77.359%0.59240%0.395SS*.EExtended strand (participates in β ladder)trans-128.5139.716865179.8-179.6132.41110.1V217 I230V217-R228 HydrophobicContact CB-CG 3.89Å; V217-R228 HydrophobicContact CG1-CG 4.46Å; V217-R228 PolarHBondContact N-O 3.41Å; V217-R228 PolarHBondContact O-N 2.92Å; R228-I230 HydrophobicContact CG-CD1 4.41Å; R228-I230 HydrophobicContact CG-CG1 4.23Å
229Q73.9Confident68Low125 Ų12580.2 Ų80.258%0.58441%0.407SS*.EExtended strand (participates in β ladder)trans-87.7131171.2-71.2175.5-12.300109.3Y66 V216Y66-Q229 PolarHBondContact OH-NE2 3.24Å; Y66-Q229 VanDerWaalsContact OH-NE2 3.07Å; V216-Q229 HydrophobicContact CG2-CG 4.24Å
230I75.1Confident66.4Low40 Ų4082.6 Ų82.621%0.20543%0.433CS..EExtended strand (participates in β ladder)trans-125.2134.7176-52.5178.8000107.2V215 V217 R228 E232V215-I230 PolarHBondContact N-O 3.33Å; V215-I230 PolarHBondContact O-N 2.86Å; V217-I230 HydrophobicContact CB-CD1 4.09Å; V217-I230 HydrophobicContact CG2-CD1 3.41Å; V217-I230 VanDerWaalsContact CG2-CD1 3.41Å; V217-I230 HydrophobicContact CG2-CG1 4.04Å; R228-I230 HydrophobicContact CG-CD1 4.41Å; R228-I230 HydrophobicContact CG-CG1 4.23Å; I230-E232 HydrophobicContact CG2-CG 4.5Å
231Q77.9Confident65.1Low129 Ų12983.8 Ų83.860%0.60344%0.438SS*.EExtended strand (participates in β ladder)trans-92.1115.2169.4-172.1173.61.200108.1S212S212-Q231 PolarHBondContact OG-NE2 3.2Å
232E80.4Confident63.8Low45 Ų4579.9 Ų79.921%0.2143%0.43CS..EExtended strand (participates in β ladder)trans-96.6124.8174.6-75.4-73.917500108.9R176 V188 S212 I213 V215 I230R176-E232 IonicContact CZ-OE2 3.97Å; R176-E232 IonicContact NH1-OE1 3.44Å; R176-E232 PolarHBondContact NH1-OE1 2.95Å; R176-E232 IonicContact NH1-OE2 2.81Å; R176-E232 PolarHBondContact NH1-OE2 3.47Å; V188-E232 HydrophobicContact CG1-CB 4.4Å; S212-E232 CarbonylContact C-O 3.45Å; S212-E232 WeakPolarHBondContact CA-O 3.27Å; I213-E232 PolarHBondContact N-O 2.77Å; I213-E232 PolarHBondContact O-N 3.49Å; V215-E232 HydrophobicContact CG2-CB 4.1Å; V215-E232 HydrophobicContact CG2-CG 3.99Å; I230-E232 HydrophobicContact CG2-CG 4.5Å
233E82.1Confident62.3Low98 Ų9874.1 Ų74.146%0.45842%0.419SS..EExtended strand (participates in β ladder)trans-91.1113.5179.6-166.2179.7-169.300109.8H192 H210 G236H192-E233 PolarHBondContact CE1-O 2.87Å; H192-E233 VanDerWaalsContact CE1-O 3.25Å; H210-E233 IonicContact ND1-OE1 2.98Å; H210-E233 PolarHBondContact ND1-OE1 2.7Å; E233-G236 WeakPolarHBondContact OE1-CA 3.21Å
234I83.7Confident61.1Low6 Ų683.4 Ų83.43%0.03144%0.437CS..SBendtrans-83.2-48.8-175.9-56.6-58000111.1L97 V188 L191 V195 V211 I213L97-I234 HydrophobicContact CD2-CB 4.3Å; L97-I234 HydrophobicContact CD2-CG2 3.59Å; V188-I234 HydrophobicContact CG1-CD1 4.11Å; L191-I234 HydrophobicContact CB-CD1 4.46Å; L191-I234 HydrophobicContact CB-CG2 3.81Å; V195-I234 HydrophobicContact CG2-CG2 4.05Å; V211-I234 PolarHBondContact O-N 3.27Å; I213-I234 HydrophobicContact CD1-CD1 3.86Å; I213-I234 HydrophobicContact CD1-CG1 3.62Å; I213-I234 HydrophobicContact CG1-CD1 4.29Å; I213-I234 HydrophobicContact CG1-CG1 3.74Å
235T71.9Confident60.3Low3 Ų382.9 Ų82.92%0.01843%0.432CS..SBendtrans-110.266.9175.858.30000109.7L97 V195 L207 P208 H210 V211L97-T235 HydrophobicContact CD1-CG2 3.99Å; L97-T235 HydrophobicContact CD2-CG2 4.01Å; V195-T235 HydrophobicContact CG1-CG2 4.43Å; V195-T235 HydrophobicContact CG2-CG2 4.11Å; L207-T235 HydrophobicContact CB-CG2 4.44Å; P208-T235 WeakPolarHBondContact O-CB 3.31Å; P208-T235 PolarHBondContact O-OG1 3.27Å; H210-T235 WeakPolarHBondContact CA-O 3.06Å; H210-T235 PolarHBondContact N-O 3.25Å; H210-T235 PolarHBondContact N-OG1 3.21Å; V211-T235 HydrophobicContact CB-CG2 4.5Å; V211-T235 VanDerWaalsContact CB-OG1 3.26Å; V211-T235 WeakPolarHBondContact CB-OG1 3.26Å; V211-T235 WeakPolarHBondContact CG2-OG1 3.39Å; V211-T235 PolarHBondContact N-OG1 3.47Å; V211-T235 PolarHBondContact O-N 2.78Å
236G59.1Low59.5Low32 Ų3288 Ų8833%0.3345%0.454SS..  trans-95.8129.2175.700000112.2E233 T238E233-G236 WeakPolarHBondContact OE1-CA 3.21Å; G236-T238 PolarHBondContact O-N 2.8Å
237N44.4Very low59.3Low79 Ų7989.6 Ų89.642%0.42246%0.456SS..  trans30.280.4179.6-97.14000113.9E239 A240N237-E239 HydrophobicContact CB-CB 4.36Å; N237-E239 PolarHBondContact O-N 2.87Å; N237-A240 PolarHBondContact O-N 2.84Å
238T43.3Very low59.4Low63 Ų6386.9 Ų86.939%0.38744%0.435SS..G310 helixtrans-47.8-13.8165.2-51.60000113.2G236 A240 F241 S242G236-T238 PolarHBondContact O-N 2.8Å; T238-A240 PolarHBondContact O-N 3.45Å; T238-F241 PolarHBondContact O-N 2.81Å; T238-S242 PolarHBondContact O-N 2.82Å; T238-S242 PolarHBondContact O-OG 2.97Å
239E40.5Very low59.8Low78 Ų7883.3 Ų83.336%0.36444%0.438SS..G310 helixtrans-54.3-25.4169.5-59.4-173.5178.600114.7N237 S242 R247N237-E239 HydrophobicContact CB-CB 4.36Å; N237-E239 PolarHBondContact O-N 2.87Å; E239-S242 WeakPolarHBondContact CA-OG 3.35Å; E239-R247 IonicContact OE1-CZ 3Å; E239-R247 VanDerWaalsContact OE1-CZ 3.28Å; E239-R247 IonicContact OE1-NE 3.9Å; E239-R247 PolarHBondContact OE1-NE 3.43Å; E239-R247 IonicContact OE1-NH2 3.47Å; E239-R247 PolarHBondContact OE1-NH2 2.84Å; E239-R247 IonicContact OE2-NE 3.56Å
240A39Very low60.3Low86 Ų8678.2 Ų78.271%0.71141%0.414SS*.G310 helixtrans-75.7-27.7-177.100000114.1N237 T238N237-A240 PolarHBondContact O-N 2.84Å; T238-A240 PolarHBondContact O-N 3.45Å
241F37.9Very low60.7Low85 Ų8577.1 Ų77.137%0.37341%0.409SS..THydrogen-bonded Turntrans-100.3-21.3179.9-74.9-89.3000113L170 Q199 T238 G243L170-F241 HydrophobicContact CD2-CE1 3.9Å; L170-F241 HydrophobicContact CD2-CZ 3.74Å; Q199-F241 HydrophobicContact CB-CB 4.27Å; Q199-F241 HydrophobicContact CB-CG 4.24Å; T238-F241 PolarHBondContact O-N 2.81Å; F241-G243 PolarHBondContact O-N 3.06Å
242S41.3Very low61Low41 Ų4174.8 Ų74.829%0.28740%0.404SS..SBendtrans-83.383.5165.162.40000109T238 E239 R244T238-S242 PolarHBondContact O-N 2.82Å; T238-S242 PolarHBondContact O-OG 2.97Å; E239-S242 WeakPolarHBondContact CA-OG 3.35Å; S242-R244 PolarHBondContact O-N 3.46Å
243G39.3Very low61.2Low58 Ų5873.9 Ų73.960%0.59840%0.4SS*.THydrogen-bonded Turntrans-34.1115.4-174.900000114.2F241 H245F241-G243 PolarHBondContact O-N 3.06Å; G243-H245 PolarHBondContact O-N 3.21Å
244R39.2Very low61.3Low246 Ų24672 Ų7293%0.92839%0.391SS*.THydrogen-bonded Turntrans32.277.7166.7-71.3-175.3176.6177.7-0.9114.8S242S242-R244 PolarHBondContact O-N 3.46Å
245H48.9Very low61.1Low103 Ų10375.7 Ų75.748%0.47741%0.41SS..  trans-105.8114.7153.3-67.1-65.7000108.3G243 R247G243-H245 PolarHBondContact O-N 3.21Å; H245-R247 PolarHBondContact O-N 3.49Å
246E55.6Low61.5Low184 Ų18482.5 Ų82.586%0.8644%0.442SS*.  trans-52.9126.5165.7-134.4172.4-174.200107.6D248E246-D248 PolarHBondContact O-N 3.5Å
247R65.8Low62.7Low131 Ų13182 Ų8249%0.49443%0.434SS..  trans-49126.8-179.6-78.7-167.6172.7-144.2-4.5109.8E239 H245 D255E239-R247 IonicContact OE1-CZ 3Å; E239-R247 VanDerWaalsContact OE1-CZ 3.28Å; E239-R247 IonicContact OE1-NE 3.9Å; E239-R247 PolarHBondContact OE1-NE 3.43Å; E239-R247 IonicContact OE1-NH2 3.47Å; E239-R247 PolarHBondContact OE1-NH2 2.84Å; E239-R247 IonicContact OE2-NE 3.56Å; H245-R247 PolarHBondContact O-N 3.49Å; R247-D255 IonicContact NH1-OD2 3.24Å; R247-D255 PolarHBondContact NH1-OD2 2.77Å
248D74.7Confident64.4Low36 Ų3681.9 Ų81.919%0.19344%0.438CS..  trans-108.9179.2-178.774.414.7000112.3E246 F250 D251 T252 R359E246-D248 PolarHBondContact O-N 3.5Å; D248-F250 PolarHBondContact O-N 3.49Å; D248-F250 WeakPolarHBondContact OD1-CA 3.26Å; D248-F250 VanDerWaalsContact OD1-CB 3.29Å; D248-F250 WeakPolarHBondContact OD1-CB 3.33Å; D248-F250 PolarHBondContact OD1-N 3.22Å; D248-D251 PolarHBondContact N-OD2 3.18Å; D248-D251 PolarHBondContact O-N 2.95Å; D248-D251 VanDerWaalsContact O-N 3.09Å; D248-D251 PolarHBondContact OD1-N 3.05Å; D248-D251 VanDerWaalsContact OD1-N 3.15Å; D248-T252 PolarHBondContact O-N 3.38Å; D248-R359 VanDerWaalsContact CG-NH2 3.31Å; D248-R359 IonicContact OD1-CZ 3.83Å; D248-R359 IonicContact OD1-NE 3.87Å; D248-R359 PolarHBondContact OD1-NE 3.03Å; D248-R359 IonicContact OD1-NH2 3.11Å; D248-R359 PolarHBondContact OD1-NH2 3.13Å; D248-R359 IonicContact OD2-CZ 3.22Å; D248-R359 IonicContact OD2-NE 3.38Å; D248-R359 PolarHBondContact OD2-NE 3.02Å; D248-R359 IonicContact OD2-NH2 3.35Å; D248-R359 PolarHBondContact OD2-NH2 3.01Å
249A81.7Confident66.4Low81 Ų8185.2 Ų85.267%0.66945%0.453SS*.Hα-helixtrans-60.2-27-179.800000112.9L253A249-L253 VanDerWaalsContact O-CB 3.27Å; A249-L253 WeakPolarHBondContact O-CB 3.22Å; A249-L253 PolarHBondContact O-N 3.31Å
250F84.8Confident68.6Low18 Ų1888.2 Ų88.28%0.07947%0.465CS..Hα-helixtrans-72.7-35.6175.5-85.5-80.8000111.7D248 T252 L253 F254 V264 K355 L358 R359 Y362D248-F250 PolarHBondContact O-N 3.49Å; D248-F250 WeakPolarHBondContact OD1-CA 3.26Å; D248-F250 VanDerWaalsContact OD1-CB 3.29Å; D248-F250 WeakPolarHBondContact OD1-CB 3.33Å; D248-F250 PolarHBondContact OD1-N 3.22Å; F250-T252 VanDerWaalsContact C-N 3.34Å; F250-T252 PolarHBondContact O-N 3.12Å; F250-L253 HydrophobicContact CD1-CD2 4.07Å; F250-L253 HydrophobicContact CE1-CD2 4.18Å; F250-L253 PolarHBondContact O-N 2.85Å; F250-F254 HydrophobicContact CD1-CE2 4.29Å; F250-F254 VanDerWaalsContact O-CD2 3.27Å; F250-F254 WeakPolarHBondContact O-CD2 3.38Å; F250-F254 PolarHBondContact O-N 3.04Å; F250-V264 HydrophobicContact CE1-CG1 4.34Å; F250-K355 HydrophobicContact CB-CG 4.39Å; F250-L358 HydrophobicContact CD1-CB 4.24Å; F250-L358 HydrophobicContact CE1-CB 3.6Å; F250-L358 HydrophobicContact CE1-CD1 4.38Å; F250-L358 HydrophobicContact CZ-CB 4.15Å; F250-R359 HydrophobicContact CB-CG 4.16Å; F250-R359 HydrophobicContact CD2-CG 3.57Å; F250-R359 HydrophobicContact CE2-CG 4.08Å; F250-R359 HydrophobicContact CG-CG 3.86Å; F250-Y362 HydrophobicContact CE2-CD1 4.05Å; F250-Y362 AromaticContact CE2-CG 3.95Å; F250-Y362 HydrophobicContact CE2-CG 3.95Å; F250-Y362 HydrophobicContact CZ-CD1 4.46Å; F250-Y362 HydrophobicContact CZ-CD2 4.33Å; F250-Y362 AromaticContact CZ-CG 3.9Å; F250-Y362 HydrophobicContact CZ-CG 3.9Å
251D82.4Confident70.9Confident18 Ų1885 Ų8510%0.09644%0.436CS..Hα-helixtrans-62.1-45.4174.1-60.8-49.9000110.9D248 L253 F254 D255 K355 R359D248-D251 PolarHBondContact N-OD2 3.18Å; D248-D251 PolarHBondContact O-N 2.95Å; D248-D251 VanDerWaalsContact O-N 3.09Å; D248-D251 PolarHBondContact OD1-N 3.05Å; D248-D251 VanDerWaalsContact OD1-N 3.15Å; D251-L253 VanDerWaalsContact C-N 3.33Å; D251-L253 PolarHBondContact O-N 3.12Å; D251-F254 PolarHBondContact O-N 3.41Å; D251-D255 WeakPolarHBondContact O-CB 3.39Å; D251-D255 PolarHBondContact O-N 2.88Å; D251-K355 WeakPolarHBondContact OD1-CD 3.29Å; D251-K355 IonicContact OD1-NZ 2.77Å; D251-K355 PolarHBondContact OD1-NZ 3.2Å; D251-R359 IonicContact OD1-CZ 2.77Å; D251-R359 IonicContact OD1-NH2 3.36Å; D251-R359 PolarHBondContact OD1-NH2 3.09Å; D251-R359 IonicContact OD2-NH2 3.49Å; D251-R359 PolarHBondContact OD2-NH2 3.07Å
252T84.7Confident73.3Confident80 Ų8085.2 Ų85.249%0.49144%0.441SS..Hα-helixtrans-65.1-37.7177.1-54.80000112.3D248 F250 D255 H256D248-T252 PolarHBondContact O-N 3.38Å; F250-T252 VanDerWaalsContact C-N 3.34Å; F250-T252 PolarHBondContact O-N 3.12Å; T252-D255 PolarHBondContact O-N 3.21Å; T252-H256 PolarHBondContact O-N 3.27Å; T252-H256 PolarHBondContact O-ND1 3.17Å
253L85.6Confident75.8Confident26 Ų2687.6 Ų87.614%0.13645%0.453CS..Hα-helixtrans-62.8-44.5178.7-178.767.5000111.9A249 F250 D251 A257 K260 L261 V264A249-L253 VanDerWaalsContact O-CB 3.27Å; A249-L253 WeakPolarHBondContact O-CB 3.22Å; A249-L253 PolarHBondContact O-N 3.31Å; F250-L253 HydrophobicContact CD1-CD2 4.07Å; F250-L253 HydrophobicContact CE1-CD2 4.18Å; F250-L253 PolarHBondContact O-N 2.85Å; D251-L253 VanDerWaalsContact C-N 3.33Å; D251-L253 PolarHBondContact O-N 3.12Å; L253-A257 HydrophobicContact CD1-CB 4.13Å; L253-A257 CarbonylContact O-C 3.27Å; L253-A257 VanDerWaalsContact O-C 3.3Å; L253-A257 WeakPolarHBondContact O-CA 3.35Å; L253-A257 PolarHBondContact O-N 3.2Å; L253-K260 HydrophobicContact CD1-CB 3.56Å; L253-L261 HydrophobicContact CD2-CD1 3.88Å; L253-L261 HydrophobicContact CG-CB 4.3Å; L253-L261 HydrophobicContact CG-CD1 4.29Å; L253-V264 HydrophobicContact CD2-CG2 4.09Å
