A0A096NNQ1_PAPAN Loading...

CCAAT/enhancer-binding protein

AlphaFold DB (A0A2K6ARK8), UniProt , Accession A0A096NNQ1, Species PAPAN (Papio anubis, Olive baboon), Gene CEBPB, Length 344 aa.

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(Predicted Aligned Error values between residue pairs)
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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
1M42.4Very low47.9Very low247 Ų247158.6 Ų158.6100%1.21784%0.837SS**  01120-74.1-175.9174.600108
2Q50.1Low48.6Very low185 Ų185158.1 Ų158.186%0.86483%0.834SS**  trans-71.7138.6167.7-63.1169.224.300108.3
3R48.3Very low48.8Very low245 Ų245155.2 Ų155.293%0.92583%0.83SS**  trans-165.1114.4144.8-107.4168.9-169.2-165.42.5109.7
4L47.9Very low49.1Very low165 Ų165155.6 Ų155.686%0.86483%0.831SS**  trans-57.9135.8171.5-69.9109.2000110.4A6L4-A6 PolarHBondContact O-N 3.22Å
5V56.8Low49.7Very low130 Ų130152.6 Ų152.679%0.78882%0.823SS**  trans-80.599.5160.6-179.70000106.3W7V5-W7 PolarHBondContact O-N 2.91Å
6A48.4Very low50.2Low90 Ų90150.3 Ų150.374%0.74482%0.818SS**PPolyproline II helixtrans-61.8123.217100000109L4L4-A6 PolarHBondContact O-N 3.22Å
7W46.1Very low50.8Low241 Ų241148.2 Ų148.291%0.91381%0.814SS**PPolyproline II helixtrans-77.3131.9163.8-8024.3000108.3V5V5-W7 PolarHBondContact O-N 2.91Å
8D44.3Very low50.9Low122 Ų122146.9 Ų146.965%0.65281%0.814SS**PPolyproline II helixtrans-58.2126.4177.8-177.2-3.8000111.2A10D8-A10 PolarHBondContact O-N 2.94Å; D8-A10 WeakPolarHBondContact OD1-CB 3.42Å; D8-A10 PolarHBondContact OD1-N 3Å
9P50.7Low50.6Low124 Ų124143.9 Ų143.981%0.80581%0.81SS**THydrogen-bonded Turntrans-78.310.3178.632.2-34.7000114.7
10A46.2Very low50.1Low76 Ų76146.4 Ų146.463%0.62881%0.812SS**THydrogen-bonded Turntrans-83.6-6.6-178.400000115.9D8 L12D8-A10 PolarHBondContact O-N 2.94Å; D8-A10 WeakPolarHBondContact OD1-CB 3.42Å; D8-A10 PolarHBondContact OD1-N 3Å; A10-L12 PolarHBondContact O-N 3.16Å
11C46Very low50Low120 Ų120148.7 Ų148.781%0.81181%0.814SS**  trans-100.573-179.1-71.10000112.3
12L56.2Low50.1Low152 Ų152142.1 Ų142.180%0.79679%0.792SS**PPolyproline II helixtrans-72137.4162.9-71.7168.4000109.6A10 L14A10-L12 PolarHBondContact O-N 3.16Å; L12-L14 PolarHBondContact O-N 3.02Å
13P51.3Low49.6Very low120 Ų120141.7 Ų141.778%0.77979%0.792SS**PPolyproline II helixtrans-66.4122.9171.325-29000109.4
14L53.4Low49.5Very low162 Ų162138.7 Ų138.785%0.84879%0.789SS**PPolyproline II helixtrans-51139.3172-68.8164.8000110.3L12L12-L14 PolarHBondContact O-N 3.02Å
15P58.2Low49.1Very low110 Ų110137 Ų13771%0.71479%0.785SS**PPolyproline II helixtrans-62.9144.7177.126-32.8000110.5
16P57.2Low48.3Very low115 Ų115134.1 Ų134.175%0.74777%0.774SS**PPolyproline II helixtrans-60.6141.1178.725.4-33.4000110.4
17P60.7Low47.9Very low115 Ų115136.6 Ų136.675%0.74778%0.775SS**PPolyproline II helixtrans-59.2148.2173.225.5-32.9000110A19P17-A19 PolarHBondContact O-N 2.87Å
18P52.7Low47.6Very low126 Ų126134.4 Ų134.482%0.81877%0.773SS**PPolyproline II helixtrans-57.1130.3-17823.9-33000109.8F20P18-F20 PolarHBondContact O-N 3.14Å
19A44.6Very low47.6Very low89 Ų89137.9 Ų137.974%0.73678%0.778SS**  trans-40.9129.4-17900000111.8P17 K21P17-A19 PolarHBondContact O-N 2.87Å; A19-K21 PolarHBondContact O-N 3.42Å
20F40.8Very low47.5Very low194 Ų194142.1 Ų142.185%0.85178%0.779SS**  trans-50.3112.1168.1-159.3-95.4000107.8P18 S22P18-F20 PolarHBondContact O-N 3.14Å; F20-S22 PolarHBondContact O-N 3.45Å; F20-S22 VanDerWaalsContact O-N 3.12Å
21K47.7Very low47.5Very low195 Ų195146.5 Ų146.585%0.84879%0.787SS**  trans-61.2118174.1-68.9178.9179.9179.50106.7A19 M23A19-K21 PolarHBondContact O-N 3.42Å; K21-M23 PolarHBondContact O-N 3.24Å; K21-M23 VanDerWaalsContact O-N 3.07Å
22S44.8Very low47.4Very low108 Ų108143.7 Ų143.776%0.75577%0.773SS**  trans-46.7119167.9-57.80000108.3F20 E24F20-S22 PolarHBondContact O-N 3.45Å; F20-S22 VanDerWaalsContact O-N 3.12Å; S22-E24 PolarHBondContact O-N 2.93Å
23M40.7Very low46.8Very low176 Ų176142.5 Ų142.587%0.86777%0.767SS**  trans-58.9107.7173.2-173152.362.700106.9K21 V25K21-M23 PolarHBondContact O-N 3.24Å; K21-M23 VanDerWaalsContact O-N 3.07Å; M23-V25 PolarHBondContact O-N 2.94Å; M23-V25 VanDerWaalsContact O-N 3.16Å
24E45Very low46.3Very low183 Ų183141.8 Ų141.886%0.85576%0.764SS**  trans-57.8120.6176.6-65.6-171148.600107.8S22 A26S22-E24 PolarHBondContact O-N 2.93Å; E24-A26 PolarHBondContact O-N 3.29Å
25V40.2Very low45.8Very low130 Ų130141.6 Ų141.679%0.78876%0.763SS**  trans-59.8109.4165165.30000105.7M23 N27M23-V25 PolarHBondContact O-N 2.94Å; M23-V25 VanDerWaalsContact O-N 3.16Å; V25-N27 PolarHBondContact O-N 2.78Å
26A40.2Very low45.2Very low68 Ų68139.8 Ų139.856%0.56276%0.757SS**  trans-53.2105.8168.500000108E24 F28E24-A26 PolarHBondContact O-N 3.29Å; A26-F28 HydrophobicContact CB-CD2 4.12Å; A26-F28 HydrophobicContact CB-CE2 3.98Å; A26-F28 PolarHBondContact O-N 3.42Å
27N38.8Very low44.7Very low143 Ų143138.8 Ų138.877%0.76576%0.758SS**  trans-62.591.9163-100.4-14.9000107V25 Y29V25-N27 PolarHBondContact O-N 2.78Å; N27-Y29 PolarHBondContact O-N 3.25Å
28F40.2Very low44.2Very low195 Ų195137.1 Ų137.186%0.85575%0.754SS**  trans-71.380.5160.9-81.3-83000108.1A26A26-F28 HydrophobicContact CB-CD2 4.12Å; A26-F28 HydrophobicContact CB-CE2 3.98Å; A26-F28 PolarHBondContact O-N 3.42Å
29Y43.8Very low43.7Very low194 Ų194141.4 Ų141.476%0.76176%0.755SS**  trans-118.182.4163.1-107.1-88.9000107.3N27N27-Y29 PolarHBondContact O-N 3.25Å
30Y49.6Very low43.4Very low213 Ų213141.2 Ų141.284%0.83576%0.763SS**  trans-112.9107.2156.8-132.8-95000104.8
31E45.2Very low43.3Very low168 Ų168135.6 Ų135.679%0.78576%0.759SS**SBendtrans156.836.8168.9-87.2-68.9165.100110
32A43.8Very low43.3Very low62 Ų62136.4 Ų136.451%0.51276%0.763SS.*SBendtrans-122.6-20170.700000113
33D43.9Very low43Very low127 Ų127136.1 Ų136.168%0.67977%0.767SS**THydrogen-bonded Turntrans-91.2-10.9-174.1-68.4-24.7000114.4L35D33-L35 VanDerWaalsContact C-N 3.26Å; D33-L35 PolarHBondContact O-N 3.09Å
34C40Very low43.2Very low105 Ų105132.4 Ų132.471%0.70976%0.764SS**THydrogen-bonded Turntrans-74.4-12.1176.5-69.60000114
35L44.1Very low43.3Very low158 Ų158130 Ų13083%0.82776%0.764SS**THydrogen-bonded Turntrans-104.9-13.2179.1-78.8165.6000114.1D33D33-L35 VanDerWaalsContact C-N 3.26Å; D33-L35 PolarHBondContact O-N 3.09Å
36A45.7Very low43.2Very low71 Ų71128.7 Ų128.759%0.58777%0.767SS**G310 helixtrans-83.5-15.8-178.200000113.7A38A36-A38 VanDerWaalsContact C-N 3.31Å; A36-A38 PolarHBondContact O-N 3.29Å
37A46.9Very low43.5Very low95 Ų95129.8 Ų129.879%0.78578%0.776SS**G310 helixtrans-78.4-7.1-178.500000114.7
38A50.6Low43.8Very low79 Ų79128.7 Ų128.765%0.65378%0.776SS**G310 helixtrans-93.1-11.1-174.300000115.1A36A36-A38 VanDerWaalsContact C-N 3.31Å; A36-A38 PolarHBondContact O-N 3.29Å
39Y40.3Very low44Very low216 Ų216125.6 Ų125.685%0.84778%0.776SS**  trans-132.893.5178.7-82.5-87.4000110.4
40G38.7Very low43.8Very low86 Ų86121.3 Ų121.389%0.88778%0.781SS**  trans-61.7134.5169.600000111.5
41G39.7Very low43.2Very low75 Ų75116 Ų11677%0.77378%0.781SS**  trans174.591.6174.700000113.6
42K46.7Very low43Very low213 Ų213119.4 Ų119.493%0.92679%0.787SS**  trans-15.7122.8170.9-60.8-170.5175.4-167.90117.7
43A38.3Very low42.9Very low102 Ų102122.8 Ų122.884%0.84380%0.803SS**  trans-165.1125.613900000110.5
44A45.9Very low42.9Very low97 Ų97119.9 Ų119.980%0.80280%0.803SS**PPolyproline II helixtrans-76.7148.717300000111
45P47.2Very low43.1Very low134 Ų134121.2 Ų121.287%0.8781%0.811SS**PPolyproline II helixtrans-82125.5177.730.7-31.4000111.9
46A37.5Very low43.3Very low102 Ų102125.1 Ų125.184%0.84381%0.814SS**PPolyproline II helixtrans-80.3135.8168.800000110.7
47A46.3Very low43.1Very low91 Ų91127.3 Ų127.375%0.75282%0.823SS**PPolyproline II helixtrans-70.4154178.100000113.1
48P45Very low43.2Very low119 Ų119129 Ų12977%0.77383%0.825SS**PPolyproline II helixtrans-79.5148178.131.4-33.4000112.8
49P45Very low43Very low131 Ų131130.5 Ų130.585%0.85184%0.838SS**PPolyproline II helixtrans-78.8139.8-17930.5-33.2000113.2
50A40.2Very low43.3Very low103 Ų103123.6 Ų123.685%0.85183%0.833SS**PPolyproline II helixtrans-65.7132.4175.800000112.7
51A36.1Very low43.1Very low102 Ų102128.7 Ų128.784%0.84383%0.834SS**PPolyproline II helixtrans-81.8133.5172.900000111.4
52R40.4Very low43.7Very low240 Ų240134.3 Ų134.391%0.90685%0.845SS**PPolyproline II helixtrans-79.1150.8172.5-75.3176.6161.2-118.6-0.2111.4
53P43.4Very low43.3Very low133 Ų133127 Ų12786%0.86483%0.83SS**PPolyproline II helixtrans-88.6133179.534.4-29.9000111.9
54G43Very low43.9Very low66 Ų66127.4 Ų127.468%0.6883%0.827SS**PPolyproline II helixtrans-97.7163.6168.700000112.5
55P45.2Very low43.9Very low133 Ų133131.7 Ų131.786%0.86483%0.834SS**PPolyproline II helixtrans-78.6139.5-165.231.4-33.1000113.3
56R48.2Very low44.1Very low240 Ų240126.8 Ų126.891%0.90681%0.807SS**PPolyproline II helixtrans-77.8137.3171.7-79.2-174-83.3-161.4-5.1111.1
57P41.5Very low44.8Very low117 Ų117128.7 Ų128.776%0.7680%0.803SS**PPolyproline II helixtrans-84156.4162.533.2-29.6000111.6
58P47.5Very low45.1Very low129 Ų129133.3 Ų133.384%0.83881%0.809SS**PPolyproline II helixtrans-79.1153.5-169.931.8-34.5000113.6
59A46.4Very low45.7Very low111 Ų111136 Ų13692%0.91781%0.811SS**PPolyproline II helixtrans-70.4130.2177.200000111.8
60G46.8Very low46.7Very low72 Ų72140.7 Ų140.774%0.74281%0.812SS**  trans149.583.4164.400000113.8
61E34.9Very low48.2Very low193 Ų193140.1 Ų140.190%0.90281%0.807SS**  trans-171.6110.1143.5-118.3179.1152.600109.8G63E61-G63 VanDerWaalsContact C-N 3.3Å; E61-G63 PolarHBondContact O-N 3.41Å; E61-G63 VanDerWaalsContact O-N 3.1Å
62L51.7Low49.9Very low193 Ų193141.4 Ų141.4100%1.0180%0.799SS**  trans-75.485.9164.3-80.5161.1000107.5
63G38.7Very low51.4Low60 Ų60134.9 Ų134.962%0.61978%0.782SS**  trans-110101.217600000111.8E61E61-G63 VanDerWaalsContact C-N 3.3Å; E61-G63 PolarHBondContact O-N 3.41Å; E61-G63 VanDerWaalsContact O-N 3.1Å