254F82.6Confident78.3Confident59 Ų5986.5 Ų86.526%0.25944%0.435SS..Hα-helixtrans-68.1-42.6177.7-89.7-105.3000111.9F250 D251 L261 L354 K355 L358F250-F254 HydrophobicContact CD1-CE2 4.29Å; F250-F254 VanDerWaalsContact O-CD2 3.27Å; F250-F254 WeakPolarHBondContact O-CD2 3.38Å; F250-F254 PolarHBondContact O-N 3.04Å; D251-F254 PolarHBondContact O-N 3.41Å; F254-L261 HydrophobicContact CD1-CD2 4.13Å; F254-L261 HydrophobicContact CD2-CD1 4.01Å; F254-L261 HydrophobicContact CD2-CD2 4.39Å; F254-L261 HydrophobicContact CE1-CD2 3.92Å; F254-L261 HydrophobicContact CE2-CD1 3.52Å; F254-L261 HydrophobicContact CE2-CD2 4.2Å; F254-L261 HydrophobicContact CG-CD2 4.38Å; F254-L261 HydrophobicContact CZ-CD1 3.89Å; F254-L261 HydrophobicContact CZ-CD2 3.97Å; F254-L354 HydrophobicContact CE1-CD2 4.02Å; F254-L354 HydrophobicContact CZ-CD2 3.83Å; F254-L354 HydrophobicContact CZ-CG 4.05Å; F254-K355 HydrophobicContact CD2-CD 4.47Å; F254-K355 HydrophobicContact CD2-CG 4.01Å; F254-K355 HydrophobicContact CE1-CB 4.24Å; F254-K355 HydrophobicContact CE2-CB 3.94Å; F254-K355 HydrophobicContact CE2-CG 3.75Å; F254-K355 HydrophobicContact CZ-CB 3.77Å; F254-K355 HydrophobicContact CZ-CG 4.12Å; F254-L358 HydrophobicContact CE2-CD1 3.92Å; F254-L358 HydrophobicContact CZ-CD1 3.9Å
255D79.7Confident81Confident83 Ų8376.5 Ų76.544%0.44440%0.398SS..Hα-helixtrans-70.9-38.1-175.3-68.5-2.8000112.5R247 D251 T252R247-D255 IonicContact NH1-OD2 3.24Å; R247-D255 PolarHBondContact NH1-OD2 2.77Å; D251-D255 WeakPolarHBondContact O-CB 3.39Å; D251-D255 PolarHBondContact O-N 2.88Å; T252-D255 PolarHBondContact O-N 3.21Å
256H81.6Confident83.2Confident146 Ų14678.8 Ų78.868%0.67641%0.407SS*.Hα-helixtrans-125.6-6.4-164.6-5791.7000115.3T252T252-H256 PolarHBondContact O-N 3.27Å; T252-H256 PolarHBondContact O-ND1 3.17Å
257A83.5Confident85.1Confident20 Ų2072.8 Ų72.817%0.16538%0.383CS..  trans-146.862.7-171.800000114.6L253 D259 K260 L261L253-A257 HydrophobicContact CD1-CB 4.13Å; L253-A257 CarbonylContact O-C 3.27Å; L253-A257 VanDerWaalsContact O-C 3.3Å; L253-A257 WeakPolarHBondContact O-CA 3.35Å; L253-A257 PolarHBondContact O-N 3.2Å; A257-D259 VanDerWaalsContact C-N 3.25Å; A257-D259 PolarHBondContact O-N 3.05Å; A257-K260 HydrophobicContact CB-CB 4.06Å; A257-K260 HydrophobicContact CB-CD 3.97Å; A257-K260 HydrophobicContact CB-CG 4.13Å; A257-K260 PolarHBondContact O-N 3.32Å; A257-L261 PolarHBondContact O-N 3.28Å; A257-L261 VanDerWaalsContact O-N 3.09Å
258P81.1Confident86.6Confident78 Ų7866.6 Ų66.651%0.50636%0.36SS..Hα-helixtrans-59.6-32.4179.524.9-34.6000113.4K260 L261 N262P258-K260 VanDerWaalsContact C-N 3.34Å; P258-K260 PolarHBondContact O-N 3.32Å; P258-L261 WeakPolarHBondContact O-CB 3.44Å; P258-L261 PolarHBondContact O-N 3.04Å; P258-N262 PolarHBondContact O-N 3.31Å
259D84.1Confident87.6Confident132 Ų13266.6 Ų66.671%0.70636%0.359SS*.Hα-helixtrans-65.4-38.8176.7-62.3-40.4000112.1A257 N262A257-D259 VanDerWaalsContact C-N 3.25Å; A257-D259 PolarHBondContact O-N 3.05Å; D259-N262 PolarHBondContact O-N 3.44Å
260K86.7Confident88.3Confident141 Ų14167.6 Ų67.661%0.61336%0.357SS*.Hα-helixtrans-71.2-33.9176.5-65-175.3-175.8174.30111.3L253 A257 P258 N262 V263 V264L253-K260 HydrophobicContact CD1-CB 3.56Å; A257-K260 HydrophobicContact CB-CB 4.06Å; A257-K260 HydrophobicContact CB-CD 3.97Å; A257-K260 HydrophobicContact CB-CG 4.13Å; A257-K260 PolarHBondContact O-N 3.32Å; P258-K260 VanDerWaalsContact C-N 3.34Å; P258-K260 PolarHBondContact O-N 3.32Å; K260-N262 VanDerWaalsContact C-N 3.29Å; K260-N262 PolarHBondContact O-N 3Å; K260-V263 WeakPolarHBondContact O-CB 3.46Å; K260-V263 PolarHBondContact O-N 3.18Å; K260-V263 VanDerWaalsContact O-N 3.13Å; K260-V264 WeakPolarHBondContact O-CG2 3.37Å; K260-V264 PolarHBondContact O-N 3.44Å
261L88.3Confident88.9Confident20 Ų2067.3 Ų67.311%0.10536%0.356CS..Hα-helixtrans-57.1-43.3175.7-178.663.3000111.4L253 F254 A257 P258 V263 V264 K265 L358L253-L261 HydrophobicContact CD2-CD1 3.88Å; L253-L261 HydrophobicContact CG-CB 4.3Å; L253-L261 HydrophobicContact CG-CD1 4.29Å; F254-L261 HydrophobicContact CD1-CD2 4.13Å; F254-L261 HydrophobicContact CD2-CD1 4.01Å; F254-L261 HydrophobicContact CD2-CD2 4.39Å; F254-L261 HydrophobicContact CE1-CD2 3.92Å; F254-L261 HydrophobicContact CE2-CD1 3.52Å; F254-L261 HydrophobicContact CE2-CD2 4.2Å; F254-L261 HydrophobicContact CG-CD2 4.38Å; F254-L261 HydrophobicContact CZ-CD1 3.89Å; F254-L261 HydrophobicContact CZ-CD2 3.97Å; A257-L261 PolarHBondContact O-N 3.28Å; A257-L261 VanDerWaalsContact O-N 3.09Å; P258-L261 WeakPolarHBondContact O-CB 3.44Å; P258-L261 PolarHBondContact O-N 3.04Å; L261-V263 VanDerWaalsContact C-N 3.31Å; L261-V263 PolarHBondContact O-N 2.96Å; L261-V264 PolarHBondContact O-N 3.21Å; L261-K265 PolarHBondContact O-N 3.38Å; L261-L358 HydrophobicContact CD1-CD1 3.53Å
262N88.9Confident89.7Confident88 Ų8866.4 Ų66.447%0.47135%0.351SS..Hα-helixtrans-63.9-34.7177.5-72.5-35.2000113.1P258 D259 K260 K266P258-N262 PolarHBondContact O-N 3.31Å; D259-N262 PolarHBondContact O-N 3.44Å; K260-N262 VanDerWaalsContact C-N 3.29Å; K260-N262 PolarHBondContact O-N 3Å; N262-K266 WeakPolarHBondContact O-CG 3.26Å; N262-K266 PolarHBondContact O-N 3.01Å; N262-K266 VanDerWaalsContact O-N 3.09Å
263V92Very high90.3Very high91 Ų9163.4 Ų63.455%0.55233%0.332SS*.Hα-helixtrans-67.2-42.7174.6178.80000110.7K260 L261 K266 T267K260-V263 WeakPolarHBondContact O-CB 3.46Å; K260-V263 PolarHBondContact O-N 3.18Å; K260-V263 VanDerWaalsContact O-N 3.13Å; L261-V263 VanDerWaalsContact C-N 3.31Å; L261-V263 PolarHBondContact O-N 2.96Å; V263-K266 PolarHBondContact O-N 2.93Å; V263-T267 PolarHBondContact O-N 2.92Å; V263-T267 PolarHBondContact O-OG1 2.84Å
264V92.9Very high90.8Very high35 Ų3566.7 Ų66.721%0.21235%0.345CS..Hα-helixtrans-61.4-47.1175.4174.60000110.5F250 L253 K260 L261 K266 T267 L268F250-V264 HydrophobicContact CE1-CG1 4.34Å; L253-V264 HydrophobicContact CD2-CG2 4.09Å; K260-V264 WeakPolarHBondContact O-CG2 3.37Å; K260-V264 PolarHBondContact O-N 3.44Å; L261-V264 PolarHBondContact O-N 3.21Å; V264-K266 PolarHBondContact O-N 3.07Å; V264-T267 WeakPolarHBondContact O-CB 3.33Å; V264-T267 PolarHBondContact O-N 3.45Å; V264-L268 HydrophobicContact CG1-CD1 3.93Å; V264-L268 HydrophobicContact CG1-CG 4.34Å; V264-L268 WeakPolarHBondContact O-CG 3.45Å; V264-L268 PolarHBondContact O-N 3.3Å
265K94.6Very high91.4Very high37 Ų3764 Ų6416%0.16133%0.333CS..Hα-helixtrans-53.3-51.8174.9-74.1-167175.6-156.60111.7L261 T267 L268 I269 L286 D287 L354 L358L261-K265 PolarHBondContact O-N 3.38Å; K265-T267 VanDerWaalsContact C-N 3.3Å; K265-T267 PolarHBondContact O-N 3.07Å; K265-L268 PolarHBondContact O-N 3.37Å; K265-I269 VanDerWaalsContact O-CG1 3.31Å; K265-I269 WeakPolarHBondContact O-CG1 3.22Å; K265-I269 PolarHBondContact O-N 2.86Å; K265-L286 HydrophobicContact CB-CD1 4.36Å; K265-L286 HydrophobicContact CG-CD1 4.46Å; K265-D287 VanDerWaalsContact NZ-CG 3.31Å; K265-D287 IonicContact NZ-OD1 2.91Å; K265-D287 PolarHBondContact NZ-OD1 3.3Å; K265-D287 IonicContact NZ-OD2 3.96Å; K265-D287 PolarHBondContact NZ-OD2 3.1Å; K265-L354 VanDerWaalsContact NZ-CD2 3.26Å; K265-L358 HydrophobicContact CG-CD1 4.49Å; K265-L358 HydrophobicContact CG-CD2 4.15Å
266K95.1Very high92.2Very high150 Ų15060 Ų6065%0.65231%0.312SS*.Hα-helixtrans-59.5-39.9179.3-75.1-180179.8-1790112.8N262 V263 V264 T270N262-K266 WeakPolarHBondContact O-CG 3.26Å; N262-K266 PolarHBondContact O-N 3.01Å; N262-K266 VanDerWaalsContact O-N 3.09Å; V263-K266 PolarHBondContact O-N 2.93Å; V264-K266 PolarHBondContact O-N 3.07Å; K266-T270 WeakPolarHBondContact O-CB 3.23Å; K266-T270 PolarHBondContact O-N 3.15Å; K266-T270 PolarHBondContact O-OG1 3.39Å
267T95.8Very high92.9Very high59 Ų5956.7 Ų56.736%0.36230%0.299SS..Hα-helixtrans-64.1-46.9178.2-56.90000111V263 V264 K265 T270 F271 F365V263-T267 PolarHBondContact O-N 2.92Å; V263-T267 PolarHBondContact O-OG1 2.84Å; V264-T267 WeakPolarHBondContact O-CB 3.33Å; V264-T267 PolarHBondContact O-N 3.45Å; K265-T267 VanDerWaalsContact C-N 3.3Å; K265-T267 PolarHBondContact O-N 3.07Å; T267-T270 PolarHBondContact O-N 2.66Å; T267-F271 PolarHBondContact O-N 3.48Å; T267-F365 HydrophobicContact CG2-CE2 4Å; T267-F365 HydrophobicContact CG2-CZ 3.92Å
268L97.1Very high93.4Very high1 Ų161.1 Ų61.11%0.00532%0.315CS..Hα-helixtrans-67.1-40.5178.9-67177.1000112V264 K265 T270 F271 V272 L286 L358 L361 F365V264-L268 HydrophobicContact CG1-CD1 3.93Å; V264-L268 HydrophobicContact CG1-CG 4.34Å; V264-L268 WeakPolarHBondContact O-CG 3.45Å; V264-L268 PolarHBondContact O-N 3.3Å; K265-L268 PolarHBondContact O-N 3.37Å; L268-T270 VanDerWaalsContact C-N 3.31Å; L268-T270 PolarHBondContact O-N 3.41Å; L268-F271 WeakPolarHBondContact O-CB 3.38Å; L268-F271 PolarHBondContact O-N 3.43Å; L268-V272 WeakPolarHBondContact O-CG1 3.25Å; L268-V272 WeakPolarHBondContact O-CG2 3.4Å; L268-V272 PolarHBondContact O-N 3Å; L268-L286 HydrophobicContact CB-CD1 3.9Å; L268-L358 HydrophobicContact CD1-CB 4.44Å; L268-L358 HydrophobicContact CD1-CD2 3.63Å; L268-L361 HydrophobicContact CD1-CB 4.09Å; L268-L361 HydrophobicContact CD2-CB 4.31Å; L268-F365 HydrophobicContact CD2-CB 3.65Å; L268-F365 HydrophobicContact CD2-CG 4.04Å
269I97.2Very high94Very high36 Ų3661.2 Ų61.219%0.18531%0.31CS..Hα-helixtrans-56.4-47172.4-72.7167.7000110.6K265 F271 V272 N273 V283 L286K265-I269 VanDerWaalsContact O-CG1 3.31Å; K265-I269 WeakPolarHBondContact O-CG1 3.22Å; K265-I269 PolarHBondContact O-N 2.86Å; I269-F271 VanDerWaalsContact C-N 3.32Å; I269-F271 PolarHBondContact O-N 3.07Å; I269-V272 WeakPolarHBondContact O-CG2 3.19Å; I269-V272 PolarHBondContact O-N 3.28Å; I269-N273 VanDerWaalsContact O-CB 3.31Å; I269-N273 WeakPolarHBondContact O-CB 3.44Å; I269-N273 PolarHBondContact O-N 2.94Å; I269-V283 WeakPolarHBondContact CG2-O 3.49Å; I269-L286 HydrophobicContact CD1-CG 4.19Å; I269-L286 HydrophobicContact CG1-CD1 3.98Å; I269-L286 HydrophobicContact CG1-CD2 3.73Å; I269-L286 HydrophobicContact CG1-CG 3.67Å
270T96.8Very high94.5Very high101 Ų10162.4 Ų62.462%0.6232%0.317SS*.Hα-helixtrans-62.1-42.6179.6-55.70000111K266 T267 L268 K274K266-T270 WeakPolarHBondContact O-CB 3.23Å; K266-T270 PolarHBondContact O-N 3.15Å; K266-T270 PolarHBondContact O-OG1 3.39Å; T267-T270 PolarHBondContact O-N 2.66Å; L268-T270 VanDerWaalsContact C-N 3.31Å; L268-T270 PolarHBondContact O-N 3.41Å; T270-K274 PolarHBondContact O-N 2.94Å; T270-K274 VanDerWaalsContact O-N 3.08Å
271F97.3Very high94.9Very high12 Ų1257.6 Ų57.65%0.05330%0.298CS..Hα-helixtrans-62.3-53.3176.2166.2-108.1000112.3T267 L268 I269 N273 K274 H275 L303 L364 F365T267-F271 PolarHBondContact O-N 3.48Å; L268-F271 WeakPolarHBondContact O-CB 3.38Å; L268-F271 PolarHBondContact O-N 3.43Å; I269-F271 VanDerWaalsContact C-N 3.32Å; I269-F271 PolarHBondContact O-N 3.07Å; F271-N273 VanDerWaalsContact C-N 3.34Å; F271-N273 PolarHBondContact O-N 3.09Å; F271-K274 VanDerWaalsContact O-CB 3.28Å; F271-K274 WeakPolarHBondContact O-CB 3.3Å; F271-K274 PolarHBondContact O-N 3.11Å; F271-H275 AromaticContact CE2-CD2 3.84Å; F271-H275 AromaticContact CE2-NE2 3.56Å; F271-H275 PolarHBondContact O-CD2 3.39Å; F271-H275 VanDerWaalsContact O-CD2 3.27Å; F271-L303 HydrophobicContact CE2-CD2 4.25Å; F271-L303 HydrophobicContact CZ-CD1 4.19Å; F271-L303 HydrophobicContact CZ-CD2 3.91Å; F271-L364 HydrophobicContact CE1-CB 4.06Å; F271-L364 HydrophobicContact CZ-CB 4.39Å; F271-F365 HydrophobicContact CB-CD2 3.76Å; F271-F365 HydrophobicContact CB-CE2 4.36Å; F271-F365 HydrophobicContact CD1-CB 3.99Å; F271-F365 HydrophobicContact CD1-CD2 4.25Å; F271-F365 AromaticContact CD2-CD2 3.91Å; F271-F365 HydrophobicContact CD2-CD2 3.91Å; F271-F365 HydrophobicContact CE1-CB 4.15Å; F271-F365 HydrophobicContact CG-CB 4.29Å; F271-F365 AromaticContact CG-CD2 3.7Å; F271-F365 HydrophobicContact CG-CD2 3.7Å; F271-F365 HydrophobicContact CG-CG 4.5Å
272V97.6Very high95.2Very high0 Ų063.1 Ų63.10%032%0.323CS..Hα-helixtrans-64.4-39.9-177.3-59.60000111.5L268 I269 K274 H275 L276 V283 F290 L299 L361L268-V272 WeakPolarHBondContact O-CG1 3.25Å; L268-V272 WeakPolarHBondContact O-CG2 3.4Å; L268-V272 PolarHBondContact O-N 3Å; I269-V272 WeakPolarHBondContact O-CG2 3.19Å; I269-V272 PolarHBondContact O-N 3.28Å; V272-K274 VanDerWaalsContact C-N 3.31Å; V272-K274 PolarHBondContact O-N 3.36Å; V272-H275 PolarHBondContact O-N 3.24Å; V272-H275 VanDerWaalsContact O-N 3.11Å; V272-L276 HydrophobicContact CB-CD1 4.25Å; V272-L276 WeakPolarHBondContact O-CB 3.41Å; V272-L276 PolarHBondContact O-N 3.42Å; V272-V283 HydrophobicContact CG2-CB 3.91Å; V272-V283 HydrophobicContact CG2-CG1 4.19Å; V272-V283 HydrophobicContact CG2-CG2 3.93Å; V272-F290 HydrophobicContact CB-CZ 4.18Å; V272-F290 HydrophobicContact CG1-CZ 3.96Å; V272-F290 HydrophobicContact CG2-CZ 4.17Å; V272-L299 HydrophobicContact CB-CD2 4.42Å; V272-L299 HydrophobicContact CG1-CD2 3.83Å; V272-L361 HydrophobicContact CG1-CD1 4.49Å; V272-L361 HydrophobicContact CG1-CD2 3.99Å
273N97.4Very high95.6Very high17 Ų1759 Ų599%0.09130%0.301CS..Hα-helixtrans-68.2-28.9178.1-75.1-15.7000112.8I269 F271 H275 N277 V283I269-N273 VanDerWaalsContact O-CB 3.31Å; I269-N273 WeakPolarHBondContact O-CB 3.44Å; I269-N273 PolarHBondContact O-N 2.94Å; F271-N273 VanDerWaalsContact C-N 3.34Å; F271-N273 PolarHBondContact O-N 3.09Å; N273-H275 PolarHBondContact O-N 3.36Å; N273-N277 WeakPolarHBondContact O-CB 3.41Å; N273-N277 PolarHBondContact O-N 3.1Å; N273-N277 VanDerWaalsContact O-N 3.08Å; N273-N277 PolarHBondContact O-ND2 3.16Å; N273-V283 PolarHBondContact ND2-O 2.79Å; N273-V283 WeakPolarHBondContact OD1-CA 3.21Å; N273-V283 WeakPolarHBondContact OD1-CB 3.35Å; N273-V283 PolarHBondContact OD1-N 3.35Å
274K95.9Very high95.7Very high95 Ų9558.6 Ų58.641%0.41330%0.302SS..Hα-helixtrans-54.3-35.7171.5-172.8-168.7175-1680111.6T270 F271 V272 V371T270-K274 PolarHBondContact O-N 2.94Å; T270-K274 VanDerWaalsContact O-N 3.08Å; F271-K274 VanDerWaalsContact O-CB 3.28Å; F271-K274 WeakPolarHBondContact O-CB 3.3Å; F271-K274 PolarHBondContact O-N 3.11Å; V272-K274 VanDerWaalsContact C-N 3.31Å; V272-K274 PolarHBondContact O-N 3.36Å; K274-V371 PolarHBondContact NZ-O 3.24Å
275H95.9Very high95.7Very high1 Ų162.4 Ų62.41%0.00532%0.318CS..Hα-helixtrans-94.2-53.8-179.6-60.8-77000111.7F271 V272 N273 N277 K278 L299 L302F271-H275 AromaticContact CE2-CD2 3.84Å; F271-H275 AromaticContact CE2-NE2 3.56Å; F271-H275 PolarHBondContact O-CD2 3.39Å; F271-H275 VanDerWaalsContact O-CD2 3.27Å; V272-H275 PolarHBondContact O-N 3.24Å; V272-H275 VanDerWaalsContact O-N 3.11Å; N273-H275 PolarHBondContact O-N 3.36Å; H275-N277 VanDerWaalsContact C-N 3.28Å; H275-N277 PolarHBondContact O-N 3.2Å; H275-K278 WeakPolarHBondContact O-CB 3.31Å; H275-K278 VanDerWaalsContact O-CG 3.28Å; H275-K278 WeakPolarHBondContact O-CG 3.43Å; H275-K278 PolarHBondContact O-N 3.05Å; H275-L299 HydrophobicContact CB-CD1 3.71Å; H275-L302 HydrophobicContact CB-CB 4.31Å; H275-L302 HydrophobicContact CB-CD1 4.2Å; H275-L302 WeakPolarHBondContact O-CD1 3.4Å
276L96.5Very high95.7Very high0 Ų060.7 Ų60.70%031%0.311CS..Hα-helixtrans-63.8-28.3-174.1-70.8175.2000113.6V272 K278 L279 L281 V283 F290 Y295 L298 L299 L302V272-L276 HydrophobicContact CB-CD1 4.25Å; V272-L276 WeakPolarHBondContact O-CB 3.41Å; V272-L276 PolarHBondContact O-N 3.42Å; L276-K278 PolarHBondContact O-N 2.55Å; L276-K278 VanDerWaalsContact O-N 3.14Å; L276-L279 WeakPolarHBondContact O-CA 3.48Å; L276-L279 PolarHBondContact O-N 3.02Å; L276-L281 CarbonylContact C-O 3.57Å; L276-L281 HydrophobicContact CB-CB 4.13Å; L276-L281 WeakPolarHBondContact CB-O 3.37Å; L276-L281 HydrophobicContact CD2-CD1 4.45Å; L276-L281 PolarHBondContact O-N 3.38Å; L276-L281 VanDerWaalsContact O-N 3.16Å; L276-V283 HydrophobicContact CD1-CG2 3.63Å; L276-F290 HydrophobicContact CD1-CZ 4.48Å; L276-Y295 HydrophobicContact CD1-CD2 4.1Å; L276-Y295 HydrophobicContact CD1-CG 4.31Å; L276-L298 HydrophobicContact CD2-CB 4.3Å; L276-L299 HydrophobicContact CD2-CB 4.24Å; L276-L299 HydrophobicContact CG-CD1 4.42Å; L276-L302 HydrophobicContact CD2-CD1 4.12Å
277N96.1Very high95.2Very high77 Ų7756.2 Ų56.241%0.41229%0.294SS..G310 helixtrans-62.6-21.4174.2-74.1-15.5000112.6N273 H275 L279 N280 L281N273-N277 WeakPolarHBondContact O-CB 3.41Å; N273-N277 PolarHBondContact O-N 3.1Å; N273-N277 VanDerWaalsContact O-N 3.08Å; N273-N277 PolarHBondContact O-ND2 3.16Å; H275-N277 VanDerWaalsContact C-N 3.28Å; H275-N277 PolarHBondContact O-N 3.2Å; N277-L279 PolarHBondContact O-N 3.26Å; N277-N280 PolarHBondContact O-N 3.05Å; N277-L281 PolarHBondContact N-O 2.82Å; N277-L281 PolarHBondContact OD1-O 3.43Å
278K93.8Very high95Very high113 Ų11356.7 Ų56.749%0.49130%0.297SS..G310 helixtrans-62.6-21.1172.5-59.5178.4-175.4-178.30112.1H275 L276 E372H275-K278 WeakPolarHBondContact O-CB 3.31Å; H275-K278 VanDerWaalsContact O-CG 3.28Å; H275-K278 WeakPolarHBondContact O-CG 3.43Å; H275-K278 PolarHBondContact O-N 3.05Å; L276-K278 PolarHBondContact O-N 2.55Å; L276-K278 VanDerWaalsContact O-N 3.14Å; K278-E372 PolarHBondContact NZ-O 2.86Å; K278-E372 PolarHBondContact NZ-OXT 2.77Å
279L93.7Very high94.9Very high79 Ų7958.9 Ų58.941%0.41431%0.307SS..G310 helixtrans-105.611.3175.1-57.2179.2000112.6L276 N277 L281 L298 L302L276-L279 WeakPolarHBondContact O-CA 3.48Å; L276-L279 PolarHBondContact O-N 3.02Å; N277-L279 PolarHBondContact O-N 3.26Å; L279-L281 HydrophobicContact CB-CD1 4.23Å; L279-L281 HydrophobicContact CB-CG 4.22Å; L279-L281 PolarHBondContact O-N 3.22Å; L279-L298 HydrophobicContact CD1-CB 4.18Å; L279-L298 HydrophobicContact CD1-CD1 4.33Å; L279-L298 HydrophobicContact CD1-CD2 4.4Å; L279-L302 HydrophobicContact CD1-CD1 3.81Å; L279-L302 HydrophobicContact CD1-CD2 4.3Å; L279-L302 HydrophobicContact CD1-CG 4.21Å; L279-L302 HydrophobicContact CD2-CD2 4.41Å; L279-L302 HydrophobicContact CG-CD1 4.09Å; L279-L302 HydrophobicContact CG-CD2 4.21Å
280N94.8Very high95Very high157 Ų15757.2 Ų57.284%0.8430%0.298SS*.THydrogen-bonded Turntrans58.331.1-171.7-53.3-50.4000113.9N277N277-N280 PolarHBondContact O-N 3.05Å
281L95.7Very high94.9Very high41 Ų4152.9 Ų52.922%0.21527%0.273CS..  trans-105.9129.5174.5-62.5175.4000109.5L276 N277 L279 Y295 L298L276-L281 CarbonylContact C-O 3.57Å; L276-L281 HydrophobicContact CB-CB 4.13Å; L276-L281 WeakPolarHBondContact CB-O 3.37Å; L276-L281 HydrophobicContact CD2-CD1 4.45Å; L276-L281 PolarHBondContact O-N 3.38Å; L276-L281 VanDerWaalsContact O-N 3.16Å; N277-L281 PolarHBondContact N-O 2.82Å; N277-L281 PolarHBondContact OD1-O 3.43Å; L279-L281 HydrophobicContact CB-CD1 4.23Å; L279-L281 HydrophobicContact CB-CG 4.22Å; L279-L281 PolarHBondContact O-N 3.22Å; L281-Y295 HydrophobicContact CB-CE1 4.42Å; L281-Y295 HydrophobicContact CD1-CD1 4.21Å; L281-Y295 HydrophobicContact CD1-CE1 3.9Å; L281-Y295 HydrophobicContact CD2-CE1 4.05Å; L281-Y295 HydrophobicContact CG-CE1 4.35Å; L281-L298 HydrophobicContact CD1-CD1 3.55Å
282E95.3Very high94.8Very high136 Ų13654.7 Ų54.764%0.63628%0.283SS*.  trans-119.3136.3179.5-173174.3-166.500111Q289E282-Q289 PolarHBondContact O-NE2 2.77Å
283V96.6Very high94.8Very high1 Ų154.7 Ų54.71%0.00628%0.283CS..  trans-108.2121.8175-177.40000109.1I269 V272 N273 L276 L286 F290 Y295I269-V283 WeakPolarHBondContact CG2-O 3.49Å; V272-V283 HydrophobicContact CG2-CB 3.91Å; V272-V283 HydrophobicContact CG2-CG1 4.19Å; V272-V283 HydrophobicContact CG2-CG2 3.93Å; N273-V283 PolarHBondContact ND2-O 2.79Å; N273-V283 WeakPolarHBondContact OD1-CA 3.21Å; N273-V283 WeakPolarHBondContact OD1-CB 3.35Å; N273-V283 PolarHBondContact OD1-N 3.35Å; L276-V283 HydrophobicContact CD1-CG2 3.63Å; V283-L286 HydrophobicContact CG1-CD2 3.74Å; V283-F290 HydrophobicContact CG1-CE2 3.87Å; V283-F290 HydrophobicContact CG1-CZ 4.48Å; V283-F290 HydrophobicContact CG2-CE2 4.27Å; V283-F290 HydrophobicContact CG2-CZ 4.13Å; V283-Y295 HydrophobicContact CG2-CD2 3.67Å; V283-Y295 HydrophobicContact CG2-CE2 3.75Å
284S94.5Very high94.8Very high83 Ų8354.2 Ų54.258%0.5828%0.28SS*.SBendtrans-109.2-29.5171.753.60000112.2Q289S284-Q289 PolarHBondContact OG-OE1 3Å
285E92.4Very high94.9Very high114 Ų11451.6 Ų51.653%0.53327%0.268SS..  trans-132.1110-173-65.6-171.3168.500111.6D287 Q289E285-D287 PolarHBondContact O-N 3.37Å; E285-Q289 WeakPolarHBondContact O-CB 3.43Å; E285-Q289 WeakPolarHBondContact O-CG 3.44Å; E285-Q289 PolarHBondContact O-N 2.82Å; E285-Q289 PolarHBondContact O-OE1 3.01Å
286L93.7Very high95Very high2 Ų251.7 Ų51.71%0.0127%0.269CS..THydrogen-bonded Turntrans-72.3-17.6177.4-58.4-176.8000113K265 L268 I269 V283 T288 F290 L354 T357 L358 L361K265-L286 HydrophobicContact CB-CD1 4.36Å; K265-L286 HydrophobicContact CG-CD1 4.46Å; L268-L286 HydrophobicContact CB-CD1 3.9Å; I269-L286 HydrophobicContact CD1-CG 4.19Å; I269-L286 HydrophobicContact CG1-CD1 3.98Å; I269-L286 HydrophobicContact CG1-CD2 3.73Å; I269-L286 HydrophobicContact CG1-CG 3.67Å; V283-L286 HydrophobicContact CG1-CD2 3.74Å; L286-T288 VanDerWaalsContact C-N 3.29Å; L286-T288 PolarHBondContact O-N 2.86Å; L286-F290 HydrophobicContact CD2-CD2 4.23Å; L286-F290 HydrophobicContact CD2-CE2 3.6Å; L286-L354 HydrophobicContact CB-CD1 4.27Å; L286-T357 WeakPolarHBondContact O-CG2 3.46Å; L286-L358 HydrophobicContact CD1-CD2 3.55Å; L286-L361 HydrophobicContact CD1-CD1 4.29Å; L286-L361 HydrophobicContact CD2-CD1 3.77Å; L286-L361 HydrophobicContact CG-CD1 4.49Å
287D85.4Confident95.1Very high56 Ų5651.7 Ų51.730%0.29927%0.269SS..THydrogen-bonded Turntrans-70-26.5-174.9-59-107.8000112K265 E285 C352 L354K265-D287 VanDerWaalsContact NZ-CG 3.31Å; K265-D287 IonicContact NZ-OD1 2.91Å; K265-D287 PolarHBondContact NZ-OD1 3.3Å; K265-D287 IonicContact NZ-OD2 3.96Å; K265-D287 PolarHBondContact NZ-OD2 3.1Å; E285-D287 PolarHBondContact O-N 3.37Å; D287-C352 VanDerWaalsContact O-CB 3.25Å; D287-C352 WeakPolarHBondContact O-CB 3.49Å; D287-L354 WeakPolarHBondContact OD1-CD2 3.49Å
288T91.3Very high95.1Very high69 Ų6949.6 Ų49.642%0.42326%0.257SS..THydrogen-bonded Turntrans-132.9-34.1-171.857.70000114.4L286 F290 A291L286-T288 VanDerWaalsContact C-N 3.29Å; L286-T288 PolarHBondContact O-N 2.86Å; T288-F290 PolarHBondContact O-N 3.42Å; T288-F290 VanDerWaalsContact O-N 3.1Å; T288-A291 VanDerWaalsContact O-CB 3.22Å; T288-A291 WeakPolarHBondContact O-CB 3.25Å; T288-A291 PolarHBondContact O-N 3.41Å
289Q95.9Very high95.3Very high47 Ų4744.2 Ų44.222%0.2223%0.234CC..THydrogen-bonded Turntrans-72.3-8.6-167.9-65.6-174.5-83.400115.1E282 S284 E285 Y295E282-Q289 PolarHBondContact O-NE2 2.77Å; S284-Q289 PolarHBondContact OG-OE1 3Å; E285-Q289 WeakPolarHBondContact O-CB 3.43Å; E285-Q289 WeakPolarHBondContact O-CG 3.44Å; E285-Q289 PolarHBondContact O-N 2.82Å; E285-Q289 PolarHBondContact O-OE1 3.01Å; Q289-Y295 HydrophobicContact CB-CD2 4.37Å; Q289-Y295 HydrophobicContact CB-CE2 4.29Å
290F97.5Very high95.5Very high1 Ų140.4 Ų40.40%0.00421%0.214CC..THydrogen-bonded Turntrans-101-5173.7-72.1-82.3000113.3V272 L276 V283 L286 T288 D292 G293 L296 T357 L361V272-F290 HydrophobicContact CB-CZ 4.18Å; V272-F290 HydrophobicContact CG1-CZ 3.96Å; V272-F290 HydrophobicContact CG2-CZ 4.17Å; L276-F290 HydrophobicContact CD1-CZ 4.48Å; V283-F290 HydrophobicContact CG1-CE2 3.87Å; V283-F290 HydrophobicContact CG1-CZ 4.48Å; V283-F290 HydrophobicContact CG2-CE2 4.27Å; V283-F290 HydrophobicContact CG2-CZ 4.13Å; L286-F290 HydrophobicContact CD2-CD2 4.23Å; L286-F290 HydrophobicContact CD2-CE2 3.6Å; T288-F290 PolarHBondContact O-N 3.42Å; T288-F290 VanDerWaalsContact O-N 3.1Å; F290-D292 PolarHBondContact O-N 2.99Å; F290-G293 PolarHBondContact O-N 3.29Å; F290-L296 HydrophobicContact CB-CG 4.48Å; F290-L296 HydrophobicContact CD1-CD2 3.54Å; F290-L296 HydrophobicContact CD1-CG 3.72Å; F290-L296 HydrophobicContact CE1-CD2 3.96Å; F290-L296 HydrophobicContact CE1-CG 4.48Å; F290-L296 HydrophobicContact CG-CD2 4.38Å; F290-T357 HydrophobicContact CB-CG2 4.07Å; F290-T357 HydrophobicContact CD2-CG2 4.19Å; F290-T357 HydrophobicContact CG-CG2 4.34Å; F290-L361 HydrophobicContact CD1-CD2 4.4Å; F290-L361 HydrophobicContact CD2-CD1 4.05Å; F290-L361 HydrophobicContact CE1-CD2 3.93Å; F290-L361 HydrophobicContact CE2-CD1 3.72Å; F290-L361 HydrophobicContact CE2-CD2 4.38Å; F290-L361 HydrophobicContact CZ-CD1 4.08Å; F290-L361 HydrophobicContact CZ-CD2 3.93Å