64S50.2Low52.7Low110 Ų110134.9 Ų134.977%0.76977%0.768SS**  trans40.180150.4-139.80000118.5G66S64-G66 PolarHBondContact O-N 2.9Å
65I46Very low54.1Low187 Ų187135.5 Ų135.596%0.95976%0.763SS**  trans-90.966.4153.8-59.1166.3000106.8
66G51.3Low55.6Low30 Ų30133.9 Ų133.931%0.30975%0.752SS.*  trans-150.479.6179.800000106.6S64S64-G66 PolarHBondContact O-N 2.9Å
67D52.3Low56.5Low142 Ų142132 Ų13276%0.75975%0.746SS**SBendtrans17281.8160.7-85.6-34.9000106.7
68H53.3Low57.8Low189 Ų189132.7 Ų132.788%0.87574%0.743SS**  trans178.236.2149.4-77.2-24.9000111.2R70H68-R70 PolarHBondContact O-N 3.41Å
69E57.5Low58.3Low174 Ų174135 Ų13581%0.81374%0.743SS**  trans-92.876.2170.157-163.3140.300110.3A71E69-A71 PolarHBondContact O-N 3Å
70R66.5Low59.1Low231 Ų231135.7 Ų135.787%0.87274%0.737SS**  trans-74.188.5156-76.9-169.8-72-98.4-0.9106.8H68 I72H68-R70 PolarHBondContact O-N 3.41Å; R70-I72 PolarHBondContact O-N 3.23Å
71A72.1Confident59.3Low90 Ų90140.7 Ų140.774%0.74475%0.746SS**  trans-53.4135.3168.400000108.8E69 D73E69-A71 PolarHBondContact O-N 3Å; A71-D73 PolarHBondContact O-N 3.43Å
72I71.6Confident60Low130 Ų130135.1 Ų135.167%0.66774%0.741SS**  trans-68.5115.9172.7-61.5173.2000106.4R70 F74R70-I72 PolarHBondContact O-N 3.23Å; I72-F74 HydrophobicContact CB-CD2 4.45Å; I72-F74 HydrophobicContact CB-CE2 3.83Å; I72-F74 HydrophobicContact CB-CZ 4.1Å; I72-F74 HydrophobicContact CG2-CD2 4.29Å; I72-F74 HydrophobicContact CG2-CE1 4.14Å; I72-F74 HydrophobicContact CG2-CE2 3.85Å; I72-F74 HydrophobicContact CG2-CZ 3.77Å; I72-F74 WeakPolarHBondContact O-CD2 3.29Å; I72-F74 WeakPolarHBondContact O-CE2 3.43Å; I72-F74 PolarHBondContact O-N 3.1Å
73D71.8Confident59.4Low103 Ų103130.6 Ų130.655%0.55173%0.731SS**  trans-74.6108.1176.2-177.113.8000109.6A71 S75 P76A71-D73 PolarHBondContact O-N 3.43Å; D73-S75 VanDerWaalsContact C-N 3.33Å; D73-S75 WeakPolarHBondContact OD1-CB 3.29Å; D73-S75 PolarHBondContact OD1-N 3.49Å; D73-S75 PolarHBondContact OD1-OG 3.16Å; D73-P76 VanDerWaalsContact O-CD 3.32Å; D73-P76 WeakPolarHBondContact O-CD 3.46Å
74F69.9Low59.7Low132 Ų132134 Ų13458%0.57974%0.742SS**  trans-88-0.3176.5-67.8-84.5000112.8I72 P76 Y77 L78I72-F74 HydrophobicContact CB-CD2 4.45Å; I72-F74 HydrophobicContact CB-CE2 3.83Å; I72-F74 HydrophobicContact CB-CZ 4.1Å; I72-F74 HydrophobicContact CG2-CD2 4.29Å; I72-F74 HydrophobicContact CG2-CE1 4.14Å; I72-F74 HydrophobicContact CG2-CE2 3.85Å; I72-F74 HydrophobicContact CG2-CZ 3.77Å; I72-F74 WeakPolarHBondContact O-CD2 3.29Å; I72-F74 WeakPolarHBondContact O-CE2 3.43Å; I72-F74 PolarHBondContact O-N 3.1Å; F74-P76 VanDerWaalsContact C-N 3.27Å; F74-Y77 PolarHBondContact O-N 3.47Å; F74-L78 PolarHBondContact O-N 3.45Å
75S72.7Confident59Low80 Ų80138.1 Ų138.156%0.55975%0.75SS**G310 helixtrans-54.1-32.6177.5-51.60000114.5D73 Y77 L78D73-S75 VanDerWaalsContact C-N 3.33Å; D73-S75 WeakPolarHBondContact OD1-CB 3.29Å; D73-S75 PolarHBondContact OD1-N 3.49Å; D73-S75 PolarHBondContact OD1-OG 3.16Å; S75-Y77 PolarHBondContact O-N 3.35Å; S75-L78 PolarHBondContact O-N 3.27Å
76P77.3Confident58.5Low98 Ų98133.4 Ų133.464%0.63674%0.739SS**G310 helixtrans-68.3-14.4175.6-2133.9000114.8D73 F74D73-P76 VanDerWaalsContact O-CD 3.32Å; D73-P76 WeakPolarHBondContact O-CD 3.46Å; F74-P76 VanDerWaalsContact C-N 3.27Å
77Y67.4Low58.2Low201 Ų201138.3 Ų138.379%0.78877%0.765SS**G310 helixtrans-111-1.4-177.7-63.2-80000113.3F74 S75 E79F74-Y77 PolarHBondContact O-N 3.47Å; S75-Y77 PolarHBondContact O-N 3.35Å; Y77-E79 PolarHBondContact O-N 3.13Å
78L68.7Low57.2Low132 Ų132136.1 Ų136.169%0.69177%0.766SS**  trans-93.582.3171.5-87.7150.1000108.7F74 S75 P80F74-L78 PolarHBondContact O-N 3.45Å; S75-L78 PolarHBondContact O-N 3.27Å; L78-P80 WeakPolarHBondContact O-CD 3.32Å
79E57.6Low56.8Low178 Ų178133.2 Ų133.283%0.83276%0.764SS**  trans-71.4123.3170.8-167.6149.8-146.900109.5Y77 L81Y77-E79 PolarHBondContact O-N 3.13Å; E79-L81 PolarHBondContact O-N 2.97Å
80P63.7Low55.8Low124 Ų124129.6 Ų129.681%0.80576%0.764SS**  trans-67.2106.7-177.3-21.833.8000111.8L78 G82L78-P80 WeakPolarHBondContact O-CD 3.32Å; P80-G82 PolarHBondContact O-N 3.39Å; P80-G82 VanDerWaalsContact O-N 3.16Å
81L50.3Low54.2Low177 Ų177125.4 Ų125.493%0.92776%0.764SS**  trans-70.3104.9163.9-79.4165.7000109.4E79E79-L81 PolarHBondContact O-N 2.97Å
82G49.3Very low52.4Low77 Ų77125.6 Ų125.679%0.79477%0.766SS**  trans81.8103.2153.700000116.5P80P80-G82 PolarHBondContact O-N 3.39Å; P80-G82 VanDerWaalsContact O-N 3.16Å
83A40.2Very low50.7Low98 Ų98126.6 Ų126.681%0.8178%0.779SS**  trans-140.8140.4151.100000110.3
84P43.7Very low48.9Very low131 Ų131128.6 Ų128.685%0.85179%0.789SS**PPolyproline II helixtrans-79.7131.6-171.932-32.7000111.4
85Q36.7Very low47.2Very low197 Ų197128 Ų12892%0.92180%0.796SS**PPolyproline II helixtrans-85.4116.2175.7-160.8174.622.600109.7
86A34.8Very low45.4Very low88 Ų88132.8 Ų132.873%0.72781%0.807SS**PPolyproline II helixtrans-92.5153164.900000110
87P44.1Very low43.4Very low132 Ų132136.3 Ų136.386%0.85782%0.816SS**PPolyproline II helixtrans-93.4152.8-151.135.9-33.7000114
88A32.8Very low41.8Very low96 Ų96131.2 Ų131.279%0.79382%0.815SS**  trans-122.3157.6169.400000110.1
89P43.8Very low40.2Very low128 Ų128129.3 Ų129.383%0.83182%0.818SS**  trans-91.6162.3-14135.1-35.9000115.7
90A36.9Very low40Very low98 Ų98126.4 Ų126.481%0.8182%0.815SS**  trans-57.8139.1179.100000114.5
91T33Very low39.6Very low143 Ų143126.2 Ų126.288%0.87781%0.813SS**  trans-130.7127.8143.644.60000109.3
92A34.9Very low39Very low94 Ų94122 Ų12278%0.77781%0.805SS**  trans-70.7138.9-178.700000111.7
93T35.5Very low38.9Very low152 Ų152124.6 Ų124.693%0.93381%0.807SS**  trans-140.7146.7134.144.80000108
94D33.5Very low39Very low145 Ų145124.4 Ų124.478%0.77581%0.806SS**  trans-114.4159.9-152.2-154.2-41.1000108.9
95T33.9Very low39.2Very low119 Ų119124.3 Ų124.373%0.7381%0.805SS**  trans76.7120.6157.2-28.10000116.4
96F34.6Very low39.2Very low180 Ų180119.6 Ų119.679%0.78980%0.8SS**  cis-162.8134.738.1-162.8-108.4000105.8
97E36.4Very low39.4Very low173 Ų173121.3 Ų121.381%0.80880%0.803SS**  179.714572.8-168.4168.9150.900108.5
98A33.4Very low39.4Very low93 Ų93120 Ų12077%0.76980%0.804SS**  trans-104.8127.7-169.100000114.4
99A36Very low39.6Very low93 Ų93120.9 Ų120.977%0.76980%0.804SS**  trans45.2171.6130.700000122.1
100P53.2Low39.6Very low117 Ų117119.6 Ų119.676%0.7680%0.798SS**  cis-142.3-152.33.938.5-13.8000114
101P55.5Low39.5Very low119 Ų119118.4 Ų118.477%0.77380%0.796SS**  -121.7171.5-60.731.6-12.9000114.4
102A37.8Very low40Very low90 Ų90119.4 Ų119.474%0.74479%0.79SS**  trans-61.3173.9175.700000115.9
103P45.4Very low40.5Very low131 Ų131122.4 Ų122.485%0.85179%0.788SS**  -129158.1113.737.1-28.9000113.9
104A42.5Very low41.1Very low94 Ų94122.5 Ų122.578%0.77778%0.778SS**  trans-85.9-165.5-170.800000113.3
105P49.4Very low42Very low129 Ų129119.5 Ų119.584%0.83876%0.762SS**  -106.1157-123.324.2-1.7000114.2
106A35.4Very low43.3Very low98 Ų98122 Ų12281%0.8176%0.763SS**  trans-138.5156.9173.900000110.9
107P39.3Very low44.5Very low123 Ų123119.1 Ų119.180%0.79976%0.755SS**  trans-88.9163.2-133.134.4-36.8000115.1S109P107-S109 PolarHBondContact O-N 2.93Å
108A45.1Very low45.4Very low106 Ų106114 Ų11488%0.87674%0.739SS**  trans-34.6114.7172.400000113.9
109S35Very low46.6Very low113 Ų113114.4 Ų114.479%0.7973%0.728SS**  trans-96.6109.8156.1177.40000106.8P107 G111P107-S109 PolarHBondContact O-N 2.93Å; S109-G111 PolarHBondContact O-N 2.57Å
110S43.8Very low47.9Very low101 Ų101115.3 Ų115.371%0.70672%0.719SS**  trans-53.598166.752.10000109.1Q112S110-Q112 PolarHBondContact O-N 3.41Å
111G35.6Very low48.1Very low74 Ų74117.4 Ų117.476%0.76372%0.716SS**  trans-59.6103.9164.100000107.5S109 H113S109-G111 PolarHBondContact O-N 2.57Å; G111-H113 PolarHBondContact O-N 2.71Å
112Q43.5Very low48.3Very low163 Ų163115.7 Ų115.776%0.76271%0.707SS**  trans-57.1109.3170.2-69.9-175.8-58.900107.1S110 H114S110-Q112 PolarHBondContact O-N 3.41Å; Q112-H114 PolarHBondContact O-N 2.79Å
113H45.1Very low48.9Very low158 Ų158117.7 Ų117.773%0.73171%0.705SS**  trans-62.493158.3-170.6-99.5000105.3G111 D115G111-H113 PolarHBondContact O-N 2.71Å; H113-D115 VanDerWaalsContact C-N 3.29Å; H113-D115 IonicContact CE1-OD1 2.99Å; H113-D115 PolarHBondContact CE1-OD1 2.95Å; H113-D115 VanDerWaalsContact CE1-OD1 3.29Å; H113-D115 IonicContact ND1-OD1 2.77Å; H113-D115 PolarHBondContact ND1-OD1 3.01Å; H113-D115 PolarHBondContact O-N 3.25Å
114H48.3Very low49.3Very low153 Ų153118.1 Ų118.171%0.70870%0.7SS**  trans-6699171.3-122.3-84.3000105.4Q112 F116Q112-H114 PolarHBondContact O-N 2.79Å; H114-F116 PolarHBondContact O-N 2.96Å
115D53.1Low49.9Very low83 Ų83124.4 Ų124.444%0.44471%0.705SS.*  trans-60.2106.9176.6-72.5-44.8000107.6H113 L117 S118H113-D115 VanDerWaalsContact C-N 3.29Å; H113-D115 IonicContact CE1-OD1 2.99Å; H113-D115 PolarHBondContact CE1-OD1 2.95Å; H113-D115 VanDerWaalsContact CE1-OD1 3.29Å; H113-D115 IonicContact ND1-OD1 2.77Å; H113-D115 PolarHBondContact ND1-OD1 3.01Å; H113-D115 PolarHBondContact O-N 3.25Å; D115-L117 PolarHBondContact O-N 3.33Å; D115-S118 WeakPolarHBondContact O-CB 3.06Å; D115-S118 PolarHBondContact O-N 3.15Å
116F61.6Low49.4Very low172 Ų172121.7 Ų121.775%0.75470%0.701SS**Hα-helixtrans-49.5-25.5174.8176.9-97.3000112.4H114H114-F116 PolarHBondContact O-N 2.96Å
117L59.6Low49.8Very low118 Ų118120.2 Ų120.262%0.61870%0.695SS**Hα-helixtrans-72.9-27.3175.7-60.5178.1000113.3D115 F121D115-L117 PolarHBondContact O-N 3.33Å; L117-F121 WeakPolarHBondContact O-CD2 3.47Å
118S55.8Low50.2Low67 Ų67123.9 Ų123.947%0.46970%0.699SS.*Hα-helixtrans-75.6-26.5179.5-610000113.2D115 S122D115-S118 WeakPolarHBondContact O-CB 3.06Å; D115-S118 PolarHBondContact O-N 3.15Å; S118-S122 WeakPolarHBondContact O-CB 3.38Å; S118-S122 PolarHBondContact O-N 3.49Å; S118-S122 PolarHBondContact O-OG 3.48Å