291A95.4Very high95.5Very high10 Ų1033.2 Ų33.28%0.08318%0.177CC..THydrogen-bonded Turntrans-67.1-19.5-17200000113.8T288 I349 V350T288-A291 VanDerWaalsContact O-CB 3.22Å; T288-A291 WeakPolarHBondContact O-CB 3.25Å; T288-A291 PolarHBondContact O-N 3.41Å; A291-I349 WeakPolarHBondContact CA-O 3.28Å; A291-V350 WeakPolarHBondContact O-CA 3.2Å
292D95.4Very high95.5Very high49 Ų4933.2 Ų33.226%0.26218%0.177SC..THydrogen-bonded Turntrans-89.5-4.7176.270.17.8000113.8F290 V294 P317 K323 N326F290-D292 PolarHBondContact O-N 2.99Å; D292-V294 PolarHBondContact O-N 3.16Å; D292-V294 VanDerWaalsContact O-N 3.12Å; D292-V294 WeakPolarHBondContact OD1-CB 3.08Å; D292-V294 PolarHBondContact OD1-N 3.05Å; D292-P317 HydrophobicContact CB-CG 3.72Å; D292-K323 HydrophobicContact CB-CG 4.33Å; D292-N326 WeakPolarHBondContact O-CB 3.34Å; D292-N326 PolarHBondContact O-ND2 3.31Å
293G97.3Very high95.5Very high0 Ų027.1 Ų27.10%015%0.149CC..SBendtrans71.1-9.4-178.900000115.6F290 Y295 L296 V297F290-G293 PolarHBondContact O-N 3.29Å; G293-Y295 PolarHBondContact O-N 3.47Å; G293-L296 PolarHBondContact O-N 3.04Å; G293-V297 WeakPolarHBondContact O-CG2 3.45Å; G293-V297 PolarHBondContact O-N 3.07Å; G293-V297 VanDerWaalsContact O-N 3.09Å
294V97.9Very high95.4Very high7 Ų730.7 Ų30.74%0.04217%0.165CC..Hα-helixtrans-63.8-47.6-175.3175.60000110.2D292 L296 V297 L298 F313 F314 L315 P317D292-V294 PolarHBondContact O-N 3.16Å; D292-V294 VanDerWaalsContact O-N 3.12Å; D292-V294 WeakPolarHBondContact OD1-CB 3.08Å; D292-V294 PolarHBondContact OD1-N 3.05Å; V294-L296 VanDerWaalsContact C-N 3.29Å; V294-L296 PolarHBondContact O-N 2.9Å; V294-V297 PolarHBondContact O-N 3.44Å; V294-L298 HydrophobicContact CG1-CD1 3.91Å; V294-L298 HydrophobicContact CG1-CG 4.37Å; V294-L298 WeakPolarHBondContact O-CG 3.5Å; V294-L298 PolarHBondContact O-N 3.32Å; V294-F313 HydrophobicContact CG1-CE2 4.32Å; V294-F314 WeakPolarHBondContact CG2-O 3.42Å; V294-L315 HydrophobicContact CG1-CD1 4.04Å; V294-P317 HydrophobicContact CG2-CG 4.26Å
295Y98.1Very high95.4Very high41 Ų4130.1 Ų30.116%0.16117%0.172CC..Hα-helixtrans-64.8-32.6179.5-77.615.3000112.3L276 L281 V283 Q289 G293 L299L276-Y295 HydrophobicContact CD1-CD2 4.1Å; L276-Y295 HydrophobicContact CD1-CG 4.31Å; L281-Y295 HydrophobicContact CB-CE1 4.42Å; L281-Y295 HydrophobicContact CD1-CD1 4.21Å; L281-Y295 HydrophobicContact CD1-CE1 3.9Å; L281-Y295 HydrophobicContact CD2-CE1 4.05Å; L281-Y295 HydrophobicContact CG-CE1 4.35Å; V283-Y295 HydrophobicContact CG2-CD2 3.67Å; V283-Y295 HydrophobicContact CG2-CE2 3.75Å; Q289-Y295 HydrophobicContact CB-CD2 4.37Å; Q289-Y295 HydrophobicContact CB-CE2 4.29Å; G293-Y295 PolarHBondContact O-N 3.47Å; Y295-L299 WeakPolarHBondContact O-CB 3.38Å; Y295-L299 PolarHBondContact O-N 3.2Å
296L97.9Very high95.4Very high2 Ų228.8 Ų28.81%0.0116%0.163CC..Hα-helixtrans-66.9-45.3175.3-71179.3000111.6F290 G293 V294 L299 M300 V327 F331 M334 I349 V360 L361F290-L296 HydrophobicContact CB-CG 4.48Å; F290-L296 HydrophobicContact CD1-CD2 3.54Å; F290-L296 HydrophobicContact CD1-CG 3.72Å; F290-L296 HydrophobicContact CE1-CD2 3.96Å; F290-L296 HydrophobicContact CE1-CG 4.48Å; F290-L296 HydrophobicContact CG-CD2 4.38Å; G293-L296 PolarHBondContact O-N 3.04Å; V294-L296 VanDerWaalsContact C-N 3.29Å; V294-L296 PolarHBondContact O-N 2.9Å; L296-L299 PolarHBondContact O-N 2.91Å; L296-M300 PolarHBondContact O-N 3.14Å; L296-V327 HydrophobicContact CD1-CG1 4.23Å; L296-F331 HydrophobicContact CD1-CE1 4.49Å; L296-M334 HydrophobicContact CD2-CE 4.44Å; L296-I349 HydrophobicContact CD1-CG2 4.22Å; L296-V360 HydrophobicContact CD2-CG1 4.25Å; L296-L361 HydrophobicContact CD2-CD2 3.94Å
297V98Very high95.4Very high0 Ų036 Ų360%020%0.195CC..Hα-helixtrans-62.8-47.6178.8174.30000110.9G293 V294 M300 G301 V308 F313 N326 F329 L333G293-V297 WeakPolarHBondContact O-CG2 3.45Å; G293-V297 PolarHBondContact O-N 3.07Å; G293-V297 VanDerWaalsContact O-N 3.09Å; V294-V297 PolarHBondContact O-N 3.44Å; V297-M300 PolarHBondContact O-N 3.32Å; V297-G301 PolarHBondContact O-N 2.97Å; V297-G301 VanDerWaalsContact O-N 3.14Å; V297-V308 HydrophobicContact CG1-CB 4.12Å; V297-V308 HydrophobicContact CG1-CG1 3.67Å; V297-V308 HydrophobicContact CG1-CG2 4.1Å; V297-F313 HydrophobicContact CB-CD2 4.36Å; V297-F313 HydrophobicContact CB-CG 4.47Å; V297-F313 HydrophobicContact CG1-CD1 3.73Å; V297-F313 HydrophobicContact CG1-CD2 4.12Å; V297-F313 HydrophobicContact CG1-CE1 3.86Å; V297-F313 HydrophobicContact CG1-CE2 4.24Å; V297-F313 HydrophobicContact CG1-CG 3.86Å; V297-F313 HydrophobicContact CG1-CZ 4.11Å; V297-F313 HydrophobicContact CG2-CB 4.49Å; V297-F313 HydrophobicContact CG2-CG 4.48Å; V297-N326 WeakPolarHBondContact CG2-O 3.47Å; V297-F329 HydrophobicContact CG1-CD1 4.21Å; V297-F329 HydrophobicContact CG1-CE1 4.1Å; V297-F329 HydrophobicContact CG2-CD1 3.99Å; V297-L333 HydrophobicContact CG1-CD1 4.18Å
298L97.4Very high95.9Very high33 Ų3333.8 Ų33.817%0.17318%0.183CC..Hα-helixtrans-65.1-41.4178.7-66.2178.6000111.9L276 L279 L281 V294 M300 G301 L302 F313L276-L298 HydrophobicContact CD2-CB 4.3Å; L279-L298 HydrophobicContact CD1-CB 4.18Å; L279-L298 HydrophobicContact CD1-CD1 4.33Å; L279-L298 HydrophobicContact CD1-CD2 4.4Å; L281-L298 HydrophobicContact CD1-CD1 3.55Å; V294-L298 HydrophobicContact CG1-CD1 3.91Å; V294-L298 HydrophobicContact CG1-CG 4.37Å; V294-L298 WeakPolarHBondContact O-CG 3.5Å; V294-L298 PolarHBondContact O-N 3.32Å; L298-M300 VanDerWaalsContact C-N 3.34Å; L298-M300 PolarHBondContact O-N 3.34Å; L298-G301 PolarHBondContact O-N 3.07Å; L298-L302 WeakPolarHBondContact O-CG 3.33Å; L298-L302 PolarHBondContact O-N 2.99Å; L298-F313 HydrophobicContact CD2-CZ 4.08Å
299L97.3Very high96Very high0 Ų032.2 Ų32.20%017%0.174CC..Hα-helixtrans-59.7-44.7175.6-179.962.1000110.9V272 H275 L276 Y295 L296 G301 L302 L303 L361 L364V272-L299 HydrophobicContact CB-CD2 4.42Å; V272-L299 HydrophobicContact CG1-CD2 3.83Å; H275-L299 HydrophobicContact CB-CD1 3.71Å; L276-L299 HydrophobicContact CD2-CB 4.24Å; L276-L299 HydrophobicContact CG-CD1 4.42Å; Y295-L299 WeakPolarHBondContact O-CB 3.38Å; Y295-L299 PolarHBondContact O-N 3.2Å; L296-L299 PolarHBondContact O-N 2.91Å; L299-G301 PolarHBondContact O-N 3.14Å; L299-L302 PolarHBondContact O-N 2.83Å; L299-L303 HydrophobicContact CD1-CD1 4.1Å; L299-L303 HydrophobicContact CD1-CD2 4.42Å; L299-L303 HydrophobicContact CD1-CG 4.06Å; L299-L303 HydrophobicContact CD2-CD1 4.5Å; L299-L303 HydrophobicContact CG-CD1 3.84Å; L299-L303 HydrophobicContact CG-CG 4.24Å; L299-L303 WeakPolarHBondContact O-CB 3.41Å; L299-L303 VanDerWaalsContact O-CG 3.23Å; L299-L303 WeakPolarHBondContact O-CG 3.47Å; L299-L303 PolarHBondContact O-N 3.44Å; L299-L361 HydrophobicContact CD2-CD2 4.24Å; L299-L364 HydrophobicContact CD2-CD1 3.81Å
300M96.8Very high95.7Very high0 Ų034.5 Ų34.50%019%0.187CC..Hα-helixtrans-59.6-45.3176.6-80.2-53.3-54.200112.8L296 V297 L298 L302 L303 E304 L333 M334 L364L296-M300 PolarHBondContact O-N 3.14Å; V297-M300 PolarHBondContact O-N 3.32Å; L298-M300 VanDerWaalsContact C-N 3.34Å; L298-M300 PolarHBondContact O-N 3.34Å; M300-L302 VanDerWaalsContact C-N 3.3Å; M300-L302 PolarHBondContact O-N 2.98Å; M300-L303 PolarHBondContact O-N 3.32Å; M300-L303 HydrophobicContact SD-CD1 4.47Å; M300-E304 HydrophobicContact CE-CG 4.04Å; M300-E304 PolarHBondContact O-N 2.99Å; M300-L333 HydrophobicContact CB-CB 4.17Å; M300-L333 HydrophobicContact CB-CD1 4.19Å; M300-L333 HydrophobicContact CG-CB 4.26Å; M300-M334 HydrophobicContact CE-CG 4.09Å; M300-M334 HydrophobicContact CG-CE 4.13Å; M300-M334 HydrophobicContact CG-CG 3.98Å; M300-M334 HydrophobicContact SD-CB 4.47Å; M300-M334 HydrophobicContact SD-CE 4.28Å; M300-M334 HydrophobicContact SD-CG 3.46Å; M300-M334 WeakPolarHBondContact SD-CG 3.23Å; M300-L364 HydrophobicContact SD-CD2 3.41Å; M300-L364 WeakPolarHBondContact SD-CD2 3.22Å
301G95.5Very high95.5Very high5 Ų543.8 Ų43.85%0.05222%0.223CC..Hα-helixtrans-58.6-41.2175.300000112.7V297 L298 L299 G305 Y306V297-G301 PolarHBondContact O-N 2.97Å; V297-G301 VanDerWaalsContact O-N 3.14Å; L298-G301 PolarHBondContact O-N 3.07Å; L299-G301 PolarHBondContact O-N 3.14Å; G301-G305 WeakPolarHBondContact O-CA 3.46Å; G301-G305 PolarHBondContact O-N 3.16Å; G301-Y306 CarbonylContact C-O 3.55Å; G301-Y306 VanDerWaalsContact C-O 3.27Å; G301-Y306 VanDerWaalsContact CA-O 3.23Å; G301-Y306 WeakPolarHBondContact CA-O 3.42Å; G301-Y306 PolarHBondContact O-N 3.24Å
302L95.4Very high95.4Very high41 Ų4145.9 Ų45.922%0.21523%0.233CC..Hα-helixtrans-68.4-36.2177.1-69.2168.9000113.5H275 L276 L279 L298 L299 M300H275-L302 HydrophobicContact CB-CB 4.31Å; H275-L302 HydrophobicContact CB-CD1 4.2Å; H275-L302 WeakPolarHBondContact O-CD1 3.4Å; L276-L302 HydrophobicContact CD2-CD1 4.12Å; L279-L302 HydrophobicContact CD1-CD1 3.81Å; L279-L302 HydrophobicContact CD1-CD2 4.3Å; L279-L302 HydrophobicContact CD1-CG 4.21Å; L279-L302 HydrophobicContact CD2-CD2 4.41Å; L279-L302 HydrophobicContact CG-CD1 4.09Å; L279-L302 HydrophobicContact CG-CD2 4.21Å; L298-L302 WeakPolarHBondContact O-CG 3.33Å; L298-L302 PolarHBondContact O-N 2.99Å; L299-L302 PolarHBondContact O-N 2.83Å; M300-L302 VanDerWaalsContact C-N 3.3Å; M300-L302 PolarHBondContact O-N 2.98Å
303L95.8Very high95.5Very high9 Ų944 Ų445%0.04722%0.222CC..Hα-helixtrans-72.6-38.2-179.5-70.4175.7000112.2F271 L299 M300 L364 Y368F271-L303 HydrophobicContact CE2-CD2 4.25Å; F271-L303 HydrophobicContact CZ-CD1 4.19Å; F271-L303 HydrophobicContact CZ-CD2 3.91Å; L299-L303 HydrophobicContact CD1-CD1 4.1Å; L299-L303 HydrophobicContact CD1-CD2 4.42Å; L299-L303 HydrophobicContact CD1-CG 4.06Å; L299-L303 HydrophobicContact CD2-CD1 4.5Å; L299-L303 HydrophobicContact CG-CD1 3.84Å; L299-L303 HydrophobicContact CG-CG 4.24Å; L299-L303 WeakPolarHBondContact O-CB 3.41Å; L299-L303 VanDerWaalsContact O-CG 3.23Å; L299-L303 WeakPolarHBondContact O-CG 3.47Å; L299-L303 PolarHBondContact O-N 3.44Å; M300-L303 PolarHBondContact O-N 3.32Å; M300-L303 HydrophobicContact SD-CD1 4.47Å; L303-L364 HydrophobicContact CD1-CB 4.31Å; L303-L364 HydrophobicContact CD1-CD1 4.45Å; L303-L364 HydrophobicContact CD1-CD2 4.24Å; L303-Y368 HydrophobicContact CB-CD1 4.01Å; L303-Y368 HydrophobicContact CB-CD2 4.33Å; L303-Y368 HydrophobicContact CB-CE1 4.13Å; L303-Y368 HydrophobicContact CB-CE2 4.44Å; L303-Y368 HydrophobicContact CB-CG 4.12Å; L303-Y368 HydrophobicContact CD1-CD2 3.74Å; L303-Y368 HydrophobicContact CD1-CE2 4.16Å; L303-Y368 HydrophobicContact CD1-CG 4.1Å; L303-Y368 HydrophobicContact CD2-CD1 4.46Å; L303-Y368 HydrophobicContact CD2-CD2 4.48Å; L303-Y368 HydrophobicContact CD2-CG 4.01Å; L303-Y368 HydrophobicContact CG-CD2 4.4Å; L303-Y368 HydrophobicContact CG-CG 4.3Å
304E94.6Very high95.5Very high76 Ų7648 Ų4836%0.35524%0.24SC..Hα-helixtrans-87.8-10.5177.7-72.6-68.7141.700113.4M300 Y306 Y368M300-E304 HydrophobicContact CE-CG 4.04Å; M300-E304 PolarHBondContact O-N 2.99Å; E304-Y306 HydrophobicContact CB-CD1 3.34Å; E304-Y306 HydrophobicContact CB-CE1 3.08Å; E304-Y306 HydrophobicContact CB-CG 4.3Å; E304-Y306 HydrophobicContact CG-CD1 4.3Å; E304-Y306 HydrophobicContact CG-CE1 3.56Å; E304-Y368 WeakPolarHBondContact OE1-CE1 3.49Å; E304-Y368 VanDerWaalsContact OE1-CZ 3.32Å; E304-Y368 PolarHBondContact OE1-OH 3.07Å
305G93.7Very high95.4Very high70 Ų7052 Ų5272%0.72226%0.261SS*.THydrogen-bonded Turntrans74.125.6178.600000114.2G301G301-G305 WeakPolarHBondContact O-CA 3.46Å; G301-G305 PolarHBondContact O-N 3.16Å
306Y93.9Very high95.3Very high86 Ų8655.3 Ų55.334%0.33729%0.285SS..  trans-119.3158.4174.762.1-114000112.6G301 E304 V308G301-Y306 CarbonylContact C-O 3.55Å; G301-Y306 VanDerWaalsContact C-O 3.27Å; G301-Y306 VanDerWaalsContact CA-O 3.23Å; G301-Y306 WeakPolarHBondContact CA-O 3.42Å; G301-Y306 PolarHBondContact O-N 3.24Å; E304-Y306 HydrophobicContact CB-CD1 3.34Å; E304-Y306 HydrophobicContact CB-CE1 3.08Å; E304-Y306 HydrophobicContact CB-CG 4.3Å; E304-Y306 HydrophobicContact CG-CD1 4.3Å; E304-Y306 HydrophobicContact CG-CE1 3.56Å; Y306-V308 HydrophobicContact CD2-CG2 4.05Å; Y306-V308 HydrophobicContact CE2-CG2 3.61Å