119D58.7Low49.9Very low101 Ų101126.6 Ų126.654%0.5470%0.699SS.*Hα-helixtrans-71.3-40.9175.2-155.736000110.7F121 S122D119-F121 PolarHBondContact O-N 3.06Å; D119-F121 VanDerWaalsContact O-N 3.14Å; D119-S122 PolarHBondContact O-N 3.33Å
120L62.1Low50.4Low112 Ų112127.7 Ų127.759%0.58671%0.705SS**Hα-helixtrans-62.4-25.4-178.8-166.866.7000114.3
121F58.4Low50.5Low161 Ų161132.7 Ų132.771%0.70671%0.714SS**THydrogen-bonded Turntrans-101.7-6.7177.1-67.6-72.2000113.6L117 D119L117-F121 WeakPolarHBondContact O-CD2 3.47Å; D119-F121 PolarHBondContact O-N 3.06Å; D119-F121 VanDerWaalsContact O-N 3.14Å
122S59.7Low50.9Low82 Ų82138.7 Ų138.757%0.57372%0.719SS**THydrogen-bonded Turntrans-86.4-24.3-179.9-65.10000112.8S118 D119 D124S118-S122 WeakPolarHBondContact O-CB 3.38Å; S118-S122 PolarHBondContact O-N 3.49Å; S118-S122 PolarHBondContact O-OG 3.48Å; D119-S122 PolarHBondContact O-N 3.33Å; S122-D124 VanDerWaalsContact C-N 3.31Å; S122-D124 PolarHBondContact O-N 2.96Å
123D49.5Very low50.9Low132 Ų132137 Ų13771%0.70672%0.722SS**THydrogen-bonded Turntrans-69.9-20-176.7-84-44000114.8
124D54.7Low50.6Low140 Ų140134.1 Ų134.175%0.74973%0.725SS**THydrogen-bonded Turntrans-88.7-3.4-174.4-91.9-71.9000115.2S122S122-D124 VanDerWaalsContact C-N 3.31Å; S122-D124 PolarHBondContact O-N 2.96Å
125Y54.5Low50.4Low226 Ų226136 Ų13689%0.88674%0.735SS**SBendtrans-127.121.8-174.5-92-82.6000116.8
126G38.3Very low49.6Very low72 Ų72143 Ų14374%0.74276%0.756SS**  trans-117.582.1176.800000114.3
127G43.7Very low48.5Very low67 Ų67138 Ų13869%0.69175%0.754SS**  trans-66.6159-170.900000117.9
128K47.5Very low47.2Very low201 Ų201142.5 Ų142.587%0.87476%0.764SS**  trans-179.694.6139.1-93154.2-166.9-179.70111.1
129N38.8Very low46.4Very low163 Ų163145.5 Ų145.587%0.87278%0.779SS**  trans160.1100134-85.4-5.9000110.4K131N129-K131 PolarHBondContact O-N 3.43Å
130C45.3Very low45.4Very low136 Ų136146 Ų14692%0.91979%0.791SS**  trans-68.7115.4170.9-59.40000110.7
131K47Very low44.6Very low206 Ų206148.9 Ų148.990%0.89681%0.806SS**  trans-136.6100.2150.9-101.2171.2179.4170.70108.4N129N129-K131 PolarHBondContact O-N 3.43Å
132K44.7Very low43.4Very low199 Ų199144.7 Ų144.787%0.86581%0.807SS**  trans26.9119.1162.5-57.1-177.8-179178.20118
133P42.5Very low42.2Very low129 Ų129152.6 Ų152.684%0.83883%0.825SS**PPolyproline II helixtrans-86.6132152.632.4-25.9000110.2
134A39.3Very low41.8Very low96 Ų96154.6 Ų154.679%0.79384%0.835SS**PPolyproline II helixtrans-61.4139.8164.700000109.9Y136A134-Y136 PolarHBondContact O-N 2.91Å
135E44Very low40.8Very low194 Ų194151.4 Ų151.491%0.90784%0.835SS**PPolyproline II helixtrans-57.3120.6171.5-168.8-178.4-161.600110.3
136Y36.8Very low39.9Very low228 Ų228146 Ų14689%0.89484%0.837SS**  trans-136.4113.4161.3-154.3-96.1000108.9A134A134-Y136 PolarHBondContact O-N 2.91Å
137G37Very low39.8Very low68 Ų68147.5 Ų147.570%0.70184%0.842SS**  trans-67.9129.2-169.700000113.6
138Y31.9Very low39.5Very low213 Ų213154.7 Ų154.784%0.83585%0.854SS**  trans-94.4114162.1-164.1-95.2000108.6S140Y138-S140 PolarHBondContact O-N 3.17Å; Y138-S140 VanDerWaalsContact O-N 3.13Å
139V41Very low38.8Very low130 Ų130148.7 Ų148.779%0.78885%0.85SS**  trans-61.8111.4173.4-107.80000109.2L141V139-L141 PolarHBondContact O-N 3.46Å
140S37.5Very low38.6Very low112 Ų112145.4 Ų145.478%0.78385%0.845SS**  trans-77.3109.5171.5-640000109.3Y138 G142Y138-S140 PolarHBondContact O-N 3.17Å; Y138-S140 VanDerWaalsContact O-N 3.13Å; S140-G142 PolarHBondContact O-N 2.92Å
141L43.8Very low38.1Very low172 Ų172147.4 Ų147.490%0.90185%0.846SS**  trans-73108.6164.9-11291.4000108.9V139V139-L141 PolarHBondContact O-N 3.46Å
142G33.5Very low37.6Very low72 Ų72146 Ų14674%0.74284%0.842SS**  trans-62.2129.1172.600000112S140 L144S140-G142 PolarHBondContact O-N 2.92Å; G142-L144 PolarHBondContact O-N 3.2Å
143R34.3Very low37.8Very low248 Ų248142 Ų14294%0.93684%0.836SS**  trans-81.5102.5170.6-169.5-175-153.2-162.86.6108.3
144L42.1Very low37.4Very low175 Ų175139 Ų13992%0.91683%0.829SS**PPolyproline II helixtrans-88.8119.9168.4-80.7168.6000109.9G142G142-L144 PolarHBondContact O-N 3.2Å
145G33.3Very low37.5Very low73 Ų73141.3 Ų141.375%0.75384%0.837SS**PPolyproline II helixtrans-72.7155.7179.200000113.5
146A34.9Very low37.1Very low112 Ų112142 Ų14293%0.92684%0.838SS**PPolyproline II helixtrans-70.8137.3174.700000112.2
147A36.9Very low37.3Very low104 Ų104135.3 Ų135.386%0.8683%0.83SS**  trans-139.6130.7155.900000109.5
148K38.2Very low37.9Very low217 Ų217137.7 Ų137.794%0.94383%0.833SS**  trans-72.4150.4176.8-79.2-179.7167.41800111.6
149G31.4Very low38.5Very low75 Ų75135.8 Ų135.877%0.77384%0.837SS**  trans148.498.7144.500000118.7
150A34.6Very low39Very low94 Ų94138.3 Ų138.378%0.77784%0.839SS**  trans67.6122.9134.700000124.2
151L34.8Very low40.3Very low178 Ų178138.2 Ų138.293%0.93284%0.836SS**  trans73.5126137.1-66.5160.6000122
152H36.7Very low41.4Very low178 Ų178135.7 Ų135.782%0.82483%0.83SS**  trans-80.2178.4170.7-135-113.7000110.7
153P49.5Very low42.9Very low114 Ų114138 Ų13874%0.7483%0.832SS**  cis-139.4163.94.941.9-23.5000117.4
154G34.3Very low44.8Very low67 Ų67131.9 Ų131.969%0.69182%0.824SS**  trans95.4109.2144.200000117.8
155C40.3Very low46.1Very low143 Ų143129.1 Ų129.197%0.96682%0.817SS**  trans-164.2139.8143-93.20000110.1
156F36.7Very low47.6Very low208 Ų208131.3 Ų131.391%0.91282%0.818SS**  trans-95128.5-168.2-124.7-104.7000111
157A40.3Very low49.2Very low88 Ų88131.6 Ų131.673%0.72781%0.81SS**  trans56.3168147.600000121.1
158P49.9Very low50.5Low118 Ų118132.2 Ų132.277%0.76681%0.805SS**  cis-128166.5-8.326.4-3.4000116
159L44Very low51.1Low174 Ų174128.1 Ų128.191%0.91180%0.801SS**  trans-32.9127.1169.9-65.2152.1000116.9
160H51.6Low51.7Low183 Ų183129.2 Ų129.285%0.84780%0.802SS**  trans-109.3131.9161-123.1-111.4000109
161P65.3Low51.8Low109 Ų109133.9 Ų133.971%0.70881%0.808SS**PPolyproline II helixtrans-75.8151.1178.430-32.9000112.1
162P65.9Low52.1Low119 Ų119133.9 Ų133.977%0.77381%0.808SS**PPolyproline II helixtrans-72.9152.7178.730.6-34.8000112.5
163P66.6Low52Low121 Ų121135.3 Ų135.379%0.78681%0.812SS**PPolyproline II helixtrans-71.8151.4-178.829.8-35000113
164P72.3Confident51.3Low119 Ų119134.6 Ų134.677%0.77382%0.816SS**PPolyproline II helixtrans-74.3155.1-17830.3-35000113.6
165P70.9Confident51.6Low117 Ų117139.5 Ų139.576%0.7682%0.821SS**PPolyproline II helixtrans-73.3154.9178.930.2-34.8000113.3
166P64.4Low51.7Low120 Ų120138.9 Ų138.978%0.77982%0.815SS**PPolyproline II helixtrans-73151.1-178.329.7-34.7000113.4
167P68.2Low51.4Low117 Ų117131.9 Ų131.976%0.7680%0.801SS**PPolyproline II helixtrans-75.5154.2-178.531-34.9000113.2
168P63.6Low51Low118 Ų118136.2 Ų136.277%0.76680%0.804SS**PPolyproline II helixtrans-72.6148.6179.430.5-34.7000112.2
169P52Low50.3Low131 Ų131138 Ų13885%0.85180%0.802SS**PPolyproline II helixtrans-70.6136.3178.127.7-32.3000111.8
170A43.4Very low50.3Low97 Ų97134.5 Ų134.580%0.80279%0.79SS**PPolyproline II helixtrans-67146.2-177.700000113.6L172A170-L172 PolarHBondContact O-N 3.05Å
171E36.1Very low49.6Very low193 Ų193131 Ų13190%0.90279%0.793SS**PPolyproline II helixtrans-54.3124.3172.5-61.8176.8144.400112
172L41Very low48.1Very low178 Ų178132.8 Ų132.893%0.93280%0.796SS**  trans-107.1106.7159-78.8173.2000108.8A170A170-L172 PolarHBondContact O-N 3.05Å
173K35.5Very low46.4Very low208 Ų208132.8 Ų132.890%0.90480%0.797SS**  trans-69.6114.2174.2-167.9172.2-173.9169.90109.5
174A35Very low44.8Very low99 Ų99136.4 Ų136.482%0.81880%0.801SS**  trans-151.7100162.500000109.8
175E40.8Very low43Very low169 Ų169141.6 Ų141.679%0.7981%0.805SS**  trans-77.1146.5159.6-81.1-73.3153.100108.5
176P41.9Very low41.2Very low130 Ų130145.7 Ų145.784%0.84481%0.811SS**  -148.7137.487.632.8-12.8000116.7
177G31Very low39.8Very low61 Ų61147.1 Ų147.163%0.62981%0.807SS**  95.189.3121.300000119.7
178F32Very low38.3Very low179 Ų179149.1 Ų149.179%0.78581%0.806SS**  30.3119.4129.6-128.3-97.7000121.8
179E34.8Very low37.1Very low157 Ų157148 Ų14873%0.73481%0.807SS**  168.1125.8117.8-92-65.815200111.5
180P43.3Very low36Very low100 Ų100145.6 Ų145.665%0.64981%0.806SS**  trans-103.9115.9170.633.7-21.9000111.5D182P180-D182 PolarHBondContact O-N 2.94Å
181A37.5Very low35.7Very low109 Ų109145.5 Ų145.590%0.90181%0.805SS**  trans-91.499.4174.200000111.9
182D34.4Very low36.3Very low147 Ų147142.6 Ų142.679%0.78680%0.803SS**  trans-81137.5151.8-83.5-60.7000109.7P180P180-D182 PolarHBondContact O-N 2.94Å
183C29.5Very low35.9Very low118 Ų118138 Ų13880%0.79780%0.798SS**  160.7138.7124.4-85.70000115.5
184K32.3Very low35.6Very low197 Ų197132 Ų13286%0.85780%0.796SS**  trans84.298.8137.8-82.8-175.3174.5174.90121.4
185R34.8Very low35.3Very low228 Ų228131 Ų13186%0.8680%0.795SS**  -23128.5122.4-179.2-175.1-67.4-158.2-1.1113.6
186K33.8Very low34.9Very low204 Ų204128.4 Ų128.489%0.88780%0.803SS**  trans-143.1116.8153-161.8177.3179.6-172.90109.4
187E35.8Very low34.5Very low149 Ų149125.8 Ų125.870%0.69680%0.8SS**  trans-93.1168.5166.2-157.7174.4171.100108.3
188E35.3Very low35Very low159 Ų159132 Ų13274%0.74382%0.815SS**  trans99.1101.8169-61.4-66.4151.600118.9
189A37.9Very low35.2Very low95 Ų95128.1 Ų128.179%0.78582%0.815SS**  65126121.200000121.7
190G31Very low35.3Very low80 Ų80125.9 Ų125.983%0.82582%0.824SS**  trans167.880.4161.900000113.8
191A36.4Very low34.8Very low95 Ų95124.3 Ų124.379%0.78583%0.826SS**  trans-85.4170.4152.500000108.5
192P49.3Very low34.6Very low132 Ų132129.4 Ų129.486%0.85783%0.828SS**  cis-139.4175.211.439.3-19.8000115.7
193G31.9Very low35.3Very low81 Ų81127.8 Ų127.884%0.83583%0.825SS**  trans129.4116.4141.200000117.8
194G28.6Very low35.8Very low83 Ų83132.5 Ų132.586%0.85683%0.828SS**  trans109.699134.700000118.8
195G28.6Very low36.5Very low77 Ų77127.7 Ų127.779%0.79483%0.825SS**  90.7109.2120.200000120.8
196A32.3Very low37Very low115 Ų115123.4 Ų123.495%0.9582%0.818SS**  trans73.4135.8137.200000121.2
197G33.7Very low37.2Very low76 Ų76124.3 Ų124.378%0.78482%0.816SS**  trans137.972148.300000118.6
198M41.2Very low37.7Very low191 Ų191121.2 Ų121.294%0.94182%0.816SS**  trans19.7127.5143.3-83160.6155.500122.8
199A36.5Very low37.9Very low97 Ų97123.8 Ų123.880%0.80282%0.82SS**  106139.8119.100000121.2
200A36.9Very low38Very low110 Ų110126.9 Ų126.991%0.90982%0.823SS**  trans75.4123.9169.500000116.7
201G33.3Very low38.3Very low67 Ų67126.6 Ų126.669%0.69182%0.819SS**  cis171.71150.200000107.5
202F34.2Very low38.4Very low217 Ų217133.5 Ų133.595%0.95283%0.827SS**  trans-120.5112.8170.4-85.9-82.4000108.3
203P49.2Very low37.8Very low112 Ų112135.2 Ų135.273%0.72782%0.823SS**  trans-99.3104172.534.1-26.7000110.2
204Y38.5Very low38.2Very low218 Ų218135.8 Ų135.886%0.85582%0.82SS**  15999.6119.8-106-92.3000111.2
205A47.8Very low39.1Very low95 Ų95137 Ų13779%0.78581%0.811SS**  trans-142.8104.3150.600000107.8
206L45.9Very low39.9Very low138 Ų138139.5 Ų139.572%0.72381%0.813SS**  trans-178134.6164.9-98.1141.5000104.7
207R38Very low40.4Very low224 Ų224140.3 Ų140.385%0.84581%0.812SS**  cis-166.8149.314.6-170.2169.4-161.6167.62.7109.3
208A46.3Very low40.6Very low83 Ų83139.8 Ų139.869%0.68681%0.807SS**  trans-37.7153.5171.100000118.6
209Y39.2Very low40.6Very low214 Ų214136.1 Ų136.184%0.83980%0.799SS**  -162144.6123.8-128.5-112000112.2
210L40.3Very low41Very low160 Ų160136.3 Ų136.384%0.83880%0.795SS**  trans85.9106.5160.8-71136.9000121.1
211G37.4Very low41Very low73 Ų73134.9 Ų134.975%0.75379%0.791SS**  98.774.7108.400000117.1Q213G211-Q213 PolarHBondContact O-N 3.34Å; G211-Q213 VanDerWaalsContact O-N 3.14Å
212Y36.9Very low41.5Very low241 Ų241136.4 Ų136.495%0.94579%0.791SS**  trans-60.7111155.1-94.7-97.4000109.4
213Q36.5Very low42.1Very low168 Ų168134.2 Ų134.279%0.78579%0.789SS**  trans-125.7106.2150.2-152.6-161.588.800107.9G211G211-Q213 PolarHBondContact O-N 3.34Å; G211-Q213 VanDerWaalsContact O-N 3.14Å
214A40.9Very low42Very low93 Ų93133.7 Ų133.777%0.76979%0.787SS**  trans-76.6125.1169.400000108.7
215V46.8Very low42.2Very low108 Ų108129.7 Ų129.766%0.65579%0.786SS**  trans-122.4140.8161.6-70.40000108.9S217V215-S217 PolarHBondContact O-N 2.91Å
216P45.4Very low41.9Very low129 Ų129130.4 Ų130.484%0.83879%0.785SS**  trans-71.9122.3-167.727.2-32.5000111.5G218P216-G218 PolarHBondContact O-N 3.46Å
217S43.8Very low41.5Very low132 Ų132129.6 Ų129.692%0.92379%0.791SS**  trans-66.593168.4174.40000109.8V215V215-S217 PolarHBondContact O-N 2.91Å
218G38.2Very low41.7Very low66 Ų66124 Ų12468%0.6879%0.786SS**  trans-102.6119.2170.700000111.9P216P216-G218 PolarHBondContact O-N 3.46Å
219S40.9Very low41.3Very low113 Ų113125.8 Ų125.879%0.7979%0.794SS**  trans71.8106.9146.8-145.40000121.6
220S43.7Very low41.7Very low102 Ų102120.2 Ų120.271%0.71379%0.786SS**  64.478.612967.80000120.2S222S220-S222 PolarHBondContact O-N 3.45Å
221G37.7Very low42.4Very low80 Ų80118.2 Ų118.283%0.82578%0.782SS**  trans-82.797.8147.900000110.1L223G221-L223 PolarHBondContact O-N 2.96Å
222S44.2Very low42.9Very low98 Ų98121 Ų12169%0.68579%0.788SS**  trans-75.898.2173.6-170.60000109.8S220 S224S220-S222 PolarHBondContact O-N 3.45Å; S222-S224 VanDerWaalsContact C-N 3.27Å; S222-S224 PolarHBondContact O-N 2.96Å; S222-S224 VanDerWaalsContact O-N 3.08Å; S222-S224 PolarHBondContact OG-OG 3.35Å
223L45.9Very low43.1Very low172 Ų172113 Ų11390%0.90178%0.778SS**  trans-77.382.8163-66.7173.6000108.4G221 T225G221-L223 PolarHBondContact O-N 2.96Å; L223-T225 PolarHBondContact O-N 3.26Å
224S47.8Very low43.4Very low100 Ų100111.5 Ų111.570%0.69978%0.78SS**  trans-87.894.1171.2-64.80000109.4S222 S226S222-S224 VanDerWaalsContact C-N 3.27Å; S222-S224 PolarHBondContact O-N 2.96Å; S222-S224 VanDerWaalsContact O-N 3.08Å; S222-S224 PolarHBondContact OG-OG 3.35Å; S224-S226 PolarHBondContact O-N 3.21Å
225T42.1Very low43.8Very low135 Ų135113.3 Ų113.383%0.82878%0.784SS**  trans-63117.2153.344.40000109L223L223-T225 PolarHBondContact O-N 3.26Å
226S42.3Very low43.3Very low109 Ų109113.3 Ų113.376%0.76279%0.789SS**SBendtrans-1.7119.7161.9-47.10000119S224S224-S226 PolarHBondContact O-N 3.21Å
227S37.1Very low43.3Very low122 Ų122113.3 Ų113.385%0.85379%0.789SS**  53.880.6128.6-50.50000118.3
228S41.5Very low43.2Very low106 Ų106110.5 Ų110.574%0.74177%0.774SS**  trans-82.7114.7150171.70000108.7S230S228-S230 PolarHBondContact O-N 3.34Å; S228-S230 VanDerWaalsContact O-N 3.1Å
229S39.6Very low43.7Very low121 Ų121115.3 Ų115.385%0.84678%0.784SS**  trans-69.698.2168.356.10000109.9
230S46Very low43.6Very low97 Ų97114.8 Ų114.868%0.67879%0.786SS**PPolyproline II helixtrans-84142.6167.8-63.40000110.3S228S228-S230 PolarHBondContact O-N 3.34Å; S228-S230 VanDerWaalsContact O-N 3.1Å
231P55.4Low43.3Very low117 Ų117119.5 Ų119.576%0.7679%0.794SS**PPolyproline II helixtrans-69150.317629.3-34.2000111.5G233P231-G233 PolarHBondContact O-N 3.04Å
232P48.6Very low43.4Very low133 Ų133120.1 Ų120.186%0.86479%0.792SS**SBendtrans-72.1129.8-17528.2-32.9000112.4
233G40.2Very low43.3Very low72 Ų72121.3 Ų121.374%0.74280%0.797SS**  trans75.386.9144.500000118.5P231P231-G233 PolarHBondContact O-N 3.04Å
234T44Very low43.5Very low136 Ų136118.9 Ų118.983%0.83479%0.791SS**  trans-114.1127.7142.754.70000107.9S236T234-S236 PolarHBondContact O-N 3.14Å
235P49.1Very low43.3Very low131 Ų131118.9 Ų118.985%0.85180%0.798SS**  trans-68.6126.9179.426.3-31.6000110.1
236S36.5Very low43Very low108 Ų108117.2 Ų117.276%0.75580%0.797SS**  trans-65.6135171.4-173.20000110.2T234 A238T234-S236 PolarHBondContact O-N 3.14Å; S236-A238 PolarHBondContact O-N 3.01Å
237P44.2Very low42.8Very low129 Ų129117.4 Ų117.484%0.83880%0.798SS**  trans-9192175.934.5-27.4000109.2
238A43.3Very low42.8Very low74 Ų74122.9 Ų122.961%0.61280%0.801SS**  trans-146.3129.8157.100000107.9S236S236-A238 PolarHBondContact O-N 3.01Å
239D48Very low43Very low167 Ų167122.8 Ų122.889%0.89381%0.807SS**  trans75.979.3173.3-58.1-62000118
240A38Very low42.9Very low101 Ų101120.6 Ų120.684%0.83580%0.803SS**  trans-149.4103.214800000111.7
241K37.7Very low43Very low201 Ų201121.1 Ų121.187%0.87481%0.814SS**  trans3.9125.9140.3-164.7172.6-176.2178.40116.5
242A40.8Very low42.3Very low94 Ų94120.2 Ų120.278%0.77782%0.816SS**  trans-50146.8171.500000113.9
243P41.3Very low42.6Very low122 Ų122119.2 Ų119.279%0.79281%0.809SS**  -144.6176.811234.7-15.8000114.2
244P50.2Low43.1Very low121 Ų121121.5 Ų121.579%0.78681%0.811SS**  trans-99.6158.6-143.638.3-35.1000116.3
245A44.5Very low43.2Very low101 Ų101120.8 Ų120.884%0.83581%0.809SS**  trans37.4113146.400000119.6
246A35.5Very low43.3Very low99 Ų99119.8 Ų119.882%0.81881%0.805SS**  trans-151.6117.4137.700000110.1
247C36.8Very low44.1Very low114 Ų114121.7 Ų121.777%0.7780%0.802SS**  trans-54.4141.6169.646.80000113.6
248Y38.5Very low44.2Very low237 Ų237121.6 Ų121.693%0.92980%0.799SS**  trans-151.7122.1135.1-105.4-79.1000109.7
249A44.8Very low44.7Very low103 Ų103125.9 Ų125.985%0.85180%0.803SS**  trans-78139.2173.700000110.2
250G37.3Very low44.7Very low75 Ų75123 Ų12377%0.77380%0.797SS**  trans-178.189.317400000112.5
251A47.5Very low45.5Very low109 Ų109128.4 Ų128.490%0.90180%0.801SS**  trans21.1102.5161.800000119.1
252A42Very low46.3Very low97 Ų97122.5 Ų122.580%0.80279%0.79SS**PPolyproline II helixtrans-96.2139.9163.500000111.1
253P53.4Low47.2Very low112 Ų112127.6 Ų127.673%0.72780%0.795SS**PPolyproline II helixtrans-72.4157.4163.431.7-30.8000110.2
254P50.9Low48.4Very low121 Ų121130.5 Ų130.579%0.78680%0.795SS**PPolyproline II helixtrans-63.5140.9-168.425-34.3000112.7S256P254-S256 PolarHBondContact O-N 3.46Å; P254-S256 VanDerWaalsContact O-N 3.08Å
255P46.4Very low49.6Very low121 Ų121131.4 Ų131.479%0.78680%0.798SS**  trans-71.1107.3-17828-33000110.9Q257P255-Q257 PolarHBondContact O-N 2.86Å; P255-Q257 VanDerWaalsContact O-N 3.15Å
256S50.8Low51.3Low109 Ų109129.4 Ų129.476%0.76278%0.776SS**  trans-60.8113.1160.8173.90000109P254 V258P254-S256 PolarHBondContact O-N 3.46Å; P254-S256 VanDerWaalsContact O-N 3.08Å; S256-V258 PolarHBondContact O-N 3.15Å
257Q53.4Low53.8Low148 Ų148129.3 Ų129.369%0.69276%0.761SS**  trans-14.185.9173.3-57.6-175.61500116P255 K259P255-Q257 PolarHBondContact O-N 2.86Å; P255-Q257 VanDerWaalsContact O-N 3.15Å; Q257-K259 PolarHBondContact O-N 3.27Å
258V47.3Very low56.4Low128 Ų128131 Ų13178%0.77676%0.756SS**  trans-69.885.1154.1-74.60000107.6S256 S260S256-V258 PolarHBondContact O-N 3.15Å; V258-S260 VanDerWaalsContact C-N 3.28Å; V258-S260 PolarHBondContact O-N 3.43Å
259K52.6Low58.9Low163 Ų163126.8 Ų126.871%0.70974%0.744SS**  trans-6596.3169.1-124.4105.2-176.8-174.80106.9Q257 K261Q257-K259 PolarHBondContact O-N 3.27Å; K259-K261 PolarHBondContact O-N 2.82Å
260S48.6Very low61.4Low108 Ų108123.9 Ų123.976%0.75572%0.718SS**  trans-42.7132.5169-33.60000108.8V258 A262V258-S260 VanDerWaalsContact C-N 3.28Å; V258-S260 PolarHBondContact O-N 3.43Å; S260-A262 PolarHBondContact O-N 3.41Å
261K55.2Low64.1Low214 Ų214125.5 Ų125.593%0.9371%0.708SS**  trans-70.362.9-177-151124.9175.6-179.50110.2K259 K263K259-K261 PolarHBondContact O-N 2.82Å; K261-K263 PolarHBondContact O-N 2.93Å
262A53.9Low66.4Low76 Ų76126 Ų12663%0.62869%0.692SS**  trans-60.3132.4163.100000106.9S260 K264S260-A262 PolarHBondContact O-N 3.41Å; A262-K264 VanDerWaalsContact C-N 3.33Å; A262-K264 PolarHBondContact O-N 3.33Å
263K59.3Low69Low202 Ų202124.8 Ų124.888%0.87867%0.667SS**  trans-53.898.5175.6-68175.8178178.50107.7K261 T265K261-K263 PolarHBondContact O-N 2.93Å; K263-T265 VanDerWaalsContact C-N 3.33Å; K263-T265 PolarHBondContact O-N 2.86Å
264K68.3Low71Confident182 Ų182124.6 Ų124.679%0.79166%0.655SS**  trans-67.599.5174.9-66.9-178.3-178.7-178.90105.7A262 V266A262-K264 VanDerWaalsContact C-N 3.33Å; A262-K264 PolarHBondContact O-N 3.33Å; K264-V266 VanDerWaalsContact C-N 3.26Å; K264-V266 HydrophobicContact CB-CG2 4.36Å; K264-V266 PolarHBondContact O-N 3.01Å