307F93.6Very high95.1Very high155 Ų15556.2 Ų56.268%0.6829%0.291SS*.PPolyproline II helixtrans-86.4130.5170.6177-102.9000110.4P309 L310F307-P309 WeakPolarHBondContact O-CD 3.28Å; F307-L310 HydrophobicContact CZ-CG 4.18Å
308V94.9Very high94.8Very high9 Ų964.3 Ų64.36%0.05533%0.329CS..PPolyproline II helixtrans-89119.5171.2-178.60000109.1V297 Y306 L310 F313 F329 L333V297-V308 HydrophobicContact CG1-CB 4.12Å; V297-V308 HydrophobicContact CG1-CG1 3.67Å; V297-V308 HydrophobicContact CG1-CG2 4.1Å; Y306-V308 HydrophobicContact CD2-CG2 4.05Å; Y306-V308 HydrophobicContact CE2-CG2 3.61Å; V308-L310 PolarHBondContact O-N 3.17Å; V308-F313 HydrophobicContact CB-CE1 4.26Å; V308-F313 HydrophobicContact CG1-CD1 3.78Å; V308-F313 HydrophobicContact CG1-CE1 3.77Å; V308-F329 HydrophobicContact CG1-CE1 3.59Å; V308-F329 HydrophobicContact CG1-CZ 4.06Å; V308-L333 HydrophobicContact CG2-CD1 3.94Å
309P93.3Very high94.2Very high36 Ų3666 Ų6623%0.23434%0.338CS..PPolyproline II helixtrans-60131.4178.1-22.432.7000113F307 Y311 N312F307-P309 WeakPolarHBondContact O-CD 3.28Å; P309-Y311 HydrophobicContact CB-CD1 3.64Å; P309-Y311 HydrophobicContact CB-CE1 3.23Å; P309-Y311 HydrophobicContact CB-CE2 4.33Å; P309-Y311 HydrophobicContact CB-CG 4.34Å; P309-Y311 HydrophobicContact CG-CE1 4.07Å; P309-Y311 PolarHBondContact O-N 3.41Å; P309-N312 WeakPolarHBondContact O-CB 3.42Å; P309-N312 PolarHBondContact O-N 2.95Å
310L91Very high93.6Very high94 Ų9469.8 Ų69.849%0.49236%0.355SS..THydrogen-bonded Turntrans-64.9-12.3-177.3-59.5-179.7000114.2F307 V308 N312 F313F307-L310 HydrophobicContact CZ-CG 4.18Å; V308-L310 PolarHBondContact O-N 3.17Å; L310-N312 VanDerWaalsContact C-N 3.33Å; L310-F313 HydrophobicContact CD2-CE1 3.91Å; L310-F313 HydrophobicContact CD2-CZ 3.74Å
311Y92Very high93Very high196 Ų19675.6 Ų75.677%0.76939%0.386SS*.THydrogen-bonded Turntrans-83.2-9.9174.864.9-101000113P309P309-Y311 HydrophobicContact CB-CD1 3.64Å; P309-Y311 HydrophobicContact CB-CE1 3.23Å; P309-Y311 HydrophobicContact CB-CE2 4.33Å; P309-Y311 HydrophobicContact CB-CG 4.34Å; P309-Y311 HydrophobicContact CG-CE1 4.07Å; P309-Y311 PolarHBondContact O-N 3.41Å
312N94.3Very high93Very high55 Ų5577.2 Ų77.229%0.29439%0.392SS..SBendtrans-87.8-16.6179.6-72.8-20.1000113.4P309 L310 H325 F329P309-N312 WeakPolarHBondContact O-CB 3.42Å; P309-N312 PolarHBondContact O-N 2.95Å; L310-N312 VanDerWaalsContact C-N 3.33Å; N312-H325 PolarHBondContact O-NE2 3.44Å; N312-F329 HydrophobicContact CB-CE1 3.81Å; N312-F329 HydrophobicContact CB-CE2 4.25Å; N312-F329 HydrophobicContact CB-CZ 3.61Å
313F97.7Very high93Very high8 Ų878.6 Ų78.64%0.03540%0.397CS..SBendtrans-147.6160.1-177.775.8-80.6000110.5V294 V297 L298 V308 L310 L315 N326 F329V294-F313 HydrophobicContact CG1-CE2 4.32Å; V297-F313 HydrophobicContact CB-CD2 4.36Å; V297-F313 HydrophobicContact CB-CG 4.47Å; V297-F313 HydrophobicContact CG1-CD1 3.73Å; V297-F313 HydrophobicContact CG1-CD2 4.12Å; V297-F313 HydrophobicContact CG1-CE1 3.86Å; V297-F313 HydrophobicContact CG1-CE2 4.24Å; V297-F313 HydrophobicContact CG1-CG 3.86Å; V297-F313 HydrophobicContact CG1-CZ 4.11Å; V297-F313 HydrophobicContact CG2-CB 4.49Å; V297-F313 HydrophobicContact CG2-CG 4.48Å; L298-F313 HydrophobicContact CD2-CZ 4.08Å; V308-F313 HydrophobicContact CB-CE1 4.26Å; V308-F313 HydrophobicContact CG1-CD1 3.78Å; V308-F313 HydrophobicContact CG1-CE1 3.77Å; L310-F313 HydrophobicContact CD2-CE1 3.91Å; L310-F313 HydrophobicContact CD2-CZ 3.74Å; F313-L315 HydrophobicContact CE2-CD1 4.06Å; F313-L315 HydrophobicContact CZ-CD1 4.33Å; F313-N326 WeakPolarHBondContact CB-OD1 3.39Å; F313-F329 HydrophobicContact CB-CD1 3.98Å; F313-F329 HydrophobicContact CB-CE1 4.35Å; F313-F329 HydrophobicContact CD1-CE1 4.48Å
314F97.3Very high92.7Very high86 Ų8679.5 Ų79.538%0.37740%0.402SS..  trans-88.3114.5-179.8-60.6-83.8000109.8V294 T316 P317 Q322 H325 N326V294-F314 WeakPolarHBondContact CG2-O 3.42Å; F314-T316 VanDerWaalsContact C-N 3.27Å; F314-T316 PolarHBondContact O-N 2.81Å; F314-P317 HydrophobicContact CB-CB 4.06Å; F314-Q322 HydrophobicContact CB-CB 4.36Å; F314-Q322 HydrophobicContact CD1-CG 3.97Å; F314-Q322 HydrophobicContact CD2-CB 3.68Å; F314-Q322 HydrophobicContact CD2-CG 3.71Å; F314-Q322 HydrophobicContact CE1-CG 3.97Å; F314-Q322 HydrophobicContact CE2-CB 4.1Å; F314-Q322 HydrophobicContact CE2-CG 3.72Å; F314-Q322 HydrophobicContact CG-CB 3.93Å; F314-Q322 HydrophobicContact CG-CG 3.85Å; F314-Q322 HydrophobicContact CZ-CG 3.85Å; F314-H325 AromaticContact CD2-CD2 3.86Å; F314-H325 HydrophobicContact CE2-CB 4.32Å; F314-H325 AromaticContact CE2-CD2 3.71Å; F314-N326 PolarHBondContact N-OD1 3.3Å; F314-N326 PolarHBondContact O-ND2 3.44Å
315L95.4Very high92.8Very high91 Ų9179.7 Ų79.748%0.47640%0.403SS..SBendtrans-69.2-28.3177.3-169.465.2000112.5V294 F313V294-L315 HydrophobicContact CG1-CD1 4.04Å; F313-L315 HydrophobicContact CE2-CD1 4.06Å; F313-L315 HydrophobicContact CZ-CD1 4.33Å
316T95.8Very high93Very high109 Ų10976.4 Ų76.467%0.66937%0.369SS*.SBendtrans-130.375.2177.354.20000108.9F314 E318F314-T316 VanDerWaalsContact C-N 3.27Å; F314-T316 PolarHBondContact O-N 2.81Å; T316-E318 PolarHBondContact O-N 3.33Å
317P94.1Very high93.2Very high21 Ų2172.3 Ų72.314%0.13635%0.353CS..  trans-69.2125.2-176.928.5-33.1000110.8D292 V294 F314 Q322 K323D292-P317 HydrophobicContact CB-CG 3.72Å; V294-P317 HydrophobicContact CG2-CG 4.26Å; F314-P317 HydrophobicContact CB-CB 4.06Å; P317-Q322 HydrophobicContact CB-CB 3.76Å; P317-K323 HydrophobicContact CB-CG 3.85Å; P317-K323 HydrophobicContact CG-CG 4Å
318E90.3Very high93.3Very high171 Ų17167 Ų6780%0.79934%0.335SS*.  trans-96.2-23.1-173.6-62.3-174.1163.200113.1T316T316-E318 PolarHBondContact O-N 3.33Å
319N85.7Confident93.4Very high68 Ų6867.9 Ų67.936%0.36434%0.338SS..SBendtrans-133168.1-176.161.957.5000112.1D321 Q322 K323N319-D321 VanDerWaalsContact C-N 3.35Å; N319-D321 PolarHBondContact O-N 3.02Å; N319-D321 PolarHBondContact OD1-N 2.97Å; N319-Q322 PolarHBondContact ND2-NE2 3.41Å; N319-Q322 PolarHBondContact O-N 3.27Å; N319-Q322 VanDerWaalsContact OD1-CG 3.29Å; N319-Q322 WeakPolarHBondContact OD1-CG 3.45Å; N319-Q322 PolarHBondContact OD1-N 3.41Å; N319-K323 WeakPolarHBondContact O-CG 3.34Å; N319-K323 PolarHBondContact O-N 3.08Å
320F85.4Confident93.6Very high80 Ų8066.1 Ų66.135%0.35133%0.327SS..Hα-helixtrans-58.3-45.1-176.9-173.4-96000112.3Q322 K323 V324 E347 V350 N351F320-Q322 VanDerWaalsContact C-N 3.33Å; F320-Q322 PolarHBondContact O-N 2.78Å; F320-K323 WeakPolarHBondContact O-CB 3.2Å; F320-K323 PolarHBondContact O-N 3.11Å; F320-K323 VanDerWaalsContact O-N 3.11Å; F320-V324 HydrophobicContact CD1-CG2 3.8Å; F320-V324 HydrophobicContact CE1-CG2 3.44Å; F320-V324 VanDerWaalsContact CE1-CG2 3.44Å; F320-V324 HydrophobicContact CG-CG2 4.49Å; F320-V324 HydrophobicContact CZ-CG2 3.86Å; F320-V324 WeakPolarHBondContact O-CG2 3.49Å; F320-V324 PolarHBondContact O-N 3.08Å; F320-E347 HydrophobicContact CE1-CG 4.41Å; F320-E347 HydrophobicContact CZ-CB 4.25Å; F320-E347 HydrophobicContact CZ-CG 4.39Å; F320-V350 HydrophobicContact CD2-CG1 3.61Å; F320-V350 HydrophobicContact CE2-CB 4.09Å; F320-V350 HydrophobicContact CE2-CG1 3.45Å; F320-V350 VanDerWaalsContact CE2-CG1 3.45Å; F320-V350 HydrophobicContact CG-CG1 4.48Å; F320-V350 HydrophobicContact CZ-CB 4.49Å; F320-V350 HydrophobicContact CZ-CG1 4.22Å; F320-N351 WeakPolarHBondContact CE2-OD1 3.39Å
321D84.1Confident93.9Very high122 Ų12262.1 Ų62.165%0.65231%0.305SS*.Hα-helixtrans-63-38.5-178.1-60.4-35.6000112.3N319 K323 V324 H325N319-D321 VanDerWaalsContact C-N 3.35Å; N319-D321 PolarHBondContact O-N 3.02Å; N319-D321 PolarHBondContact OD1-N 2.97Å; D321-K323 VanDerWaalsContact C-N 3.35Å; D321-K323 PolarHBondContact O-N 2.82Å; D321-V324 PolarHBondContact O-N 2.95Å; D321-H325 WeakPolarHBondContact O-CB 3.06Å; D321-H325 PolarHBondContact O-N 2.88Å
322Q94.1Very high94Very high39 Ų3957.5 Ų57.518%0.18229%0.291CS..Hα-helixtrans-64.6-38.2175-72.9177.82.100112.3F314 P317 N319 F320 H325 N326F314-Q322 HydrophobicContact CB-CB 4.36Å; F314-Q322 HydrophobicContact CD1-CG 3.97Å; F314-Q322 HydrophobicContact CD2-CB 3.68Å; F314-Q322 HydrophobicContact CD2-CG 3.71Å; F314-Q322 HydrophobicContact CE1-CG 3.97Å; F314-Q322 HydrophobicContact CE2-CB 4.1Å; F314-Q322 HydrophobicContact CE2-CG 3.72Å; F314-Q322 HydrophobicContact CG-CB 3.93Å; F314-Q322 HydrophobicContact CG-CG 3.85Å; F314-Q322 HydrophobicContact CZ-CG 3.85Å; P317-Q322 HydrophobicContact CB-CB 3.76Å; N319-Q322 PolarHBondContact ND2-NE2 3.41Å; N319-Q322 PolarHBondContact O-N 3.27Å; N319-Q322 VanDerWaalsContact OD1-CG 3.29Å; N319-Q322 WeakPolarHBondContact OD1-CG 3.45Å; N319-Q322 PolarHBondContact OD1-N 3.41Å; F320-Q322 VanDerWaalsContact C-N 3.33Å; F320-Q322 PolarHBondContact O-N 2.78Å; Q322-H325 PolarHBondContact O-N 2.98Å; Q322-N326 PolarHBondContact O-N 3.35Å; Q322-N326 PolarHBondContact O-OD1 3.49Å
323K96Very high94Very high70 Ų7055.5 Ų55.530%0.30428%0.28SS..Hα-helixtrans-67.1-45.1175.2-62.2179.7-177.8-178.60111.1D292 P317 N319 F320 D321 H325 N326 V327 V350D292-K323 HydrophobicContact CB-CG 4.33Å; P317-K323 HydrophobicContact CB-CG 3.85Å; P317-K323 HydrophobicContact CG-CG 4Å; N319-K323 WeakPolarHBondContact O-CG 3.34Å; N319-K323 PolarHBondContact O-N 3.08Å; F320-K323 WeakPolarHBondContact O-CB 3.2Å; F320-K323 PolarHBondContact O-N 3.11Å; F320-K323 VanDerWaalsContact O-N 3.11Å; D321-K323 VanDerWaalsContact C-N 3.35Å; D321-K323 PolarHBondContact O-N 2.82Å; K323-H325 VanDerWaalsContact C-N 3.3Å; K323-H325 PolarHBondContact O-N 2.91Å; K323-N326 PolarHBondContact O-N 2.89Å; K323-V327 WeakPolarHBondContact O-CG2 3.44Å; K323-V327 PolarHBondContact O-N 2.84Å; K323-V350 HydrophobicContact CB-CB 4.42Å; K323-V350 HydrophobicContact CB-CG1 3.67Å; K323-V350 HydrophobicContact CB-CG2 3.79Å; K323-V350 HydrophobicContact CD-CG1 3.88Å; K323-V350 HydrophobicContact CG-CG1 4.44Å
324V90.4Very high94Very high27 Ų2755.3 Ų55.316%0.16428%0.279CS..Hα-helixtrans-60.3-42.3176.4171.20000110.7F320 D321 V327 S328 P346 E347 V350F320-V324 HydrophobicContact CD1-CG2 3.8Å; F320-V324 HydrophobicContact CE1-CG2 3.44Å; F320-V324 VanDerWaalsContact CE1-CG2 3.44Å; F320-V324 HydrophobicContact CG-CG2 4.49Å; F320-V324 HydrophobicContact CZ-CG2 3.86Å; F320-V324 WeakPolarHBondContact O-CG2 3.49Å; F320-V324 PolarHBondContact O-N 3.08Å; D321-V324 PolarHBondContact O-N 2.95Å; V324-V327 PolarHBondContact O-N 3.24Å; V324-S328 VanDerWaalsContact O-CB 3.31Å; V324-S328 WeakPolarHBondContact O-CB 3.34Å; V324-S328 PolarHBondContact O-N 3.37Å; V324-P346 HydrophobicContact CG1-CB 4.16Å; V324-E347 HydrophobicContact CG1-CG 4.34Å; V324-E347 HydrophobicContact CG2-CG 4.03Å; V324-V350 HydrophobicContact CG2-CB 4.34Å; V324-V350 HydrophobicContact CG2-CG2 3.83Å
325H95.8Very high93.8Very high81 Ų8154.9 Ų54.938%0.37528%0.279SS..Hα-helixtrans-56.6-51.2173.4175.683.3000111.6N312 F314 D321 Q322 K323 V327 S328 F329N312-H325 PolarHBondContact O-NE2 3.44Å; F314-H325 AromaticContact CD2-CD2 3.86Å; F314-H325 HydrophobicContact CE2-CB 4.32Å; F314-H325 AromaticContact CE2-CD2 3.71Å; D321-H325 WeakPolarHBondContact O-CB 3.06Å; D321-H325 PolarHBondContact O-N 2.88Å; Q322-H325 PolarHBondContact O-N 2.98Å; K323-H325 VanDerWaalsContact C-N 3.3Å; K323-H325 PolarHBondContact O-N 2.91Å; H325-V327 PolarHBondContact O-N 3.42Å; H325-S328 PolarHBondContact O-N 2.88Å; H325-F329 VanDerWaalsContact O-CB 3.3Å; H325-F329 WeakPolarHBondContact O-CB 3.42Å; H325-F329 PolarHBondContact O-N 3.25Å