265T75.6Confident73.2Confident141 Ų141123 Ų12387%0.86564%0.639SS**  trans-6198.2163.4-53.30000105.9K263K263-T265 VanDerWaalsContact C-N 3.33Å; K263-T265 PolarHBondContact O-N 2.86Å
266V78.9Confident75.7Confident59 Ų59123.1 Ų123.136%0.35862%0.624SS.*  trans-81.31261771780000106.9K264 K268 Y273K264-V266 VanDerWaalsContact C-N 3.26Å; K264-V266 HydrophobicContact CB-CG2 4.36Å; K264-V266 PolarHBondContact O-N 3.01Å; V266-K268 PolarHBondContact O-N 3.07Å; V266-Y273 HydrophobicContact CG1-CD2 3.78Å; V266-Y273 HydrophobicContact CG1-CG 4.34Å
267D88Confident77.9Confident97 Ų97123 Ų12352%0.51961%0.607SS.*  trans-61.7124.5172.3173.126.3000110H269 S270 Y273D267-H269 PolarHBondContact O-N 3.13Å; D267-H269 IonicContact OD1-CD2 3.28Å; D267-H269 PolarHBondContact OD1-N 3.2Å; D267-H269 VanDerWaalsContact OD1-N 3.12Å; D267-S270 WeakPolarHBondContact O-CB 3.41Å; D267-S270 PolarHBondContact O-N 3.4Å; D267-S270 PolarHBondContact OD2-N 2.81Å; D267-Y273 WeakPolarHBondContact O-CB 3.35Å
268K91.4Very high80Confident149 Ų149120.1 Ų120.165%0.64859%0.593SS**THydrogen-bonded Turntrans-71.6-20.5-175.6-64.5-180178.7-171.80112.6V266 Y273V266-K268 PolarHBondContact O-N 3.07Å; K268-Y273 HydrophobicContact CB-CE1 4.4Å; K268-Y273 WeakPolarHBondContact O-CD1 3.47Å
269H92.3Very high82.5Confident148 Ų148122.4 Ų122.469%0.68559%0.588SS**THydrogen-bonded Turntrans-94.8-10.4-177.9-59.9-65.7000113.3D267 K274D267-H269 PolarHBondContact O-N 3.13Å; D267-H269 IonicContact OD1-CD2 3.28Å; D267-H269 PolarHBondContact OD1-N 3.2Å; D267-H269 VanDerWaalsContact OD1-N 3.12Å; H269-K274 VanDerWaalsContact O-CE 3.27Å; H269-K274 WeakPolarHBondContact O-CE 3.34Å; H269-K274 PolarHBondContact O-NZ 3.12Å
270S95.8Very high84.7Confident43 Ų43118.2 Ų118.230%0.30157%0.573SS.*SBendtrans-58.2137.5172.8178.10000111.9D267 E272 Y273 K274D267-S270 WeakPolarHBondContact O-CB 3.41Å; D267-S270 PolarHBondContact O-N 3.4Å; D267-S270 PolarHBondContact OD2-N 2.81Å; S270-E272 PolarHBondContact O-N 2.87Å; S270-E272 PolarHBondContact OG-N 3.49Å; S270-Y273 WeakPolarHBondContact O-CB 3.46Å; S270-Y273 PolarHBondContact O-N 3.46Å; S270-Y273 VanDerWaalsContact O-N 3.08Å; S270-K274 PolarHBondContact O-N 3.34Å
271D95Very high87.1Confident108 Ų108115.7 Ų115.758%0.57855%0.551SS**Hα-helixtrans-64.1-29.6177.3-65.7-31.6000112.4Y273 K274 I275D271-Y273 VanDerWaalsContact C-N 3.3Å; D271-Y273 PolarHBondContact O-N 3.08Å; D271-K274 PolarHBondContact O-N 2.78Å; D271-K274 IonicContact OD1-NZ 2.93Å; D271-K274 PolarHBondContact OD1-NZ 3.19Å; D271-I275 WeakPolarHBondContact O-CG1 3.41Å; D271-I275 PolarHBondContact O-N 3.29Å
272E95.3Very high89.1Confident120 Ų120109.8 Ų109.856%0.56153%0.529SS*.Hα-helixtrans-60.9-41.9173.1-166-165165.400111.2S270 R276S270-E272 PolarHBondContact O-N 2.87Å; S270-E272 PolarHBondContact OG-N 3.49Å; E272-R276 WeakPolarHBondContact O-CB 3.36Å; E272-R276 PolarHBondContact O-N 2.88Å; E272-R276 IonicContact OE1-CZ 3.84Å; E272-R276 IonicContact OE1-NH2 2.65Å; E272-R276 PolarHBondContact OE1-NH2 3.21Å
273Y96.4Very high91.3Very high72 Ų72108.7 Ų108.728%0.28252%0.52SS..Hα-helixtrans-63.8-46.7176.2178.6-96000111V266 D267 K268 S270 D271 I275 R276 R277V266-Y273 HydrophobicContact CG1-CD2 3.78Å; V266-Y273 HydrophobicContact CG1-CG 4.34Å; D267-Y273 WeakPolarHBondContact O-CB 3.35Å; K268-Y273 HydrophobicContact CB-CE1 4.4Å; K268-Y273 WeakPolarHBondContact O-CD1 3.47Å; S270-Y273 WeakPolarHBondContact O-CB 3.46Å; S270-Y273 PolarHBondContact O-N 3.46Å; S270-Y273 VanDerWaalsContact O-N 3.08Å; D271-Y273 VanDerWaalsContact C-N 3.3Å; D271-Y273 PolarHBondContact O-N 3.08Å; Y273-I275 PolarHBondContact O-N 3.48Å; Y273-R276 PolarHBondContact O-N 3.44Å; Y273-R277 HydrophobicContact CD1-CG 3.92Å; Y273-R277 HydrophobicContact CD2-CG 4.33Å; Y273-R277 HydrophobicContact CE1-CG 3.48Å; Y273-R277 VanDerWaalsContact CE1-CG 3.48Å; Y273-R277 HydrophobicContact CE2-CG 3.94Å; Y273-R277 HydrophobicContact CG-CG 4.33Å; Y273-R277 VanDerWaalsContact CZ-CG 3.49Å; Y273-R277 WeakPolarHBondContact O-CB 3.34Å; Y273-R277 WeakPolarHBondContact O-CG 3.28Å; Y273-R277 PolarHBondContact O-N 3.03Å
274K96.8Very high93.1Very high108 Ų108103 Ų10347%0.4750%0.502SS..Hα-helixtrans-58.4-48.1178.7-64.1175.9-163.4151.80111.9H269 S270 D271 R276 R277 E278H269-K274 VanDerWaalsContact O-CE 3.27Å; H269-K274 WeakPolarHBondContact O-CE 3.34Å; H269-K274 PolarHBondContact O-NZ 3.12Å; S270-K274 PolarHBondContact O-N 3.34Å; D271-K274 PolarHBondContact O-N 2.78Å; D271-K274 IonicContact OD1-NZ 2.93Å; D271-K274 PolarHBondContact OD1-NZ 3.19Å; K274-R276 VanDerWaalsContact C-N 3.33Å; K274-R276 PolarHBondContact O-N 3.05Å; K274-R277 PolarHBondContact O-N 3Å; K274-E278 PolarHBondContact O-N 3.06Å
275I96.8Very high94.6Very high87 Ų87100.2 Ų100.245%0.44649%0.486SS..Hα-helixtrans-61-43.6178.3-66.9166.7000110.6D271 Y273 R277 E278 R279D271-I275 WeakPolarHBondContact O-CG1 3.41Å; D271-I275 PolarHBondContact O-N 3.29Å; Y273-I275 PolarHBondContact O-N 3.48Å; I275-R277 PolarHBondContact O-N 3.25Å; I275-E278 PolarHBondContact O-N 2.86Å; I275-R279 VanDerWaalsContact CG2-CZ 3.48Å; I275-R279 WeakPolarHBondContact O-CG 3.47Å; I275-R279 PolarHBondContact O-N 2.98Å
276R97.5Very high95.7Very high123 Ų123101.3 Ų101.346%0.46448%0.479SS..Hα-helixtrans-65.3-39.4179.1-163.7-176.1-61.6158.31.2111.9E272 Y273 K274 N280E272-R276 WeakPolarHBondContact O-CB 3.36Å; E272-R276 PolarHBondContact O-N 2.88Å; E272-R276 IonicContact OE1-CZ 3.84Å; E272-R276 IonicContact OE1-NH2 2.65Å; E272-R276 PolarHBondContact OE1-NH2 3.21Å; Y273-R276 PolarHBondContact O-N 3.44Å; K274-R276 VanDerWaalsContact C-N 3.33Å; K274-R276 PolarHBondContact O-N 3.05Å; R276-N280 WeakPolarHBondContact O-CB 3.4Å; R276-N280 PolarHBondContact O-N 3.4Å
277R98.2Very high96.6Very high107 Ų107102.2 Ų102.240%0.40449%0.488SS..Hα-helixtrans-66.6-42.3175.4-71-59.4-63.4159.41.1111.6Y273 K274 I275 N280 N281Y273-R277 HydrophobicContact CD1-CG 3.92Å; Y273-R277 HydrophobicContact CD2-CG 4.33Å; Y273-R277 HydrophobicContact CE1-CG 3.48Å; Y273-R277 VanDerWaalsContact CE1-CG 3.48Å; Y273-R277 HydrophobicContact CE2-CG 3.94Å; Y273-R277 HydrophobicContact CG-CG 4.33Å; Y273-R277 VanDerWaalsContact CZ-CG 3.49Å; Y273-R277 WeakPolarHBondContact O-CB 3.34Å; Y273-R277 WeakPolarHBondContact O-CG 3.28Å; Y273-R277 PolarHBondContact O-N 3.03Å; K274-R277 PolarHBondContact O-N 3Å; I275-R277 PolarHBondContact O-N 3.25Å; R277-N280 PolarHBondContact NH1-OD1 3.41Å; R277-N280 PolarHBondContact O-N 3.4Å; R277-N281 PolarHBondContact O-N 3.35Å; R277-N281 PolarHBondContact O-ND2 3.04Å
278E98.1Very high97.2Very high88 Ų88105.2 Ų105.241%0.41149%0.492SS..Hα-helixtrans-64.9-44.6178.6-171.750.6-137.900111.6K274 I275 N280 N281 I282 R285K274-E278 PolarHBondContact O-N 3.06Å; I275-E278 PolarHBondContact O-N 2.86Å; E278-N280 VanDerWaalsContact C-N 3.28Å; E278-N280 PolarHBondContact O-N 3.5Å; E278-N281 WeakPolarHBondContact O-CB 3.36Å; E278-N281 PolarHBondContact O-N 3.46Å; E278-N281 VanDerWaalsContact O-N 3.15Å; E278-I282 HydrophobicContact CG-CD1 4.26Å; E278-I282 WeakPolarHBondContact O-CG1 3.44Å; E278-I282 PolarHBondContact O-N 3.47Å; E278-R285 IonicContact OE1-CZ 3.35Å; E278-R285 IonicContact OE1-NH2 2.63Å; E278-R285 PolarHBondContact OE1-NH2 2.87Å
279R98.7Very high97.5Very high175 Ų175102 Ų10266%0.6648%0.482SS*.Hα-helixtrans-57.1-42.2172.8-72.5176.1-177.4156.82.3112.2I275 I282 A283I275-R279 VanDerWaalsContact CG2-CZ 3.48Å; I275-R279 WeakPolarHBondContact O-CG 3.47Å; I275-R279 PolarHBondContact O-N 2.98Å; R279-I282 PolarHBondContact O-N 3.23Å; R279-A283 WeakPolarHBondContact O-CB 3.11Å; R279-A283 PolarHBondContact O-N 3.35Å
280N98.5Very high97.8Very high75 Ų75101.8 Ų101.840%0.40148%0.479SS..Hα-helixtrans-66.4-41.9177.1-177.9-114.8000111.9R276 R277 E278 I282 A283 V284R276-N280 WeakPolarHBondContact O-CB 3.4Å; R276-N280 PolarHBondContact O-N 3.4Å; R277-N280 PolarHBondContact NH1-OD1 3.41Å; R277-N280 PolarHBondContact O-N 3.4Å; E278-N280 VanDerWaalsContact C-N 3.28Å; E278-N280 PolarHBondContact O-N 3.5Å; N280-I282 VanDerWaalsContact C-N 3.31Å; N280-I282 PolarHBondContact O-N 2.89Å; N280-A283 PolarHBondContact O-N 3.35Å; N280-V284 VanDerWaalsContact O-CG2 3.29Å; N280-V284 WeakPolarHBondContact O-CG2 3.21Å; N280-V284 PolarHBondContact O-N 3.03Å
281N98.7Very high98Very high56 Ų56102 Ų10230%0.29948%0.483SS..Hα-helixtrans-59.6-43.2175.5-68.6-24.1000111.3R277 E278 V284 R285R277-N281 PolarHBondContact O-N 3.35Å; R277-N281 PolarHBondContact O-ND2 3.04Å; E278-N281 WeakPolarHBondContact O-CB 3.36Å; E278-N281 PolarHBondContact O-N 3.46Å; E278-N281 VanDerWaalsContact O-N 3.15Å; N281-V284 PolarHBondContact O-N 3.28Å; N281-R285 WeakPolarHBondContact O-CG 3.38Å; N281-R285 PolarHBondContact O-N 3.36Å
282I98.5Very high98.1Very high90 Ų90101.6 Ų101.646%0.46248%0.476SS..Hα-helixtrans-60.9-47.4174.1-64.5166000110.6E278 R279 N280 V284 R285 K286E278-I282 HydrophobicContact CG-CD1 4.26Å; E278-I282 WeakPolarHBondContact O-CG1 3.44Å; E278-I282 PolarHBondContact O-N 3.47Å; R279-I282 PolarHBondContact O-N 3.23Å; N280-I282 VanDerWaalsContact C-N 3.31Å; N280-I282 PolarHBondContact O-N 2.89Å; I282-V284 VanDerWaalsContact C-N 3.32Å; I282-V284 PolarHBondContact O-N 2.98Å; I282-R285 VanDerWaalsContact CG1-NH2 3.29Å; I282-R285 PolarHBondContact O-N 3.32Å; I282-K286 WeakPolarHBondContact O-CB 3.44Å; I282-K286 PolarHBondContact O-N 3.44Å
283A98.7Very high98.3Very high53 Ų53100.7 Ų100.744%0.43847%0.473SS..Hα-helixtrans-61.4-39.9179.200000112.3R279 N280 K286 S287R279-A283 WeakPolarHBondContact O-CB 3.11Å; R279-A283 PolarHBondContact O-N 3.35Å; N280-A283 PolarHBondContact O-N 3.35Å; A283-K286 PolarHBondContact O-N 3.28Å; A283-S287 WeakPolarHBondContact O-CB 3.32Å; A283-S287 PolarHBondContact O-N 2.95Å
284V98.8Very high98.4Very high82 Ų82104.5 Ų104.550%0.49749%0.487SS..Hα-helixtrans-64.8-47.5176.3170.10000110.7N280 N281 I282 K286 S287 R288N280-V284 VanDerWaalsContact O-CG2 3.29Å; N280-V284 WeakPolarHBondContact O-CG2 3.21Å; N280-V284 PolarHBondContact O-N 3.03Å; N281-V284 PolarHBondContact O-N 3.28Å; I282-V284 VanDerWaalsContact C-N 3.32Å; I282-V284 PolarHBondContact O-N 2.98Å; V284-K286 PolarHBondContact O-N 3.42Å; V284-S287 PolarHBondContact O-N 3.18Å; V284-R288 WeakPolarHBondContact O-CB 3.36Å; V284-R288 PolarHBondContact O-N 3.35Å
285R98.8Very high98.5Very high123 Ų123104.1 Ų104.146%0.46449%0.49SS..Hα-helixtrans-55.5-52.2175.2-73.8-174.9-71.2-103.34.9110.6E278 N281 I282 S287 R288 D289E278-R285 IonicContact OE1-CZ 3.35Å; E278-R285 IonicContact OE1-NH2 2.63Å; E278-R285 PolarHBondContact OE1-NH2 2.87Å; N281-R285 WeakPolarHBondContact O-CG 3.38Å; N281-R285 PolarHBondContact O-N 3.36Å; I282-R285 VanDerWaalsContact CG1-NH2 3.29Å; I282-R285 PolarHBondContact O-N 3.32Å; R285-S287 PolarHBondContact O-N 3.28Å; R285-R288 WeakPolarHBondContact O-CB 3.47Å; R285-R288 PolarHBondContact O-N 2.96Å; R285-R288 VanDerWaalsContact O-N 3.09Å; R285-D289 PolarHBondContact O-N 3.48Å
286K98.8Very high98.6Very high164 Ų164104.5 Ų104.571%0.71349%0.493SS*.Hα-helixtrans-57.8-43.6177.7-173.3174.6-176.1174.40112.9I282 A283 V284 R288 D289 K290I282-K286 WeakPolarHBondContact O-CB 3.44Å; I282-K286 PolarHBondContact O-N 3.44Å; A283-K286 PolarHBondContact O-N 3.28Å; V284-K286 PolarHBondContact O-N 3.42Å; K286-R288 VanDerWaalsContact C-N 3.32Å; K286-R288 PolarHBondContact O-N 3.21Å; K286-D289 PolarHBondContact O-N 2.96Å; K286-K290 WeakPolarHBondContact O-CB 3.37Å; K286-K290 PolarHBondContact O-N 2.83Å
287S98.8Very high98.7Very high79 Ų79104.2 Ų104.255%0.55250%0.497SS*.Hα-helixtrans-64.1-39.4177.2-172.40000111.7A283 V284 R285 A291A283-S287 WeakPolarHBondContact O-CB 3.32Å; A283-S287 PolarHBondContact O-N 2.95Å; V284-S287 PolarHBondContact O-N 3.18Å; R285-S287 PolarHBondContact O-N 3.28Å; S287-A291 PolarHBondContact O-N 2.98Å
288R98.9Very high98.7Very high160 Ų160102.8 Ų102.860%0.60450%0.5SS*.Hα-helixtrans-68.3-42.5180-154.6177.674.21563.3111.1V284 R285 K286 A291 K292V284-R288 WeakPolarHBondContact O-CB 3.36Å; V284-R288 PolarHBondContact O-N 3.35Å; R285-R288 WeakPolarHBondContact O-CB 3.47Å; R285-R288 PolarHBondContact O-N 2.96Å; R285-R288 VanDerWaalsContact O-N 3.09Å; K286-R288 VanDerWaalsContact C-N 3.32Å; K286-R288 PolarHBondContact O-N 3.21Å; R288-A291 PolarHBondContact O-N 3.38Å; R288-K292 WeakPolarHBondContact O-CG 3.47Å; R288-K292 PolarHBondContact O-N 2.8Å
289D98.8Very high98.7Very high80 Ų80104.6 Ų104.643%0.42851%0.508SS..Hα-helixtrans-68.3-37.9177.7-63-25.5000111.5R285 K286 A291 K292 M293R285-D289 PolarHBondContact O-N 3.48Å; K286-D289 PolarHBondContact O-N 2.96Å; D289-A291 VanDerWaalsContact C-N 3.32Å; D289-A291 PolarHBondContact O-N 3.44Å; D289-K292 WeakPolarHBondContact O-CB 3.42Å; D289-K292 PolarHBondContact O-N 2.63Å; D289-M293 WeakPolarHBondContact O-CG 3.36Å; D289-M293 PolarHBondContact O-N 3.28Å
290K98.8Very high98.7Very high145 Ų145101.6 Ų101.663%0.6350%0.502SS*.Hα-helixtrans-60.1-41.1171.2-174.5173.7-176.7174.40112.4K286 M293 R294K286-K290 WeakPolarHBondContact O-CB 3.37Å; K286-K290 PolarHBondContact O-N 2.83Å; K290-M293 PolarHBondContact O-N 2.72Å; K290-R294 PolarHBondContact O-N 3.27Å
291A98.7Very high98.7Very high46 Ų46102.8 Ų102.838%0.3850%0.503SS..Hα-helixtrans-65.9-40.6176.400000111.8S287 R288 D289 R294 N295S287-A291 PolarHBondContact O-N 2.98Å; R288-A291 PolarHBondContact O-N 3.38Å; D289-A291 VanDerWaalsContact C-N 3.32Å; D289-A291 PolarHBondContact O-N 3.44Å; A291-R294 PolarHBondContact O-N 3.1Å; A291-N295 VanDerWaalsContact O-CG 3.3Å; A291-N295 PolarHBondContact O-N 2.99Å
292K98.8Very high98.7Very high101 Ų101104.1 Ų104.144%0.43951%0.513SS..Hα-helixtrans-60.9-47.2173.7-71175.9179.3-178.70111.9R288 D289 R294 N295 L296R288-K292 WeakPolarHBondContact O-CG 3.47Å; R288-K292 PolarHBondContact O-N 2.8Å; D289-K292 WeakPolarHBondContact O-CB 3.42Å; D289-K292 PolarHBondContact O-N 2.63Å; K292-R294 PolarHBondContact O-N 2.93Å; K292-N295 WeakPolarHBondContact O-CB 3.29Å; K292-N295 PolarHBondContact O-N 2.98Å; K292-N295 VanDerWaalsContact O-N 3.16Å; K292-L296 WeakPolarHBondContact O-CG 3.43Å; K292-L296 PolarHBondContact O-N 2.99Å
293M98.6Very high98.8Very high100 Ų100105.8 Ų105.849%0.49352%0.522SS..Hα-helixtrans-59.8-45.5177.4-73.8-55-5700111.7D289 K290 N295 L296 E297D289-M293 WeakPolarHBondContact O-CG 3.36Å; D289-M293 PolarHBondContact O-N 3.28Å; K290-M293 PolarHBondContact O-N 2.72Å; M293-N295 VanDerWaalsContact C-N 3.28Å; M293-N295 PolarHBondContact O-N 3.23Å; M293-L296 PolarHBondContact O-N 3.31Å; M293-L296 VanDerWaalsContact O-N 3.16Å; M293-L296 HydrophobicContact SD-CD1 4.35Å; M293-E297 WeakPolarHBondContact O-CB 3.45Å; M293-E297 VanDerWaalsContact O-CG 3.28Å; M293-E297 WeakPolarHBondContact O-CG 3.3Å; M293-E297 PolarHBondContact O-N 3.39Å
294R98.7Very high98.8Very high153 Ų153107.2 Ų107.258%0.57752%0.52SS*.Hα-helixtrans-57.1-41.7174.8-175.4-169.4-66.1177.9-4.8112.3K290 A291 K292 T298K290-R294 PolarHBondContact O-N 3.27Å; A291-R294 PolarHBondContact O-N 3.1Å; K292-R294 PolarHBondContact O-N 2.93Å; R294-T298 WeakPolarHBondContact O-CB 3.47Å; R294-T298 PolarHBondContact O-N 3.04Å; R294-T298 PolarHBondContact O-OG1 3.42Å
295N98.7Very high98.8Very high99 Ų99107.4 Ų107.453%0.52952%0.518SS..Hα-helixtrans-65.5-43.1178.5-70.4-12.8000111.4A291 K292 M293 T298 Q299A291-N295 VanDerWaalsContact O-CG 3.3Å; A291-N295 PolarHBondContact O-N 2.99Å; K292-N295 WeakPolarHBondContact O-CB 3.29Å; K292-N295 PolarHBondContact O-N 2.98Å; K292-N295 VanDerWaalsContact O-N 3.16Å; M293-N295 VanDerWaalsContact C-N 3.28Å; M293-N295 PolarHBondContact O-N 3.23Å; N295-T298 WeakPolarHBondContact O-CB 3.3Å; N295-T298 PolarHBondContact O-N 3.26Å; N295-Q299 WeakPolarHBondContact O-CG 3.48Å; N295-Q299 PolarHBondContact O-N 3.16Å
296L98.7Very high98.8Very high96 Ų96104.7 Ų104.750%0.50352%0.515SS..Hα-helixtrans-64.1-45176-69.5173.9000111.9K292 M293 T298 Q299 H300K292-L296 WeakPolarHBondContact O-CG 3.43Å; K292-L296 PolarHBondContact O-N 2.99Å; M293-L296 PolarHBondContact O-N 3.31Å; M293-L296 VanDerWaalsContact O-N 3.16Å; M293-L296 HydrophobicContact SD-CD1 4.35Å; L296-T298 PolarHBondContact O-N 3.16Å; L296-Q299 PolarHBondContact O-N 2.83Å; L296-H300 WeakPolarHBondContact O-CB 3.48Å; L296-H300 PolarHBondContact O-N 2.93Å
297E98.7Very high98.7Very high116 Ų11699.7 Ų99.754%0.54250%0.504SS..Hα-helixtrans-58.1-40174.3-73.2164.9-168.100111.2M293 H300 K301M293-E297 WeakPolarHBondContact O-CB 3.45Å; M293-E297 VanDerWaalsContact O-CG 3.28Å; M293-E297 WeakPolarHBondContact O-CG 3.3Å; M293-E297 PolarHBondContact O-N 3.39Å; E297-H300 PolarHBondContact O-N 2.77Å; E297-K301 WeakPolarHBondContact O-CB 3.48Å; E297-K301 PolarHBondContact O-N 3.09Å
298T98.8Very high98.7Very high78 Ų7899.6 Ų99.648%0.47950%0.495SS..Hα-helixtrans-66.1-45.2177-560000111.2R294 N295 L296 H300 K301 V302R294-T298 WeakPolarHBondContact O-CB 3.47Å; R294-T298 PolarHBondContact O-N 3.04Å; R294-T298 PolarHBondContact O-OG1 3.42Å; N295-T298 WeakPolarHBondContact O-CB 3.3Å; N295-T298 PolarHBondContact O-N 3.26Å; L296-T298 PolarHBondContact O-N 3.16Å; T298-H300 VanDerWaalsContact C-N 3.34Å; T298-H300 PolarHBondContact O-N 3.1Å; T298-K301 PolarHBondContact O-N 3.47Å; T298-V302 WeakPolarHBondContact O-CG2 3.42Å; T298-V302 PolarHBondContact O-N 2.99Å
299Q98.8Very high98.7Very high125 Ų12596.1 Ų96.158%0.58449%0.489SS*.Hα-helixtrans-59.5-45.8175.3-72.7175-1000111.4N295 L296 K301 V302 L303N295-Q299 WeakPolarHBondContact O-CG 3.48Å; N295-Q299 PolarHBondContact O-N 3.16Å; L296-Q299 PolarHBondContact O-N 2.83Å; Q299-K301 VanDerWaalsContact C-N 3.3Å; Q299-K301 PolarHBondContact O-N 3.46Å; Q299-V302 PolarHBondContact O-N 2.88Å; Q299-L303 PolarHBondContact O-N 3.49Å
300H98.8Very high98.7Very high112 Ų11297.1 Ų97.152%0.51949%0.491SS..Hα-helixtrans-59.7-43.2174.9-171.5-96.5000111.4L296 E297 T298 V302 L303 E304L296-H300 WeakPolarHBondContact O-CB 3.48Å; L296-H300 PolarHBondContact O-N 2.93Å; E297-H300 PolarHBondContact O-N 2.77Å; T298-H300 VanDerWaalsContact C-N 3.34Å; T298-H300 PolarHBondContact O-N 3.1Å; H300-V302 VanDerWaalsContact C-N 3.31Å; H300-V302 PolarHBondContact O-N 3.29Å; H300-L303 WeakPolarHBondContact O-CB 3.26Å; H300-L303 PolarHBondContact O-N 2.92Å; H300-L303 VanDerWaalsContact O-N 3.12Å; H300-E304 IonicContact CE1-OE1 3.71Å; H300-E304 PolarHBondContact CE1-OE1 3.42Å; H300-E304 IonicContact ND1-OE1 2.8Å; H300-E304 PolarHBondContact ND1-OE1 3.27Å; H300-E304 PolarHBondContact O-N 3.05Å
301K98.8Very high98.7Very high101 Ų10196.4 Ų96.444%0.43948%0.484SS..Hα-helixtrans-64.2-36.4179.9-170.358.2-178.5175.90112.7E297 T298 Q299 L303 E304 L305E297-K301 WeakPolarHBondContact O-CB 3.48Å; E297-K301 PolarHBondContact O-N 3.09Å; T298-K301 PolarHBondContact O-N 3.47Å; Q299-K301 VanDerWaalsContact C-N 3.3Å; Q299-K301 PolarHBondContact O-N 3.46Å; K301-L303 VanDerWaalsContact C-N 3.34Å; K301-E304 VanDerWaalsContact CD-OE2 3.25Å; K301-E304 WeakPolarHBondContact CD-OE2 3.5Å; K301-E304 IonicContact NZ-OE2 2.82Å; K301-E304 PolarHBondContact NZ-OE2 2.85Å; K301-E304 PolarHBondContact O-N 3.36Å; K301-L305 HydrophobicContact CD-CG 4.37Å; K301-L305 HydrophobicContact CG-CD1 4.06Å; K301-L305 HydrophobicContact CG-CG 4.36Å; K301-L305 WeakPolarHBondContact O-CB 3.49Å; K301-L305 VanDerWaalsContact O-CG 3.26Å; K301-L305 WeakPolarHBondContact O-CG 3.4Å; K301-L305 PolarHBondContact O-N 2.95Å
302V98.9Very high98.7Very high84 Ų8497.8 Ų97.851%0.50949%0.485SS..Hα-helixtrans-60.4-46.3173.2170.20000110.2T298 Q299 H300 E304 L305 T306T298-V302 WeakPolarHBondContact O-CG2 3.42Å; T298-V302 PolarHBondContact O-N 2.99Å; Q299-V302 PolarHBondContact O-N 2.88Å; H300-V302 VanDerWaalsContact C-N 3.31Å; H300-V302 PolarHBondContact O-N 3.29Å; V302-E304 PolarHBondContact O-N 2.97Å; V302-L305 PolarHBondContact O-N 2.96Å; V302-T306 WeakPolarHBondContact O-CB 3.4Å; V302-T306 PolarHBondContact O-N 3.41Å; V302-T306 PolarHBondContact O-OG1 3.49Å