326N98.1Very high93.6Very high0 Ų057 Ų570%029%0.291CS..Hα-helixtrans-58.8-45.2179.2-73.8-4.4000112.5D292 V297 F313 F314 Q322 K323 F329 S330D292-N326 WeakPolarHBondContact O-CB 3.34Å; D292-N326 PolarHBondContact O-ND2 3.31Å; V297-N326 WeakPolarHBondContact CG2-O 3.47Å; F313-N326 WeakPolarHBondContact CB-OD1 3.39Å; F314-N326 PolarHBondContact N-OD1 3.3Å; F314-N326 PolarHBondContact O-ND2 3.44Å; Q322-N326 PolarHBondContact O-N 3.35Å; Q322-N326 PolarHBondContact O-OD1 3.49Å; K323-N326 PolarHBondContact O-N 2.89Å; N326-F329 PolarHBondContact O-N 3.02Å; N326-S330 PolarHBondContact O-N 3.39Å
327V97.8Very high93.3Very high0 Ų052.5 Ų52.50%027%0.265CS..Hα-helixtrans-66.9-44.2179.1178.90000110.6L296 K323 V324 H325 F329 S330 F331 P346 I349 V350L296-V327 HydrophobicContact CD1-CG1 4.23Å; K323-V327 WeakPolarHBondContact O-CG2 3.44Å; K323-V327 PolarHBondContact O-N 2.84Å; V324-V327 PolarHBondContact O-N 3.24Å; H325-V327 PolarHBondContact O-N 3.42Å; V327-F329 VanDerWaalsContact C-N 3.32Å; V327-F329 PolarHBondContact O-N 3.09Å; V327-S330 WeakPolarHBondContact O-CB 3.46Å; V327-S330 PolarHBondContact O-N 3.04Å; V327-S330 VanDerWaalsContact O-N 3.15Å; V327-S330 PolarHBondContact O-OG 3.49Å; V327-F331 HydrophobicContact CG1-CD1 4.34Å; V327-F331 HydrophobicContact CG1-CE1 3.77Å; V327-F331 HydrophobicContact CG1-CE2 4.22Å; V327-F331 HydrophobicContact CG1-CZ 3.7Å; V327-F331 WeakPolarHBondContact O-CD1 3.11Å; V327-F331 PolarHBondContact O-N 3.4Å; V327-F331 VanDerWaalsContact O-N 3.07Å; V327-P346 HydrophobicContact CB-CB 3.96Å; V327-P346 HydrophobicContact CG1-CB 3.81Å; V327-I349 HydrophobicContact CG1-CB 3.92Å; V327-I349 HydrophobicContact CG1-CG1 3.84Å; V327-I349 HydrophobicContact CG1-CG2 4.34Å; V327-I349 HydrophobicContact CG2-CB 4.22Å; V327-I349 HydrophobicContact CG2-CG2 4.13Å; V327-V350 HydrophobicContact CG2-CG2 3.92Å
328S95.4Very high93.1Very high44 Ų4454.1 Ų54.131%0.30829%0.286SS..Hα-helixtrans-57.8-46.7175.7-170.90000111.3V324 H325 S330 F331 E332V324-S328 VanDerWaalsContact O-CB 3.31Å; V324-S328 WeakPolarHBondContact O-CB 3.34Å; V324-S328 PolarHBondContact O-N 3.37Å; H325-S328 PolarHBondContact O-N 2.88Å; S328-S330 VanDerWaalsContact C-N 3.32Å; S328-S330 PolarHBondContact O-N 3.38Å; S328-F331 WeakPolarHBondContact O-CB 3.44Å; S328-F331 PolarHBondContact O-N 3.46Å; S328-E332 PolarHBondContact O-N 2.89Å
329F97.4Very high93.2Very high27 Ų2746.7 Ų46.712%0.11825%0.252CS..Hα-helixtrans-61.1-40.6176.5-179.2-120.6000111.7V297 V308 N312 F313 H325 N326 V327 F331 E332 L333V297-F329 HydrophobicContact CG1-CD1 4.21Å; V297-F329 HydrophobicContact CG1-CE1 4.1Å; V297-F329 HydrophobicContact CG2-CD1 3.99Å; V308-F329 HydrophobicContact CG1-CE1 3.59Å; V308-F329 HydrophobicContact CG1-CZ 4.06Å; N312-F329 HydrophobicContact CB-CE1 3.81Å; N312-F329 HydrophobicContact CB-CE2 4.25Å; N312-F329 HydrophobicContact CB-CZ 3.61Å; F313-F329 HydrophobicContact CB-CD1 3.98Å; F313-F329 HydrophobicContact CB-CE1 4.35Å; F313-F329 HydrophobicContact CD1-CE1 4.48Å; H325-F329 VanDerWaalsContact O-CB 3.3Å; H325-F329 WeakPolarHBondContact O-CB 3.42Å; H325-F329 PolarHBondContact O-N 3.25Å; N326-F329 PolarHBondContact O-N 3.02Å; V327-F329 VanDerWaalsContact C-N 3.32Å; V327-F329 PolarHBondContact O-N 3.09Å; F329-F331 PolarHBondContact O-N 3.2Å; F329-E332 WeakPolarHBondContact O-CB 3.31Å; F329-E332 PolarHBondContact O-N 3.39Å; F329-E332 VanDerWaalsContact O-N 3.16Å; F329-L333 HydrophobicContact CD1-CD1 4.26Å; F329-L333 HydrophobicContact CE1-CD1 3.86Å; F329-L333 HydrophobicContact CE1-CD2 4.48Å; F329-L333 HydrophobicContact CE1-CG 4.29Å; F329-L333 HydrophobicContact CE2-CD2 4.14Å; F329-L333 HydrophobicContact CE2-CG 4.35Å; F329-L333 HydrophobicContact CZ-CD1 4.12Å; F329-L333 HydrophobicContact CZ-CD2 3.9Å; F329-L333 HydrophobicContact CZ-CG 4.13Å; F329-L333 WeakPolarHBondContact O-CG 3.27Å; F329-L333 PolarHBondContact O-N 3.3Å
330S97.6Very high93.2Very high0 Ų051 Ų510%027%0.27CS..Hα-helixtrans-61-33.517481.30000113N326 V327 S328 L333 M334N326-S330 PolarHBondContact O-N 3.39Å; V327-S330 WeakPolarHBondContact O-CB 3.46Å; V327-S330 PolarHBondContact O-N 3.04Å; V327-S330 VanDerWaalsContact O-N 3.15Å; V327-S330 PolarHBondContact O-OG 3.49Å; S328-S330 VanDerWaalsContact C-N 3.32Å; S328-S330 PolarHBondContact O-N 3.38Å; S330-L333 PolarHBondContact O-N 3.48Å; S330-M334 VanDerWaalsContact O-CG 3.28Å; S330-M334 WeakPolarHBondContact O-CG 3.47Å; S330-M334 PolarHBondContact O-N 3.28Å
331F96.6Very high93Very high9 Ų955.9 Ų55.94%0.03929%0.286CS..Hα-helixtrans-74.5-29.5177.3-68.30.9000112.5L296 V327 S328 F329 M334 Q335 P342 P344 P346 I349 V360L296-F331 HydrophobicContact CD1-CE1 4.49Å; V327-F331 HydrophobicContact CG1-CD1 4.34Å; V327-F331 HydrophobicContact CG1-CE1 3.77Å; V327-F331 HydrophobicContact CG1-CE2 4.22Å; V327-F331 HydrophobicContact CG1-CZ 3.7Å; V327-F331 WeakPolarHBondContact O-CD1 3.11Å; V327-F331 PolarHBondContact O-N 3.4Å; V327-F331 VanDerWaalsContact O-N 3.07Å; S328-F331 WeakPolarHBondContact O-CB 3.44Å; S328-F331 PolarHBondContact O-N 3.46Å; F329-F331 PolarHBondContact O-N 3.2Å; F331-M334 HydrophobicContact CD1-CE 4.16Å; F331-M334 HydrophobicContact CD1-SD 4.07Å; F331-Q335 WeakPolarHBondContact O-CG 3.36Å; F331-Q335 PolarHBondContact O-N 2.98Å; F331-Q335 PolarHBondContact O-NE2 3.07Å; F331-P342 HydrophobicContact CB-CG 4.08Å; F331-P342 HydrophobicContact CD1-CB 4.06Å; F331-P342 HydrophobicContact CD1-CG 3.67Å; F331-P342 HydrophobicContact CD2-CB 3.95Å; F331-P342 HydrophobicContact CD2-CG 4.13Å; F331-P342 HydrophobicContact CE1-CB 4.03Å; F331-P342 HydrophobicContact CE1-CG 4.09Å; F331-P342 HydrophobicContact CE2-CB 3.93Å; F331-P342 HydrophobicContact CG-CB 4.02Å; F331-P342 HydrophobicContact CG-CG 3.7Å; F331-P342 HydrophobicContact CZ-CB 3.96Å; F331-P342 HydrophobicContact CZ-CG 4.48Å; F331-P344 WeakPolarHBondContact CE2-O 3.23Å; F331-P346 HydrophobicContact CD2-CG 4.04Å; F331-P346 HydrophobicContact CE2-CG 4.02Å; F331-I349 HydrophobicContact CZ-CG1 3.98Å; F331-V360 HydrophobicContact CE1-CG1 4.07Å; F331-V360 HydrophobicContact CE1-CG2 3.89Å; F331-V360 HydrophobicContact CZ-CG2 3.89Å
332E94.4Very high93.3Very high99 Ų9950.5 Ų50.546%0.46326%0.257SS..Hα-helixtrans-65.2-48.9169.1-68.3171-167.400109.9S328 F329 M334 Q335 D336S328-E332 PolarHBondContact O-N 2.89Å; F329-E332 WeakPolarHBondContact O-CB 3.31Å; F329-E332 PolarHBondContact O-N 3.39Å; F329-E332 VanDerWaalsContact O-N 3.16Å; E332-M334 VanDerWaalsContact C-N 3.26Å; E332-M334 PolarHBondContact O-N 3.46Å; E332-Q335 WeakPolarHBondContact O-CB 3.31Å; E332-Q335 PolarHBondContact O-N 3.01Å; E332-D336 PolarHBondContact O-N 2.95Å
333L95.9Very high92.8Very high14 Ų1454.5 Ų54.57%0.07327%0.274CS..Hα-helixtrans-57.3-37.9175.6-64.1179.7000112.8V297 M300 V308 F329 S330 D336 G337V297-L333 HydrophobicContact CG1-CD1 4.18Å; M300-L333 HydrophobicContact CB-CB 4.17Å; M300-L333 HydrophobicContact CB-CD1 4.19Å; M300-L333 HydrophobicContact CG-CB 4.26Å; V308-L333 HydrophobicContact CG2-CD1 3.94Å; F329-L333 HydrophobicContact CD1-CD1 4.26Å; F329-L333 HydrophobicContact CE1-CD1 3.86Å; F329-L333 HydrophobicContact CE1-CD2 4.48Å; F329-L333 HydrophobicContact CE1-CG 4.29Å; F329-L333 HydrophobicContact CE2-CD2 4.14Å; F329-L333 HydrophobicContact CE2-CG 4.35Å; F329-L333 HydrophobicContact CZ-CD1 4.12Å; F329-L333 HydrophobicContact CZ-CD2 3.9Å; F329-L333 HydrophobicContact CZ-CG 4.13Å; F329-L333 WeakPolarHBondContact O-CG 3.27Å; F329-L333 PolarHBondContact O-N 3.3Å; S330-L333 PolarHBondContact O-N 3.48Å; L333-D336 PolarHBondContact O-N 3.2Å; L333-G337 PolarHBondContact O-N 3.24Å
334M95.9Very high92.4Very high3 Ų351.8 Ų51.82%0.01526%0.264CS..Hα-helixtrans-62.9-42.6174.5-72.9173.9-15500112.3L296 M300 S330 F331 E332 G337 G338 L339 P342 V360 L364L296-M334 HydrophobicContact CD2-CE 4.44Å; M300-M334 HydrophobicContact CE-CG 4.09Å; M300-M334 HydrophobicContact CG-CE 4.13Å; M300-M334 HydrophobicContact CG-CG 3.98Å; M300-M334 HydrophobicContact SD-CB 4.47Å; M300-M334 HydrophobicContact SD-CE 4.28Å; M300-M334 HydrophobicContact SD-CG 3.46Å; M300-M334 WeakPolarHBondContact SD-CG 3.23Å; S330-M334 VanDerWaalsContact O-CG 3.28Å; S330-M334 WeakPolarHBondContact O-CG 3.47Å; S330-M334 PolarHBondContact O-N 3.28Å; F331-M334 HydrophobicContact CD1-CE 4.16Å; F331-M334 HydrophobicContact CD1-SD 4.07Å; E332-M334 VanDerWaalsContact C-N 3.26Å; E332-M334 PolarHBondContact O-N 3.46Å; M334-G337 CarbonylContact O-C 3.59Å; M334-G337 PolarHBondContact O-N 3.37Å; M334-G338 PolarHBondContact O-N 2.92Å; M334-L339 HydrophobicContact CB-CB 4.38Å; M334-L339 HydrophobicContact CB-CD1 4.44Å; M334-L339 WeakPolarHBondContact O-CB 3.42Å; M334-L339 WeakPolarHBondContact O-CD1 3.44Å; M334-L339 PolarHBondContact O-N 2.91Å; M334-P342 HydrophobicContact SD-CG 3.62Å; M334-V360 HydrophobicContact CE-CG1 3.7Å; M334-V360 HydrophobicContact SD-CG1 4Å; M334-L364 HydrophobicContact CE-CD1 3.99Å; M334-L364 HydrophobicContact CE-CD2 4.19Å; M334-L364 HydrophobicContact CE-CG 4.39Å; M334-L364 HydrophobicContact CG-CD2 3.96Å; M334-L364 HydrophobicContact SD-CD2 4.09Å
335Q93.7Very high92.2Very high78 Ų7853.8 Ų53.836%0.36427%0.268SS..Hα-helixtrans-68.3-39.9177.8-75.4169.191.800111.5F331 E332 G337 G338 R341F331-Q335 WeakPolarHBondContact O-CG 3.36Å; F331-Q335 PolarHBondContact O-N 2.98Å; F331-Q335 PolarHBondContact O-NE2 3.07Å; E332-Q335 WeakPolarHBondContact O-CB 3.31Å; E332-Q335 PolarHBondContact O-N 3.01Å; Q335-G337 VanDerWaalsContact C-N 3.26Å; Q335-G337 PolarHBondContact O-N 3.19Å; Q335-G338 WeakPolarHBondContact O-CA 3.46Å; Q335-G338 PolarHBondContact O-N 3.23Å; Q335-R341 HydrophobicContact CG-CB 4.07Å
336D91.8Very high92Very high136 Ų13650.9 Ų50.973%0.72726%0.257SS*.Hα-helixtrans-63.8-33.4174.9-69.6-14.2000111.7E332 L333 G338E332-D336 PolarHBondContact O-N 2.95Å; L333-D336 PolarHBondContact O-N 3.2Å; D336-G338 PolarHBondContact O-N 3.01Å
337G89.8Confident91.5Very high13 Ų1353.2 Ų53.213%0.13427%0.268CS..THydrogen-bonded Turntrans-73.12.2169.500000114.8L333 M334 Q335L333-G337 PolarHBondContact O-N 3.24Å; M334-G337 CarbonylContact O-C 3.59Å; M334-G337 PolarHBondContact O-N 3.37Å; Q335-G337 VanDerWaalsContact C-N 3.26Å; Q335-G337 PolarHBondContact O-N 3.19Å
338G89.6Confident90.9Very high56 Ų5654.7 Ų54.758%0.57728%0.276SS*.THydrogen-bonded Turntrans80.418.6176.500000115.1M334 Q335 D336M334-G338 PolarHBondContact O-N 2.92Å; Q335-G338 WeakPolarHBondContact O-CA 3.46Å; Q335-G338 PolarHBondContact O-N 3.23Å; D336-G338 PolarHBondContact O-N 3.01Å
339L91.4Very high90.9Very high15 Ų1552.7 Ų52.78%0.07926%0.262CS..PPolyproline II helixtrans-80.8152.9168.7-66.789.6000110.6M334 N363 L364 R367 Y368M334-L339 HydrophobicContact CB-CB 4.38Å; M334-L339 HydrophobicContact CB-CD1 4.44Å; M334-L339 WeakPolarHBondContact O-CB 3.42Å; M334-L339 WeakPolarHBondContact O-CD1 3.44Å; M334-L339 PolarHBondContact O-N 2.91Å; L339-N363 WeakPolarHBondContact CD2-OD1 3.35Å; L339-L364 HydrophobicContact CD2-CD2 3.9Å; L339-R367 HydrophobicContact CD1-CG 4.48Å; L339-R367 HydrophobicContact CD2-CB 4.23Å; L339-R367 HydrophobicContact CG-CG 4.36Å; L339-Y368 HydrophobicContact CD1-CE2 3.74Å; L339-Y368 VanDerWaalsContact CD1-OH 3.22Å; L339-Y368 WeakPolarHBondContact CD1-OH 3.12Å; L339-Y368 HydrophobicContact CD2-CE2 4.26Å
340E85.8Confident90.6Very high158 Ų15852 Ų5274%0.73826%0.259SS*.PPolyproline II helixtrans-60.1142.5164.9-67.5-173.8173.400109.9P342E340-P342 WeakPolarHBondContact O-CD 3.49Å
341R82.4Confident90.1Very high182 Ų18254.2 Ų54.269%0.68727%0.271SS*.PPolyproline II helixtrans-50.3125.9175.7-177.2172.7179.9173.63.9109.5Q335 K343Q335-R341 HydrophobicContact CG-CB 4.07Å; R341-K343 PolarHBondContact O-N 3.46Å
342P88.7Confident89.8Confident9 Ų956.6 Ų56.66%0.05829%0.288CS..PPolyproline II helixtrans-52130.7176.4-30.438000111.2F331 M334 E340 V360F331-P342 HydrophobicContact CB-CG 4.08Å; F331-P342 HydrophobicContact CD1-CB 4.06Å; F331-P342 HydrophobicContact CD1-CG 3.67Å; F331-P342 HydrophobicContact CD2-CB 3.95Å; F331-P342 HydrophobicContact CD2-CG 4.13Å; F331-P342 HydrophobicContact CE1-CB 4.03Å; F331-P342 HydrophobicContact CE1-CG 4.09Å; F331-P342 HydrophobicContact CE2-CB 3.93Å; F331-P342 HydrophobicContact CG-CB 4.02Å; F331-P342 HydrophobicContact CG-CG 3.7Å; F331-P342 HydrophobicContact CZ-CB 3.96Å; F331-P342 HydrophobicContact CZ-CG 4.48Å; M334-P342 HydrophobicContact SD-CG 3.62Å; E340-P342 WeakPolarHBondContact O-CD 3.49Å; P342-V360 HydrophobicContact CB-CG2 4.29Å
343K83.7Confident89.4Confident124 Ų12454.8 Ų54.854%0.53928%0.282SS..SBendtrans-63.7-42.4176.8-62.9-176.7179.81800112.5R341R341-K343 PolarHBondContact O-N 3.46Å
344P88.5Confident89.1Confident12 Ų1255.1 Ų55.18%0.07828%0.284CS..SBendtrans-62.6153.9177-25.238.4000112.2F331 I349 R359 V360F331-P344 WeakPolarHBondContact CE2-O 3.23Å; P344-I349 HydrophobicContact CB-CD1 4.38Å; P344-R359 HydrophobicContact CG-CB 4.09Å; P344-V360 HydrophobicContact CB-CG2 4.38Å; P344-V360 HydrophobicContact CG-CG2 4Å
345R87Confident88.8Confident69 Ų6957 Ų5726%0.2629%0.292SS..  trans-88.6153174.5-48.3170.8-58.7-165.44.4108.8R202 E347 D348R202-R345 VanDerWaalsContact CZ-CD 3.42Å; R202-R345 VanDerWaalsContact NH1-CD 3.26Å; R345-E347 WeakPolarHBondContact CB-OE2 3.5Å; R345-E347 PolarHBondContact O-N 3.27Å; R345-D348 VanDerWaalsContact CB-OD2 3.25Å; R345-D348 WeakPolarHBondContact CB-OD2 3.41Å; R345-D348 WeakPolarHBondContact CG-OD2 3.46Å; R345-D348 IonicContact CZ-OD1 3.28Å; R345-D348 IonicContact CZ-OD2 2.82Å; R345-D348 PolarHBondContact N-OD2 3.02Å; R345-D348 IonicContact NE-OD1 2.88Å; R345-D348 PolarHBondContact NE-OD1 3.34Å; R345-D348 IonicContact NE-OD2 2.84Å; R345-D348 PolarHBondContact NE-OD2 3.35Å; R345-D348 VanDerWaalsContact NE-OD2 3.11Å; R345-D348 IonicContact NH2-OD1 3.49Å; R345-D348 PolarHBondContact NH2-OD1 3.27Å; R345-D348 IonicContact NH2-OD2 3.21Å; R345-D348 WeakPolarHBondContact O-CB 3.47Å; R345-D348 PolarHBondContact O-N 3.15Å
346P90.2Very high88.7Confident21 Ų2153.6 Ų53.614%0.13628%0.277CS..Hα-helixtrans-54.3-39.2-179.9-2937.4000113.3V324 V327 F331 D348 I349 V350V324-P346 HydrophobicContact CG1-CB 4.16Å; V327-P346 HydrophobicContact CB-CB 3.96Å; V327-P346 HydrophobicContact CG1-CB 3.81Å; F331-P346 HydrophobicContact CD2-CG 4.04Å; F331-P346 HydrophobicContact CE2-CG 4.02Å; P346-D348 VanDerWaalsContact C-N 3.26Å; P346-D348 PolarHBondContact O-N 2.83Å; P346-I349 WeakPolarHBondContact O-CB 3.48Å; P346-I349 PolarHBondContact O-N 3.25Å; P346-I349 VanDerWaalsContact O-N 3.16Å; P346-V350 WeakPolarHBondContact O-CG2 3.41Å; P346-V350 PolarHBondContact O-N 3.19Å
347E87.6Confident88.9Confident49 Ų4947.3 Ų47.323%0.22924%0.243CC..Hα-helixtrans-64-30.9-179.8-52.687.6162.300112.5R202 F320 V324 R345 I349 V350 N351R202-E347 IonicContact NH1-OE1 2.78Å; R202-E347 PolarHBondContact NH1-OE1 3.14Å; R202-E347 IonicContact NH1-OE2 3.27Å; R202-E347 PolarHBondContact NH1-OE2 3.35Å; F320-E347 HydrophobicContact CE1-CG 4.41Å; F320-E347 HydrophobicContact CZ-CB 4.25Å; F320-E347 HydrophobicContact CZ-CG 4.39Å; V324-E347 HydrophobicContact CG1-CG 4.34Å; V324-E347 HydrophobicContact CG2-CG 4.03Å; R345-E347 WeakPolarHBondContact CB-OE2 3.5Å; R345-E347 PolarHBondContact O-N 3.27Å; E347-I349 VanDerWaalsContact C-N 3.27Å; E347-I349 PolarHBondContact O-N 3.41Å; E347-V350 PolarHBondContact O-N 3.21Å; E347-N351 VanDerWaalsContact O-CB 3.26Å; E347-N351 WeakPolarHBondContact O-CB 3.45Å; E347-N351 VanDerWaalsContact O-CG 3.22Å; E347-N351 PolarHBondContact O-N 3.19Å; E347-N351 PolarHBondContact O-ND2 3.42Å
348D85.8Confident89.1Confident31 Ų3146.7 Ų46.717%0.16624%0.237CC..Hα-helixtrans-65.9-35.3179.2-54.5-39.3000110.2R345 P346 D353R345-D348 VanDerWaalsContact CB-OD2 3.25Å; R345-D348 WeakPolarHBondContact CB-OD2 3.41Å; R345-D348 WeakPolarHBondContact CG-OD2 3.46Å; R345-D348 IonicContact CZ-OD1 3.28Å; R345-D348 IonicContact CZ-OD2 2.82Å; R345-D348 PolarHBondContact N-OD2 3.02Å; R345-D348 IonicContact NE-OD1 2.88Å; R345-D348 PolarHBondContact NE-OD1 3.34Å; R345-D348 IonicContact NE-OD2 2.84Å; R345-D348 PolarHBondContact NE-OD2 3.35Å; R345-D348 VanDerWaalsContact NE-OD2 3.11Å; R345-D348 IonicContact NH2-OD1 3.49Å; R345-D348 PolarHBondContact NH2-OD1 3.27Å; R345-D348 IonicContact NH2-OD2 3.21Å; R345-D348 WeakPolarHBondContact O-CB 3.47Å; R345-D348 PolarHBondContact O-N 3.15Å; P346-D348 VanDerWaalsContact C-N 3.26Å; P346-D348 PolarHBondContact O-N 2.83Å; D348-D353 HydrophobicContact CB-CB 4.41Å; D348-D353 VanDerWaalsContact O-CB 3.23Å; D348-D353 WeakPolarHBondContact O-CB 3.23Å; D348-D353 PolarHBondContact O-N 3.22Å
349I94.4Very high89.3Confident2 Ų246.3 Ų46.31%0.0122%0.218CC..Hα-helixtrans-70.4-44.8174.2-49.6-58.9000110.8A291 L296 V327 F331 P344 P346 E347 N351 C352 V360A291-I349 WeakPolarHBondContact CA-O 3.28Å; L296-I349 HydrophobicContact CD1-CG2 4.22Å; V327-I349 HydrophobicContact CG1-CB 3.92Å; V327-I349 HydrophobicContact CG1-CG1 3.84Å; V327-I349 HydrophobicContact CG1-CG2 4.34Å; V327-I349 HydrophobicContact CG2-CB 4.22Å; V327-I349 HydrophobicContact CG2-CG2 4.13Å; F331-I349 HydrophobicContact CZ-CG1 3.98Å; P344-I349 HydrophobicContact CB-CD1 4.38Å; P346-I349 WeakPolarHBondContact O-CB 3.48Å; P346-I349 PolarHBondContact O-N 3.25Å; P346-I349 VanDerWaalsContact O-N 3.16Å; E347-I349 VanDerWaalsContact C-N 3.27Å; E347-I349 PolarHBondContact O-N 3.41Å; I349-N351 PolarHBondContact O-N 3.19Å; I349-C352 PolarHBondContact O-N 3.18Å; I349-V360 HydrophobicContact CD1-CG2 3.92Å
350V91.9Very high89.5Confident12 Ų1245.8 Ų45.87%0.07322%0.215CC..Hα-helixtrans-63.4-32179.6-178.70000111.9A291 F320 K323 V324 V327 P346 E347 C352A291-V350 WeakPolarHBondContact O-CA 3.2Å; F320-V350 HydrophobicContact CD2-CG1 3.61Å; F320-V350 HydrophobicContact CE2-CB 4.09Å; F320-V350 HydrophobicContact CE2-CG1 3.45Å; F320-V350 VanDerWaalsContact CE2-CG1 3.45Å; F320-V350 HydrophobicContact CG-CG1 4.48Å; F320-V350 HydrophobicContact CZ-CB 4.49Å; F320-V350 HydrophobicContact CZ-CG1 4.22Å; K323-V350 HydrophobicContact CB-CB 4.42Å; K323-V350 HydrophobicContact CB-CG1 3.67Å; K323-V350 HydrophobicContact CB-CG2 3.79Å; K323-V350 HydrophobicContact CD-CG1 3.88Å; K323-V350 HydrophobicContact CG-CG1 4.44Å; V324-V350 HydrophobicContact CG2-CB 4.34Å; V324-V350 HydrophobicContact CG2-CG2 3.83Å; V327-V350 HydrophobicContact CG2-CG2 3.92Å; P346-V350 WeakPolarHBondContact O-CG2 3.41Å; P346-V350 PolarHBondContact O-N 3.19Å; E347-V350 PolarHBondContact O-N 3.21Å; V350-C352 PolarHBondContact O-N 3.08Å
351N86.8Confident90Very high47 Ų4738.3 Ų38.325%0.25118%0.18SC..THydrogen-bonded Turntrans-82.313175.8-71.1-29.3000114P204 F320 E347 I349 D353P204-N351 VanDerWaalsContact CA-OD1 3.26Å; P204-N351 WeakPolarHBondContact CA-OD1 3.36Å; P204-N351 WeakPolarHBondContact CB-OD1 3.28Å; F320-N351 WeakPolarHBondContact CE2-OD1 3.39Å; E347-N351 VanDerWaalsContact O-CB 3.26Å; E347-N351 WeakPolarHBondContact O-CB 3.45Å; E347-N351 VanDerWaalsContact O-CG 3.22Å; E347-N351 PolarHBondContact O-N 3.19Å; E347-N351 PolarHBondContact O-ND2 3.42Å; I349-N351 PolarHBondContact O-N 3.19Å; N351-D353 VanDerWaalsContact C-N 3.25Å; N351-D353 PolarHBondContact O-N 3.42Å
352C90.5Very high90.6Very high58 Ų5834.7 Ų34.739%0.39217%0.167SC..THydrogen-bonded Turntrans59.532.2178.2-57.70000113.3D287 I349 V350 L354D287-C352 VanDerWaalsContact O-CB 3.25Å; D287-C352 WeakPolarHBondContact O-CB 3.49Å; I349-C352 PolarHBondContact O-N 3.18Å; V350-C352 PolarHBondContact O-N 3.08Å; C352-L354 PolarHBondContact O-N 2.88Å
353D86.3Confident90.8Very high62 Ų6236.9 Ų36.933%0.33218%0.179SC..  trans-70.7102.4169.4177.429.8000109.5D348 N351 K355 S356 T357D348-D353 HydrophobicContact CB-CB 4.41Å; D348-D353 VanDerWaalsContact O-CB 3.23Å; D348-D353 WeakPolarHBondContact O-CB 3.23Å; D348-D353 PolarHBondContact O-N 3.22Å; N351-D353 VanDerWaalsContact C-N 3.25Å; N351-D353 PolarHBondContact O-N 3.42Å; D353-K355 PolarHBondContact O-N 3.09Å; D353-K355 PolarHBondContact OD1-N 2.9Å; D353-K355 VanDerWaalsContact OD1-N 3.1Å; D353-S356 PolarHBondContact O-N 3.29Å; D353-S356 WeakPolarHBondContact OD2-CB 3.4Å; D353-S356 PolarHBondContact OD2-N 2.85Å; D353-S356 PolarHBondContact OD2-OG 3Å; D353-T357 PolarHBondContact O-N 2.95Å; D353-T357 PolarHBondContact O-OG1 2.98Å; D353-T357 VanDerWaalsContact O-OG1 3.05Å
354L89.9Confident91.4Very high21 Ų2131 Ų3111%0.1115%0.153CC..Hα-helixtrans-55.9-41.2177.6174.468.7000111.5F254 K265 L286 D287 C352 S356 T357 L358F254-L354 HydrophobicContact CE1-CD2 4.02Å; F254-L354 HydrophobicContact CZ-CD2 3.83Å; F254-L354 HydrophobicContact CZ-CG 4.05Å; K265-L354 VanDerWaalsContact NZ-CD2 3.26Å; L286-L354 HydrophobicContact CB-CD1 4.27Å; D287-L354 WeakPolarHBondContact OD1-CD2 3.49Å; C352-L354 PolarHBondContact O-N 2.88Å; L354-S356 VanDerWaalsContact C-N 3.33Å; L354-S356 PolarHBondContact O-N 2.97Å; L354-T357 PolarHBondContact O-N 2.85Å; L354-L358 HydrophobicContact CD1-CD1 3.9Å; L354-L358 HydrophobicContact CD1-CD2 4.14Å; L354-L358 HydrophobicContact CD1-CG 3.79Å; L354-L358 HydrophobicContact CD2-CD1 4.28Å; L354-L358 HydrophobicContact CG-CD1 3.81Å; L354-L358 HydrophobicContact CG-CG 4.1Å; L354-L358 WeakPolarHBondContact O-CB 3.1Å; L354-L358 VanDerWaalsContact O-CG 3.23Å; L354-L358 WeakPolarHBondContact O-CG 3.42Å; L354-L358 PolarHBondContact O-N 3.15Å
355K89.9Confident91.7Very high42 Ų4232.5 Ų32.518%0.18316%0.158CC..Hα-helixtrans-63.5-44.4-175.6-169.9-172.9-75.2-173.90110F250 D251 F254 D353 R359F250-K355 HydrophobicContact CB-CG 4.39Å; D251-K355 WeakPolarHBondContact OD1-CD 3.29Å; D251-K355 IonicContact OD1-NZ 2.77Å; D251-K355 PolarHBondContact OD1-NZ 3.2Å; F254-K355 HydrophobicContact CD2-CD 4.47Å; F254-K355 HydrophobicContact CD2-CG 4.01Å; F254-K355 HydrophobicContact CE1-CB 4.24Å; F254-K355 HydrophobicContact CE2-CB 3.94Å; F254-K355 HydrophobicContact CE2-CG 3.75Å; F254-K355 HydrophobicContact CZ-CB 3.77Å; F254-K355 HydrophobicContact CZ-CG 4.12Å; D353-K355 PolarHBondContact O-N 3.09Å; D353-K355 PolarHBondContact OD1-N 2.9Å; D353-K355 VanDerWaalsContact OD1-N 3.1Å; K355-R359 WeakPolarHBondContact O-CG 3.46Å; K355-R359 PolarHBondContact O-N 3.5Å; K355-R359 VanDerWaalsContact O-N 3.08Å
356S91.8Very high91.9Very high7 Ų732 Ų325%0.04917%0.165CC..Hα-helixtrans-61-46.9172.4-71.50000112.9D353 L354 L358 R359 V360D353-S356 PolarHBondContact O-N 3.29Å; D353-S356 WeakPolarHBondContact OD2-CB 3.4Å; D353-S356 PolarHBondContact OD2-N 2.85Å; D353-S356 PolarHBondContact OD2-OG 3Å; L354-S356 VanDerWaalsContact C-N 3.33Å; L354-S356 PolarHBondContact O-N 2.97Å; S356-L358 VanDerWaalsContact C-N 3.35Å; S356-L358 PolarHBondContact O-N 2.78Å; S356-R359 WeakPolarHBondContact O-CB 3.47Å; S356-R359 PolarHBondContact O-N 3.29Å; S356-V360 WeakPolarHBondContact O-CG2 3.27Å; S356-V360 PolarHBondContact O-N 3.23Å
357T95.3Very high92Very high4 Ų438.5 Ų38.53%0.02519%0.187CC..Hα-helixtrans-59.9-44.8178.8-57.60000111.7L286 F290 D353 L354 R359 V360 L361L286-T357 WeakPolarHBondContact O-CG2 3.46Å; F290-T357 HydrophobicContact CB-CG2 4.07Å; F290-T357 HydrophobicContact CD2-CG2 4.19Å; F290-T357 HydrophobicContact CG-CG2 4.34Å; D353-T357 PolarHBondContact O-N 2.95Å; D353-T357 PolarHBondContact O-OG1 2.98Å; D353-T357 VanDerWaalsContact O-OG1 3.05Å; L354-T357 PolarHBondContact O-N 2.85Å; T357-R359 VanDerWaalsContact C-N 3.35Å; T357-R359 PolarHBondContact O-N 3Å; T357-V360 PolarHBondContact O-N 3.18Å; T357-L361 HydrophobicContact CG2-CD1 3.98Å; T357-L361 HydrophobicContact CG2-CG 4.36Å; T357-L361 WeakPolarHBondContact O-CG 3.42Å; T357-L361 PolarHBondContact O-N 3.4Å
358L94.7Very high92.3Very high0 Ų036.7 Ų36.70%018%0.178CC..Hα-helixtrans-64.4-37.6177.1-65.7175.2000112.5F250 F254 L261 K265 L268 L286 L354 S356 Y362F250-L358 HydrophobicContact CD1-CB 4.24Å; F250-L358 HydrophobicContact CE1-CB 3.6Å; F250-L358 HydrophobicContact CE1-CD1 4.38Å; F250-L358 HydrophobicContact CZ-CB 4.15Å; F254-L358 HydrophobicContact CE2-CD1 3.92Å; F254-L358 HydrophobicContact CZ-CD1 3.9Å; L261-L358 HydrophobicContact CD1-CD1 3.53Å; K265-L358 HydrophobicContact CG-CD1 4.49Å; K265-L358 HydrophobicContact CG-CD2 4.15Å; L268-L358 HydrophobicContact CD1-CB 4.44Å; L268-L358 HydrophobicContact CD1-CD2 3.63Å; L286-L358 HydrophobicContact CD1-CD2 3.55Å; L354-L358 HydrophobicContact CD1-CD1 3.9Å; L354-L358 HydrophobicContact CD1-CD2 4.14Å; L354-L358 HydrophobicContact CD1-CG 3.79Å; L354-L358 HydrophobicContact CD2-CD1 4.28Å; L354-L358 HydrophobicContact CG-CD1 3.81Å; L354-L358 HydrophobicContact CG-CG 4.1Å; L354-L358 WeakPolarHBondContact O-CB 3.1Å; L354-L358 VanDerWaalsContact O-CG 3.23Å; L354-L358 WeakPolarHBondContact O-CG 3.42Å; L354-L358 PolarHBondContact O-N 3.15Å; S356-L358 VanDerWaalsContact C-N 3.35Å; S356-L358 PolarHBondContact O-N 2.78Å; L358-Y362 WeakPolarHBondContact O-CB 3.41Å; L358-Y362 PolarHBondContact O-N 3.34Å