303L98.8Very high98.7Very high124 Ų12498.5 Ų98.565%0.64949%0.489SS*.Hα-helixtrans-61.5-45.2178-64.9174.7000112.3Q299 H300 K301 L305 T306 A307Q299-L303 PolarHBondContact O-N 3.49Å; H300-L303 WeakPolarHBondContact O-CB 3.26Å; H300-L303 PolarHBondContact O-N 2.92Å; H300-L303 VanDerWaalsContact O-N 3.12Å; K301-L303 VanDerWaalsContact C-N 3.34Å; L303-L305 PolarHBondContact O-N 3.27Å; L303-T306 PolarHBondContact O-N 3.49Å; L303-A307 PolarHBondContact O-N 3.39Å
304E98.7Very high98.7Very high84 Ų84100 Ų10039%0.39349%0.493SS..Hα-helixtrans-57.4-47.9175.1-71.9179.6-176.500112H300 K301 V302 T306 A307 E308H300-E304 IonicContact CE1-OE1 3.71Å; H300-E304 PolarHBondContact CE1-OE1 3.42Å; H300-E304 IonicContact ND1-OE1 2.8Å; H300-E304 PolarHBondContact ND1-OE1 3.27Å; H300-E304 PolarHBondContact O-N 3.05Å; K301-E304 VanDerWaalsContact CD-OE2 3.25Å; K301-E304 WeakPolarHBondContact CD-OE2 3.5Å; K301-E304 IonicContact NZ-OE2 2.82Å; K301-E304 PolarHBondContact NZ-OE2 2.85Å; K301-E304 PolarHBondContact O-N 3.36Å; V302-E304 PolarHBondContact O-N 2.97Å; E304-T306 VanDerWaalsContact C-N 3.35Å; E304-A307 PolarHBondContact O-N 3.35Å; E304-E308 WeakPolarHBondContact O-CB 3.41Å; E304-E308 PolarHBondContact O-N 2.86Å
305L98.8Very high98.7Very high85 Ų8596.9 Ų96.945%0.44548%0.484SS..Hα-helixtrans-68.5-34.7-178.3-71.3174.8000112K301 V302 L303 E308 N309K301-L305 HydrophobicContact CD-CG 4.37Å; K301-L305 HydrophobicContact CG-CD1 4.06Å; K301-L305 HydrophobicContact CG-CG 4.36Å; K301-L305 WeakPolarHBondContact O-CB 3.49Å; K301-L305 VanDerWaalsContact O-CG 3.26Å; K301-L305 WeakPolarHBondContact O-CG 3.4Å; K301-L305 PolarHBondContact O-N 2.95Å; V302-L305 PolarHBondContact O-N 2.96Å; L303-L305 PolarHBondContact O-N 3.27Å; L305-E308 PolarHBondContact O-N 3.02Å; L305-N309 VanDerWaalsContact O-CB 3.3Å; L305-N309 WeakPolarHBondContact O-CB 3.33Å; L305-N309 PolarHBondContact O-N 3.27Å; L305-N309 PolarHBondContact O-ND2 3.42Å
306T98.7Very high98.7Very high67 Ų6796.5 Ų96.541%0.41149%0.485SS..Hα-helixtrans-62.9-49.1173.9-63.20000110.8V302 L303 E304 E308 N309 E310V302-T306 WeakPolarHBondContact O-CB 3.4Å; V302-T306 PolarHBondContact O-N 3.41Å; V302-T306 PolarHBondContact O-OG1 3.49Å; L303-T306 PolarHBondContact O-N 3.49Å; E304-T306 VanDerWaalsContact C-N 3.35Å; T306-E308 VanDerWaalsContact C-N 3.32Å; T306-E308 PolarHBondContact O-N 3.34Å; T306-N309 PolarHBondContact O-N 3.33Å; T306-E310 PolarHBondContact O-N 3.13Å
307A98.7Very high98.7Very high59 Ų5997 Ų9749%0.48849%0.485SS..Hα-helixtrans-61.3-41177.800000112.3L303 E304 E310 R311L303-A307 PolarHBondContact O-N 3.39Å; E304-A307 PolarHBondContact O-N 3.35Å; A307-E310 PolarHBondContact O-N 3.39Å; A307-R311 WeakPolarHBondContact O-CB 3.41Å; A307-R311 PolarHBondContact O-N 2.91Å
308E98.8Very high98.7Very high76 Ų7695.1 Ų95.136%0.35548%0.476SS..Hα-helixtrans-67.5-39.6177.1-178.159.8-167.700112.2E304 L305 T306 R311 L312E304-E308 WeakPolarHBondContact O-CB 3.41Å; E304-E308 PolarHBondContact O-N 2.86Å; L305-E308 PolarHBondContact O-N 3.02Å; T306-E308 VanDerWaalsContact C-N 3.32Å; T306-E308 PolarHBondContact O-N 3.34Å; E308-R311 WeakPolarHBondContact O-CB 3.4Å; E308-R311 PolarHBondContact O-N 3.48Å; E308-R311 IonicContact OE1-CZ 3.29Å; E308-R311 IonicContact OE1-NE 3.67Å; E308-R311 PolarHBondContact OE1-NE 3.41Å; E308-R311 IonicContact OE1-NH2 2.78Å; E308-R311 PolarHBondContact OE1-NH2 3.2Å; E308-R311 IonicContact OE2-CZ 4Å; E308-R311 IonicContact OE2-NE 3.91Å; E308-R311 PolarHBondContact OE2-NE 3.43Å; E308-R311 IonicContact OE2-NH2 2.86Å; E308-L312 HydrophobicContact CG-CD1 4.22Å; E308-L312 WeakPolarHBondContact O-CB 3.49Å; E308-L312 VanDerWaalsContact O-CG 3.3Å; E308-L312 WeakPolarHBondContact O-CG 3.41Å; E308-L312 PolarHBondContact O-N 2.93Å
309N98.7Very high98.7Very high88 Ų8895 Ų9547%0.47147%0.472SS..Hα-helixtrans-61.5-45.7174.3-87.3-46.5000111.8L305 T306 R311 L312 Q313L305-N309 VanDerWaalsContact O-CB 3.3Å; L305-N309 WeakPolarHBondContact O-CB 3.33Å; L305-N309 PolarHBondContact O-N 3.27Å; L305-N309 PolarHBondContact O-ND2 3.42Å; T306-N309 PolarHBondContact O-N 3.33Å; N309-R311 VanDerWaalsContact C-N 3.3Å; N309-R311 PolarHBondContact O-N 3.47Å; N309-L312 PolarHBondContact O-N 3.42Å; N309-Q313 WeakPolarHBondContact O-CB 3.25Å; N309-Q313 VanDerWaalsContact O-CG 3.29Å; N309-Q313 WeakPolarHBondContact O-CG 3.49Å; N309-Q313 PolarHBondContact O-N 2.83Å
310E98.8Very high98.7Very high101 Ų10192.2 Ų92.247%0.47247%0.467SS..Hα-helixtrans-60.5-41175.5-71.7-178-172.500111.9T306 A307 L312 Q313 K314T306-E310 PolarHBondContact O-N 3.13Å; A307-E310 PolarHBondContact O-N 3.39Å; E310-L312 VanDerWaalsContact C-N 3.35Å; E310-Q313 PolarHBondContact O-N 2.84Å; E310-K314 WeakPolarHBondContact O-CG 3.35Å; E310-K314 PolarHBondContact O-N 3.16Å
311R98.8Very high98.7Very high129 Ų12994.4 Ų94.449%0.48747%0.47SS..Hα-helixtrans-61.3-44.5176-169.6-16570.773-1.1111.3A307 E308 N309 K315A307-R311 WeakPolarHBondContact O-CB 3.41Å; A307-R311 PolarHBondContact O-N 2.91Å; E308-R311 WeakPolarHBondContact O-CB 3.4Å; E308-R311 PolarHBondContact O-N 3.48Å; E308-R311 IonicContact OE1-CZ 3.29Å; E308-R311 IonicContact OE1-NE 3.67Å; E308-R311 PolarHBondContact OE1-NE 3.41Å; E308-R311 IonicContact OE1-NH2 2.78Å; E308-R311 PolarHBondContact OE1-NH2 3.2Å; E308-R311 IonicContact OE2-CZ 4Å; E308-R311 IonicContact OE2-NE 3.91Å; E308-R311 PolarHBondContact OE2-NE 3.43Å; E308-R311 IonicContact OE2-NH2 2.86Å; N309-R311 VanDerWaalsContact C-N 3.3Å; N309-R311 PolarHBondContact O-N 3.47Å; R311-K315 PolarHBondContact O-N 3.12Å; R311-K315 VanDerWaalsContact O-N 3.13Å
312L98.8Very high98.7Very high75 Ų7594 Ų9439%0.39347%0.47SS..Hα-helixtrans-67.1-42.7177.9-72.1172.1000111.7E308 N309 E310 K314 K315 V316E308-L312 HydrophobicContact CG-CD1 4.22Å; E308-L312 WeakPolarHBondContact O-CB 3.49Å; E308-L312 VanDerWaalsContact O-CG 3.3Å; E308-L312 WeakPolarHBondContact O-CG 3.41Å; E308-L312 PolarHBondContact O-N 2.93Å; N309-L312 PolarHBondContact O-N 3.42Å; E310-L312 VanDerWaalsContact C-N 3.35Å; L312-K314 PolarHBondContact O-N 3.07Å; L312-K315 WeakPolarHBondContact O-CB 3.28Å; L312-K315 PolarHBondContact O-N 3.01Å; L312-V316 WeakPolarHBondContact O-CG2 3.43Å; L312-V316 PolarHBondContact O-N 3.24Å
313Q98.7Very high98.6Very high116 Ų11694.1 Ų94.154%0.54247%0.467SS..Hα-helixtrans-57.1-48.6175-76173.4-3.300111.3N309 E310 K315 V316 E317N309-Q313 WeakPolarHBondContact O-CB 3.25Å; N309-Q313 VanDerWaalsContact O-CG 3.29Å; N309-Q313 WeakPolarHBondContact O-CG 3.49Å; N309-Q313 PolarHBondContact O-N 2.83Å; E310-Q313 PolarHBondContact O-N 2.84Å; Q313-K315 PolarHBondContact O-N 3.17Å; Q313-V316 PolarHBondContact O-N 2.94Å; Q313-V316 VanDerWaalsContact O-N 3.15Å; Q313-E317 WeakPolarHBondContact O-CG 3.45Å; Q313-E317 PolarHBondContact O-N 3.42Å
314K98.8Very high98.6Very high132 Ų13291 Ų9157%0.57446%0.455SS*.Hα-helixtrans-57.5-38.2174.6-73.2171.5-177.8166.40112.3E310 L312 Q318E310-K314 WeakPolarHBondContact O-CG 3.35Å; E310-K314 PolarHBondContact O-N 3.16Å; L312-K314 PolarHBondContact O-N 3.07Å; K314-Q318 WeakPolarHBondContact O-CB 3.38Å; K314-Q318 PolarHBondContact O-N 3.32Å
315K98.6Very high98.5Very high87 Ų8790.9 Ų90.938%0.37846%0.461SS..Hα-helixtrans-69.7-40.9178.1-171.159.3179.8173.50112R311 L312 Q313 Q318 L319R311-K315 PolarHBondContact O-N 3.12Å; R311-K315 VanDerWaalsContact O-N 3.13Å; L312-K315 WeakPolarHBondContact O-CB 3.28Å; L312-K315 PolarHBondContact O-N 3.01Å; Q313-K315 PolarHBondContact O-N 3.17Å; K315-Q318 PolarHBondContact O-N 3.15Å; K315-L319 HydrophobicContact CG-CD1 4.25Å; K315-L319 VanDerWaalsContact O-CG 3.32Å; K315-L319 WeakPolarHBondContact O-CG 3.4Å; K315-L319 PolarHBondContact O-N 3.35Å
316V98.8Very high98.4Very high91 Ų9191.3 Ų91.355%0.55246%0.463SS*.Hα-helixtrans-60.4-50.7173.4170.90000109.8L312 Q313 Q318 L319 S320L312-V316 WeakPolarHBondContact O-CG2 3.43Å; L312-V316 PolarHBondContact O-N 3.24Å; Q313-V316 PolarHBondContact O-N 2.94Å; Q313-V316 VanDerWaalsContact O-N 3.15Å; V316-Q318 VanDerWaalsContact C-N 3.31Å; V316-Q318 PolarHBondContact O-N 3.39Å; V316-L319 PolarHBondContact O-N 2.96Å; V316-S320 WeakPolarHBondContact O-CB 3.42Å; V316-S320 PolarHBondContact O-N 3.22Å; V316-S320 PolarHBondContact O-OG 2.88Å; V316-S320 VanDerWaalsContact O-OG 3.05Å
317E98.7Very high98.2Very high106 Ų10695.9 Ų95.950%0.49547%0.473SS..Hα-helixtrans-58.8-40.1177.7-72.6174.1-168.700113.1Q313 R321Q313-E317 WeakPolarHBondContact O-CG 3.45Å; Q313-E317 PolarHBondContact O-N 3.42Å; E317-R321 WeakPolarHBondContact O-CB 3.5Å; E317-R321 WeakPolarHBondContact O-CG 3.43Å; E317-R321 PolarHBondContact O-N 3.49Å; E317-R321 PolarHBondContact O-NE 3.05Å
318Q98.6Very high98Very high77 Ų7796.6 Ų96.636%0.3647%0.469SS..Hα-helixtrans-60-54.6174.2-179.2-169.2-14.700110.9K314 K315 V316 S320 R321 E322K314-Q318 WeakPolarHBondContact O-CB 3.38Å; K314-Q318 PolarHBondContact O-N 3.32Å; K315-Q318 PolarHBondContact O-N 3.15Å; V316-Q318 VanDerWaalsContact C-N 3.31Å; V316-Q318 PolarHBondContact O-N 3.39Å; Q318-S320 VanDerWaalsContact C-N 3.3Å; Q318-S320 PolarHBondContact O-N 3.12Å; Q318-R321 WeakPolarHBondContact O-CB 3.49Å; Q318-R321 PolarHBondContact O-N 3.23Å; Q318-R321 VanDerWaalsContact O-N 3.15Å; Q318-E322 WeakPolarHBondContact CG-OE1 3.44Å; Q318-E322 PolarHBondContact NE2-OE1 3.46Å; Q318-E322 WeakPolarHBondContact O-CG 3.29Å; Q318-E322 PolarHBondContact O-N 3.41Å
319L98.6Very high97.8Very high75 Ų7597.3 Ų97.339%0.39347%0.474SS..Hα-helixtrans-63.7-37.6-178.2-67.9172.9000111.7K315 V316 R321 E322 L323K315-L319 HydrophobicContact CG-CD1 4.25Å; K315-L319 VanDerWaalsContact O-CG 3.32Å; K315-L319 WeakPolarHBondContact O-CG 3.4Å; K315-L319 PolarHBondContact O-N 3.35Å; V316-L319 PolarHBondContact O-N 2.96Å; L319-R321 VanDerWaalsContact C-N 3.34Å; L319-R321 PolarHBondContact O-N 3.37Å; L319-E322 PolarHBondContact O-N 3.05Å; L319-L323 WeakPolarHBondContact O-CB 3.34Å; L319-L323 WeakPolarHBondContact O-CG 3.48Å; L319-L323 PolarHBondContact O-N 3.27Å