359R93.1Very high92.5Very high48 Ų4842.2 Ų42.218%0.18120%0.197CC..Hα-helixtrans-61.4-46.1175-78.7175.5175129.12.2111.8D248 F250 D251 P344 K355 S356 T357 N363D248-R359 VanDerWaalsContact CG-NH2 3.31Å; D248-R359 IonicContact OD1-CZ 3.83Å; D248-R359 IonicContact OD1-NE 3.87Å; D248-R359 PolarHBondContact OD1-NE 3.03Å; D248-R359 IonicContact OD1-NH2 3.11Å; D248-R359 PolarHBondContact OD1-NH2 3.13Å; D248-R359 IonicContact OD2-CZ 3.22Å; D248-R359 IonicContact OD2-NE 3.38Å; D248-R359 PolarHBondContact OD2-NE 3.02Å; D248-R359 IonicContact OD2-NH2 3.35Å; D248-R359 PolarHBondContact OD2-NH2 3.01Å; F250-R359 HydrophobicContact CB-CG 4.16Å; F250-R359 HydrophobicContact CD2-CG 3.57Å; F250-R359 HydrophobicContact CE2-CG 4.08Å; F250-R359 HydrophobicContact CG-CG 3.86Å; D251-R359 IonicContact OD1-CZ 2.77Å; D251-R359 IonicContact OD1-NH2 3.36Å; D251-R359 PolarHBondContact OD1-NH2 3.09Å; D251-R359 IonicContact OD2-NH2 3.49Å; D251-R359 PolarHBondContact OD2-NH2 3.07Å; P344-R359 HydrophobicContact CG-CB 4.09Å; K355-R359 WeakPolarHBondContact O-CG 3.46Å; K355-R359 PolarHBondContact O-N 3.5Å; K355-R359 VanDerWaalsContact O-N 3.08Å; S356-R359 WeakPolarHBondContact O-CB 3.47Å; S356-R359 PolarHBondContact O-N 3.29Å; T357-R359 VanDerWaalsContact C-N 3.35Å; T357-R359 PolarHBondContact O-N 3Å; R359-N363 PolarHBondContact O-N 2.96Å; R359-N363 VanDerWaalsContact O-N 3.15Å
360V95.8Very high92.1Very high4 Ų448.2 Ų48.22%0.02423%0.229CC..Hα-helixtrans-61.3-53.7177.31760000110.3L296 F331 M334 P342 P344 I349 S356 T357 Y362 N363 L364L296-V360 HydrophobicContact CD2-CG1 4.25Å; F331-V360 HydrophobicContact CE1-CG1 4.07Å; F331-V360 HydrophobicContact CE1-CG2 3.89Å; F331-V360 HydrophobicContact CZ-CG2 3.89Å; M334-V360 HydrophobicContact CE-CG1 3.7Å; M334-V360 HydrophobicContact SD-CG1 4Å; P342-V360 HydrophobicContact CB-CG2 4.29Å; P344-V360 HydrophobicContact CB-CG2 4.38Å; P344-V360 HydrophobicContact CG-CG2 4Å; I349-V360 HydrophobicContact CD1-CG2 3.92Å; S356-V360 WeakPolarHBondContact O-CG2 3.27Å; S356-V360 PolarHBondContact O-N 3.23Å; T357-V360 PolarHBondContact O-N 3.18Å; V360-Y362 VanDerWaalsContact C-N 3.3Å; V360-Y362 PolarHBondContact O-N 3.27Å; V360-N363 WeakPolarHBondContact O-CB 3.19Å; V360-N363 PolarHBondContact O-N 2.91Å; V360-N363 VanDerWaalsContact O-N 3.14Å; V360-L364 PolarHBondContact O-N 3.36Å
361L96.6Very high91.6Very high0 Ų050.2 Ų50.20%024%0.241CC..Hα-helixtrans-64.3-34.2-177.5-66.8-179.6000112.8L268 V272 L286 F290 L296 L299 T357 N363 L364 F365L268-L361 HydrophobicContact CD1-CB 4.09Å; L268-L361 HydrophobicContact CD2-CB 4.31Å; V272-L361 HydrophobicContact CG1-CD1 4.49Å; V272-L361 HydrophobicContact CG1-CD2 3.99Å; L286-L361 HydrophobicContact CD1-CD1 4.29Å; L286-L361 HydrophobicContact CD2-CD1 3.77Å; L286-L361 HydrophobicContact CG-CD1 4.49Å; F290-L361 HydrophobicContact CD1-CD2 4.4Å; F290-L361 HydrophobicContact CD2-CD1 4.05Å; F290-L361 HydrophobicContact CE1-CD2 3.93Å; F290-L361 HydrophobicContact CE2-CD1 3.72Å; F290-L361 HydrophobicContact CE2-CD2 4.38Å; F290-L361 HydrophobicContact CZ-CD1 4.08Å; F290-L361 HydrophobicContact CZ-CD2 3.93Å; L296-L361 HydrophobicContact CD2-CD2 3.94Å; L299-L361 HydrophobicContact CD2-CD2 4.24Å; T357-L361 HydrophobicContact CG2-CD1 3.98Å; T357-L361 HydrophobicContact CG2-CG 4.36Å; T357-L361 WeakPolarHBondContact O-CG 3.42Å; T357-L361 PolarHBondContact O-N 3.4Å; L361-N363 VanDerWaalsContact C-N 3.35Å; L361-L364 HydrophobicContact CD2-CD1 4.28Å; L361-L364 PolarHBondContact O-N 2.8Å; L361-F365 WeakPolarHBondContact O-CB 3.47Å; L361-F365 PolarHBondContact O-N 3.41Å
362Y94.3Very high90.7Very high107 Ų10757 Ų5742%0.4227%0.271SS..Hα-helixtrans-69-33.3176.1-175.3-94.7000112.7F250 L358 V360 F365 S366F250-Y362 HydrophobicContact CE2-CD1 4.05Å; F250-Y362 AromaticContact CE2-CG 3.95Å; F250-Y362 HydrophobicContact CE2-CG 3.95Å; F250-Y362 HydrophobicContact CZ-CD1 4.46Å; F250-Y362 HydrophobicContact CZ-CD2 4.33Å; F250-Y362 AromaticContact CZ-CG 3.9Å; F250-Y362 HydrophobicContact CZ-CG 3.9Å; L358-Y362 WeakPolarHBondContact O-CB 3.41Å; L358-Y362 PolarHBondContact O-N 3.34Å; V360-Y362 VanDerWaalsContact C-N 3.3Å; V360-Y362 PolarHBondContact O-N 3.27Å; Y362-F365 HydrophobicContact CD2-CD1 4.3Å; Y362-F365 HydrophobicContact CE2-CD1 4.26Å; Y362-F365 PolarHBondContact O-N 2.89Å; Y362-S366 VanDerWaalsContact CE1-OG 3.3Å; Y362-S366 WeakPolarHBondContact CE1-OG 3.31Å; Y362-S366 VanDerWaalsContact O-CB 3.31Å; Y362-S366 WeakPolarHBondContact O-CB 3.44Å; Y362-S366 PolarHBondContact O-N 2.88Å; Y362-S366 PolarHBondContact O-OG 2.48Å
363N92.8Very high90.7Very high55 Ų5557 Ų5729%0.29427%0.265SS..Hα-helixtrans-63.4-48.3173.1-164-15.8000110.4L339 R359 V360 L361 F365 S366 R367L339-N363 WeakPolarHBondContact CD2-OD1 3.35Å; R359-N363 PolarHBondContact O-N 2.96Å; R359-N363 VanDerWaalsContact O-N 3.15Å; V360-N363 WeakPolarHBondContact O-CB 3.19Å; V360-N363 PolarHBondContact O-N 2.91Å; V360-N363 VanDerWaalsContact O-N 3.14Å; L361-N363 VanDerWaalsContact C-N 3.35Å; N363-F365 PolarHBondContact O-N 2.9Å; N363-S366 PolarHBondContact O-N 2.83Å; N363-R367 PolarHBondContact O-N 3.44Å; N363-R367 VanDerWaalsContact O-N 3.12Å
364L95.4Very high91Very high1 Ų156.7 Ų56.71%0.00526%0.262CS..Hα-helixtrans-57.6-49.1173.1-62.3177.6000111.9F271 L299 M300 L303 M334 L339 V360 L361 S366 R367 Y368F271-L364 HydrophobicContact CE1-CB 4.06Å; F271-L364 HydrophobicContact CZ-CB 4.39Å; L299-L364 HydrophobicContact CD2-CD1 3.81Å; M300-L364 HydrophobicContact SD-CD2 3.41Å; M300-L364 WeakPolarHBondContact SD-CD2 3.22Å; L303-L364 HydrophobicContact CD1-CB 4.31Å; L303-L364 HydrophobicContact CD1-CD1 4.45Å; L303-L364 HydrophobicContact CD1-CD2 4.24Å; M334-L364 HydrophobicContact CE-CD1 3.99Å; M334-L364 HydrophobicContact CE-CD2 4.19Å; M334-L364 HydrophobicContact CE-CG 4.39Å; M334-L364 HydrophobicContact CG-CD2 3.96Å; M334-L364 HydrophobicContact SD-CD2 4.09Å; L339-L364 HydrophobicContact CD2-CD2 3.9Å; V360-L364 PolarHBondContact O-N 3.36Å; L361-L364 HydrophobicContact CD2-CD1 4.28Å; L361-L364 PolarHBondContact O-N 2.8Å; L364-S366 VanDerWaalsContact C-N 3.31Å; L364-S366 PolarHBondContact O-N 2.85Å; L364-R367 PolarHBondContact O-N 2.75Å; L364-Y368 HydrophobicContact CD2-CD2 4.42Å; L364-Y368 HydrophobicContact CD2-CE2 4.13Å; L364-Y368 VanDerWaalsContact O-CD2 3.27Å; L364-Y368 WeakPolarHBondContact O-CD2 3.31Å; L364-Y368 PolarHBondContact O-N 3.45Å
365F95.3Very high91Very high43 Ų4358.7 Ų58.719%0.18927%0.27CS..Hα-helixtrans-57-45.9177.6170.9-99.7000111.6T267 L268 F271 L361 Y362 N363 R367 Y368 R369T267-F365 HydrophobicContact CG2-CE2 4Å; T267-F365 HydrophobicContact CG2-CZ 3.92Å; L268-F365 HydrophobicContact CD2-CB 3.65Å; L268-F365 HydrophobicContact CD2-CG 4.04Å; F271-F365 HydrophobicContact CB-CD2 3.76Å; F271-F365 HydrophobicContact CB-CE2 4.36Å; F271-F365 HydrophobicContact CD1-CB 3.99Å; F271-F365 HydrophobicContact CD1-CD2 4.25Å; F271-F365 AromaticContact CD2-CD2 3.91Å; F271-F365 HydrophobicContact CD2-CD2 3.91Å; F271-F365 HydrophobicContact CE1-CB 4.15Å; F271-F365 HydrophobicContact CG-CB 4.29Å; F271-F365 AromaticContact CG-CD2 3.7Å; F271-F365 HydrophobicContact CG-CD2 3.7Å; F271-F365 HydrophobicContact CG-CG 4.5Å; L361-F365 WeakPolarHBondContact O-CB 3.47Å; L361-F365 PolarHBondContact O-N 3.41Å; Y362-F365 HydrophobicContact CD2-CD1 4.3Å; Y362-F365 HydrophobicContact CE2-CD1 4.26Å; Y362-F365 PolarHBondContact O-N 2.89Å; N363-F365 PolarHBondContact O-N 2.9Å; F365-R367 VanDerWaalsContact C-N 3.25Å; F365-R367 PolarHBondContact O-N 3.45Å; F365-Y368 PolarHBondContact O-N 3.21Å; F365-R369 HydrophobicContact CD2-CB 4.12Å; F365-R369 HydrophobicContact CE2-CB 3.9Å; F365-R369 HydrophobicContact CZ-CB 4.2Å; F365-R369 WeakPolarHBondContact O-CA 3.3Å; F365-R369 WeakPolarHBondContact O-CB 3.27Å; F365-R369 VanDerWaalsContact O-CG 3.31Å; F365-R369 WeakPolarHBondContact O-CG 3.47Å; F365-R369 PolarHBondContact O-N 3.31Å
366S91.8Very high91.1Very high58 Ų5859.6 Ų59.641%0.40628%0.275SS..Hα-helixtrans-61.5-36.6-178.3-62.70000112Y362 N363 L364Y362-S366 VanDerWaalsContact CE1-OG 3.3Å; Y362-S366 WeakPolarHBondContact CE1-OG 3.31Å; Y362-S366 VanDerWaalsContact O-CB 3.31Å; Y362-S366 WeakPolarHBondContact O-CB 3.44Å; Y362-S366 PolarHBondContact O-N 2.88Å; Y362-S366 PolarHBondContact O-OG 2.48Å; N363-S366 PolarHBondContact O-N 2.83Å; L364-S366 VanDerWaalsContact C-N 3.31Å; L364-S366 PolarHBondContact O-N 2.85Å
367R92.1Very high91Very high157 Ų15762.9 Ų62.959%0.59229%0.29SS*.Hα-helixtrans-79.2-44.4178.5-17762.2171.9180-1.7113.1L339 N363 L364 F365L339-R367 HydrophobicContact CD1-CG 4.48Å; L339-R367 HydrophobicContact CD2-CB 4.23Å; L339-R367 HydrophobicContact CG-CG 4.36Å; N363-R367 PolarHBondContact O-N 3.44Å; N363-R367 VanDerWaalsContact O-N 3.12Å; L364-R367 PolarHBondContact O-N 2.75Å; F365-R367 VanDerWaalsContact C-N 3.25Å; F365-R367 PolarHBondContact O-N 3.45Å
368Y94.1Very high90.7Very high11 Ų1166.9 Ų66.94%0.04331%0.307CS..Hα-helixtrans-112.76.4-166-57.5-85000115.3L303 E304 L339 L364 F365 N370 V371L303-Y368 HydrophobicContact CB-CD1 4.01Å; L303-Y368 HydrophobicContact CB-CD2 4.33Å; L303-Y368 HydrophobicContact CB-CE1 4.13Å; L303-Y368 HydrophobicContact CB-CE2 4.44Å; L303-Y368 HydrophobicContact CB-CG 4.12Å; L303-Y368 HydrophobicContact CD1-CD2 3.74Å; L303-Y368 HydrophobicContact CD1-CE2 4.16Å; L303-Y368 HydrophobicContact CD1-CG 4.1Å; L303-Y368 HydrophobicContact CD2-CD1 4.46Å; L303-Y368 HydrophobicContact CD2-CD2 4.48Å; L303-Y368 HydrophobicContact CD2-CG 4.01Å; L303-Y368 HydrophobicContact CG-CD2 4.4Å; L303-Y368 HydrophobicContact CG-CG 4.3Å; E304-Y368 WeakPolarHBondContact OE1-CE1 3.49Å; E304-Y368 VanDerWaalsContact OE1-CZ 3.32Å; E304-Y368 PolarHBondContact OE1-OH 3.07Å; L339-Y368 HydrophobicContact CD1-CE2 3.74Å; L339-Y368 VanDerWaalsContact CD1-OH 3.22Å; L339-Y368 WeakPolarHBondContact CD1-OH 3.12Å; L339-Y368 HydrophobicContact CD2-CE2 4.26Å; L364-Y368 HydrophobicContact CD2-CD2 4.42Å; L364-Y368 HydrophobicContact CD2-CE2 4.13Å; L364-Y368 VanDerWaalsContact O-CD2 3.27Å; L364-Y368 WeakPolarHBondContact O-CD2 3.31Å; L364-Y368 PolarHBondContact O-N 3.45Å; F365-Y368 PolarHBondContact O-N 3.21Å; Y368-N370 PolarHBondContact O-N 3.36Å; Y368-V371 HydrophobicContact CD1-CG2 3.95Å; Y368-V371 WeakPolarHBondContact O-CB 3.44Å; Y368-V371 PolarHBondContact O-N 3.12Å
369R89.4Confident90.5Very high147 Ų14771.6 Ų71.656%0.55533%0.329SS*.THydrogen-bonded Turntrans-48.5-26.4178.349177.5-97.1-175.6-6.4115.8F365F365-R369 HydrophobicContact CD2-CB 4.12Å; F365-R369 HydrophobicContact CE2-CB 3.9Å; F365-R369 HydrophobicContact CZ-CB 4.2Å; F365-R369 WeakPolarHBondContact O-CA 3.3Å; F365-R369 WeakPolarHBondContact O-CB 3.27Å; F365-R369 VanDerWaalsContact O-CG 3.31Å; F365-R369 WeakPolarHBondContact O-CG 3.47Å; F365-R369 PolarHBondContact O-N 3.31Å
370N86.7Confident90.3Very high128 Ų12873.5 Ų73.568%0.68434%0.341SS*.THydrogen-bonded Turntrans-101.10.5-177.7-55.1-27.3000113.2Y368Y368-N370 PolarHBondContact O-N 3.36Å
371V81.6Confident89.8Confident55 Ų5579.3 Ų79.333%0.33337%0.367SS..  trans-80.1136.8177.6178.20000109.4K274 Y368K274-V371 PolarHBondContact NZ-O 3.24Å; Y368-V371 HydrophobicContact CD1-CG2 3.95Å; Y368-V371 WeakPolarHBondContact O-CB 3.44Å; Y368-V371 PolarHBondContact O-N 3.12Å
372E67.4Low89.2Confident189 Ų18986.5 Ų86.588%0.88340%0.4SS*.  trans-85.50-174.6-70.7-167.7156.500114.4K278K278-E372 PolarHBondContact NZ-O 2.86Å; K278-E372 PolarHBondContact NZ-OXT 2.77Å

Retrieved 372 of 372 residues in 232.9 ms (Link to these results)