320S98.3Very high97.5Very high68 Ų6899 Ų9948%0.47648%0.478SS..Hα-helixtrans-62-40.7174.4-68.30000112.1V316 Q318 S324V316-S320 WeakPolarHBondContact O-CB 3.42Å; V316-S320 PolarHBondContact O-N 3.22Å; V316-S320 PolarHBondContact O-OG 2.88Å; V316-S320 VanDerWaalsContact O-OG 3.05Å; Q318-S320 VanDerWaalsContact C-N 3.3Å; Q318-S320 PolarHBondContact O-N 3.12Å; S320-S324 WeakPolarHBondContact O-CB 3.33Å; S320-S324 PolarHBondContact O-N 3.17Å
321R98.5Very high97.1Very high158 Ų158102.3 Ų102.360%0.59649%0.49SS*.Hα-helixtrans-64.6-47.4173.3-77.7-179.7-73.3-164.5-4111.6E317 Q318 L319 L323 S324 T325E317-R321 WeakPolarHBondContact O-CB 3.5Å; E317-R321 WeakPolarHBondContact O-CG 3.43Å; E317-R321 PolarHBondContact O-N 3.49Å; E317-R321 PolarHBondContact O-NE 3.05Å; Q318-R321 WeakPolarHBondContact O-CB 3.49Å; Q318-R321 PolarHBondContact O-N 3.23Å; Q318-R321 VanDerWaalsContact O-N 3.15Å; L319-R321 VanDerWaalsContact C-N 3.34Å; L319-R321 PolarHBondContact O-N 3.37Å; R321-L323 PolarHBondContact O-N 2.86Å; R321-S324 PolarHBondContact O-N 3.49Å; R321-T325 PolarHBondContact O-N 3.25Å; R321-T325 PolarHBondContact O-OG1 3.45Å; R321-T325 VanDerWaalsContact O-OG1 3.06Å
322E98.1Very high96.5Very high92 Ų92103.4 Ų103.443%0.4350%0.501SS..Hα-helixtrans-57.9-46.3177.3-71172.7-163.700111.6Q318 L319 S324 T325 L326Q318-E322 WeakPolarHBondContact CG-OE1 3.44Å; Q318-E322 PolarHBondContact NE2-OE1 3.46Å; Q318-E322 WeakPolarHBondContact O-CG 3.29Å; Q318-E322 PolarHBondContact O-N 3.41Å; L319-E322 PolarHBondContact O-N 3.05Å; E322-S324 PolarHBondContact O-N 2.99Å; E322-T325 PolarHBondContact O-N 2.88Å; E322-L326 WeakPolarHBondContact O-CG 3.42Å; E322-L326 PolarHBondContact O-N 2.89Å
323L98.3Very high95.9Very high87 Ų87103.7 Ų103.746%0.45550%0.503SS..Hα-helixtrans-63.9-39175.7-74.1178.7000112.7L319 R321 L326 R327L319-L323 WeakPolarHBondContact O-CB 3.34Å; L319-L323 WeakPolarHBondContact O-CG 3.48Å; L319-L323 PolarHBondContact O-N 3.27Å; R321-L323 PolarHBondContact O-N 2.86Å; L323-L326 PolarHBondContact O-N 3Å; L323-R327 WeakPolarHBondContact O-CB 3.27Å; L323-R327 VanDerWaalsContact O-CG 3.28Å; L323-R327 WeakPolarHBondContact O-CG 3.34Å; L323-R327 PolarHBondContact O-N 3.33Å
324S97.6Very high94.8Very high57 Ų57101.8 Ų101.840%0.39950%0.5SS..Hα-helixtrans-63.6-44.4176-178.20000111.2S320 R321 E322 R327 N328S320-S324 WeakPolarHBondContact O-CB 3.33Å; S320-S324 PolarHBondContact O-N 3.17Å; R321-S324 PolarHBondContact O-N 3.49Å; E322-S324 PolarHBondContact O-N 2.99Å; S324-R327 PolarHBondContact O-N 2.97Å; S324-N328 WeakPolarHBondContact O-CB 3.46Å; S324-N328 VanDerWaalsContact O-CG 3.22Å; S324-N328 PolarHBondContact O-N 2.82Å; S324-N328 PolarHBondContact O-ND2 3.47Å
325T97.1Very high93.3Very high83 Ų83103.6 Ų103.651%0.50951%0.511SS..Hα-helixtrans-59.7-48.1175.3-57.20000111.2R321 E322 R327 N328 L329R321-T325 PolarHBondContact O-N 3.25Å; R321-T325 PolarHBondContact O-OG1 3.45Å; R321-T325 VanDerWaalsContact O-OG1 3.06Å; E322-T325 PolarHBondContact O-N 2.88Å; T325-R327 PolarHBondContact O-N 2.9Å; T325-N328 PolarHBondContact O-N 2.92Å; T325-L329 HydrophobicContact CG2-CD1 4.14Å; T325-L329 WeakPolarHBondContact O-CG 3.39Å; T325-L329 PolarHBondContact O-N 2.77Å
326L96.9Very high91.5Very high94 Ų94104.2 Ų104.249%0.49252%0.523SS..Hα-helixtrans-60.2-45.4177.1-72173.7000112E322 L323 N328 L329 F330E322-L326 WeakPolarHBondContact O-CG 3.42Å; E322-L326 PolarHBondContact O-N 2.89Å; L323-L326 PolarHBondContact O-N 3Å; L326-N328 VanDerWaalsContact C-N 3.31Å; L326-N328 PolarHBondContact O-N 3.28Å; L326-L329 HydrophobicContact CD2-CD1 4.43Å; L326-L329 WeakPolarHBondContact O-CB 3.39Å; L326-L329 PolarHBondContact O-N 3.36Å; L326-F330 WeakPolarHBondContact O-CD2 3.2Å; L326-F330 PolarHBondContact O-N 2.71Å
327R95Very high89.4Confident163 Ų163105.6 Ų105.662%0.61553%0.527SS*.Hα-helixtrans-61-40.2175.9-75.3173.5176.7151.3-0.4112.2L323 S324 T325 F330 K331L323-R327 WeakPolarHBondContact O-CB 3.27Å; L323-R327 VanDerWaalsContact O-CG 3.28Å; L323-R327 WeakPolarHBondContact O-CG 3.34Å; L323-R327 PolarHBondContact O-N 3.33Å; S324-R327 PolarHBondContact O-N 2.97Å; T325-R327 PolarHBondContact O-N 2.9Å; R327-F330 PolarHBondContact O-N 3.39Å; R327-K331 VanDerWaalsContact O-CG 3.29Å; R327-K331 WeakPolarHBondContact O-CG 3.36Å; R327-K331 PolarHBondContact O-N 3.44Å
328N94.6Very high87.5Confident74 Ų74104.2 Ų104.240%0.39652%0.523SS..Hα-helixtrans-66.5-39.7177.4-72-16.4000111.6S324 T325 L326 K331 Q332S324-N328 WeakPolarHBondContact O-CB 3.46Å; S324-N328 VanDerWaalsContact O-CG 3.22Å; S324-N328 PolarHBondContact O-N 2.82Å; S324-N328 PolarHBondContact O-ND2 3.47Å; T325-N328 PolarHBondContact O-N 2.92Å; L326-N328 VanDerWaalsContact C-N 3.31Å; L326-N328 PolarHBondContact O-N 3.28Å; N328-K331 PolarHBondContact O-N 3.08Å; N328-Q332 VanDerWaalsContact O-CG 3.29Å; N328-Q332 WeakPolarHBondContact O-CG 3.46Å; N328-Q332 PolarHBondContact O-N 3.32Å; N328-Q332 VanDerWaalsContact O-N 3.09Å
329L93.9Very high85.5Confident90 Ų90104.6 Ų104.647%0.47154%0.539SS..Hα-helixtrans-60.4-47.9173.3-71.5163.1000111.1T325 L326 K331 Q332 L333T325-L329 HydrophobicContact CG2-CD1 4.14Å; T325-L329 WeakPolarHBondContact O-CG 3.39Å; T325-L329 PolarHBondContact O-N 2.77Å; L326-L329 HydrophobicContact CD2-CD1 4.43Å; L326-L329 WeakPolarHBondContact O-CB 3.39Å; L326-L329 PolarHBondContact O-N 3.36Å; L329-K331 VanDerWaalsContact C-N 3.29Å; L329-K331 PolarHBondContact O-N 3.4Å; L329-Q332 PolarHBondContact O-N 3.41Å; L329-Q332 VanDerWaalsContact O-N 3.1Å; L329-L333 PolarHBondContact O-N 2.65Å
330F91.6Very high83.6Confident124 Ų124106 Ų10654%0.54456%0.555SS.*Hα-helixtrans-60.8-36.5176.6-91.1-81.3000113.1L326 R327 Q332 L333 L338L326-F330 WeakPolarHBondContact O-CD2 3.2Å; L326-F330 PolarHBondContact O-N 2.71Å; R327-F330 PolarHBondContact O-N 3.39Å; F330-Q332 VanDerWaalsContact C-N 3.31Å; F330-Q332 PolarHBondContact O-N 2.91Å; F330-L333 HydrophobicContact CD1-CD1 4.32Å; F330-L333 PolarHBondContact O-N 2.86Å; F330-L338 HydrophobicContact CD1-CD2 4.08Å; F330-L338 HydrophobicContact CE1-CD2 4.05Å
331K90.4Very high81.6Confident170 Ų170107.6 Ų107.674%0.73957%0.566SS**Hα-helixtrans-69.5-26175.6-74175.3178.4-171.30113.7R327 N328 L329R327-K331 VanDerWaalsContact O-CG 3.29Å; R327-K331 WeakPolarHBondContact O-CG 3.36Å; R327-K331 PolarHBondContact O-N 3.44Å; N328-K331 PolarHBondContact O-N 3.08Å; L329-K331 VanDerWaalsContact C-N 3.29Å; L329-K331 PolarHBondContact O-N 3.4Å
332Q87.6Confident79.5Confident153 Ų153103.2 Ų103.272%0.71557%0.57SS**Hα-helixtrans-85.2-14.6178.8-71.8173700112.7N328 L329 F330N328-Q332 VanDerWaalsContact O-CG 3.29Å; N328-Q332 WeakPolarHBondContact O-CG 3.46Å; N328-Q332 PolarHBondContact O-N 3.32Å; N328-Q332 VanDerWaalsContact O-N 3.09Å; L329-Q332 PolarHBondContact O-N 3.41Å; L329-Q332 VanDerWaalsContact O-N 3.1Å; F330-Q332 VanDerWaalsContact C-N 3.31Å; F330-Q332 PolarHBondContact O-N 2.91Å
333L84.6Confident77.3Confident81 Ų81107.6 Ų107.642%0.42459%0.59SS.*SBendtrans-71.9130.9177.1-71.8171.1000110.4L329 F330 E335L329-L333 PolarHBondContact O-N 2.65Å; F330-L333 HydrophobicContact CD1-CD1 4.32Å; F330-L333 PolarHBondContact O-N 2.86Å; L333-E335 PolarHBondContact O-N 2.92Å
334P76.2Confident74.6Confident76 Ų76113.3 Ų113.349%0.49464%0.635SS.*  trans-59.8134174.4-20.831.1000111.4P336 L337P334-P336 VanDerWaalsContact C-N 3.3Å; P334-P336 HydrophobicContact CB-CG 4.05Å; P334-P336 WeakPolarHBondContact O-CD 3.32Å; P334-P336 VanDerWaalsContact O-N 3.11Å; P334-L337 PolarHBondContact O-N 2.9Å; P334-L337 VanDerWaalsContact O-N 3.13Å
335E66.9Low73.4Confident170 Ų170116.2 Ų116.279%0.79465%0.647SS**Hα-helixtrans-44.9-36.7175.5-72.3-169.2160.800116.2L333 L337 L338 A339L333-E335 PolarHBondContact O-N 2.92Å; E335-L337 PolarHBondContact O-N 3.15Å; E335-L337 VanDerWaalsContact O-N 3.16Å; E335-L338 PolarHBondContact O-N 3.49Å; E335-A339 PolarHBondContact O-N 3.34Å
336P60.5Low72.2Confident99 Ų99117.9 Ų117.964%0.64365%0.654SS**Hα-helixtrans-64.7-19.2-178.822.4-35.1000115.1P334P334-P336 VanDerWaalsContact C-N 3.3Å; P334-P336 HydrophobicContact CB-CG 4.05Å; P334-P336 WeakPolarHBondContact O-CD 3.32Å; P334-P336 VanDerWaalsContact O-N 3.11Å
337L56.6Low70.8Confident121 Ų121119.2 Ų119.263%0.63466%0.663SS**Hα-helixtrans-88.1-23.8179-64.7178.2000113.2P334 E335P334-L337 PolarHBondContact O-N 2.9Å; P334-L337 VanDerWaalsContact O-N 3.13Å; E335-L337 PolarHBondContact O-N 3.15Å; E335-L337 VanDerWaalsContact O-N 3.16Å
338L57.8Low69.4Low77 Ų77116.6 Ų116.640%0.40367%0.666SS.*Hα-helixtrans-80.4-26.2177.5-71.5170.1000112.3F330 E335 S340 S341F330-L338 HydrophobicContact CD1-CD2 4.08Å; F330-L338 HydrophobicContact CE1-CD2 4.05Å; E335-L338 PolarHBondContact O-N 3.49Å; L338-S340 VanDerWaalsContact C-N 3.3Å; L338-S340 PolarHBondContact O-N 3.08Å; L338-S341 PolarHBondContact O-OG 3.4Å
339A57.7Low67.8Low85 Ų85119.3 Ų119.370%0.70268%0.683SS**G310 helixtrans-72.6-19.7177.800000113.7E335E335-A339 PolarHBondContact O-N 3.34Å
340S56.8Low66Low103 Ų103121.3 Ų121.372%0.7270%0.697SS**G310 helixtrans-81.8-14.5-176.1-172.80000114.4L338L338-S340 VanDerWaalsContact C-N 3.3Å; L338-S340 PolarHBondContact O-N 3.08Å
341S57.3Low64.2Low103 Ų103121.1 Ų121.172%0.7271%0.708SS**G310 helixtrans-98.67.1-175.762.70000114.6L338L338-S341 PolarHBondContact O-OG 3.4Å
342G55.1Low62.2Low65 Ų65117.3 Ų117.367%0.6771%0.706SS**SBendtrans-97.812.5-177.800000115.8
343H51.8Low60.1Low184 Ų184114.3 Ų114.385%0.85271%0.705SS**  trans-127.984.9176.4-108.363.7000109.8
344C39.9Very low57.9Low208 Ų208117.4 Ų117.4100%1.40573%0.731SS**  trans-152.90158.7-84.30000107.7

Retrieved 344 of 344 residues in 220.9 ms (Link to these results)