A0A077ZLC2_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZLC2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 304 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
1M40.4Very low39.7Very low242 Ų242156.9 Ų156.9100%1.19282%0.82SS**  0142.10-64.6169.7174.900108.8
2R40.8Very low39.7Very low253 Ų253154.8 Ų154.896%0.95581%0.809SS**  trans-90.2113.3177.2-69.3-172.6179.7-157.50.4109.9H4R2-H4 PolarHBondContact O-N 3Å
3Q40.4Very low39.6Very low182 Ų182150.1 Ų150.185%0.8580%0.796SS**  trans-73.5116.2171.7-77-174.6-17.100110R5Q3-R5 PolarHBondContact O-N 2.99Å
4H42.2Very low39.8Very low183 Ų183148.8 Ų148.885%0.84778%0.78SS**  trans-81.898.2175.3-151.3-85.7000108.9R2 S6R2-H4 PolarHBondContact O-N 3Å; H4-S6 PolarHBondContact O-N 2.69Å; H4-S6 VanDerWaalsContact O-N 3.08Å
5R41.6Very low39.9Very low230 Ų230147.9 Ų147.987%0.86878%0.777SS**  trans-68.9104.1175.9-78.7-176.6173.1169.8-2.6109.6Q3Q3-R5 PolarHBondContact O-N 2.99Å
6S39.7Very low39.8Very low103 Ų103147.9 Ų147.972%0.7276%0.764SS**  trans-61.2137.1170.4-61.50000110.7H4 A8H4-S6 PolarHBondContact O-N 2.69Å; H4-S6 VanDerWaalsContact O-N 3.08Å; S6-A8 PolarHBondContact O-N 2.88Å
7P43.7Very low39.6Very low115 Ų115146.1 Ų146.175%0.74776%0.761SS**  trans-68.1128.2174.528.1-33.4000110V9P7-V9 PolarHBondContact O-N 2.71Å; P7-V9 VanDerWaalsContact O-N 3.13Å
8A38.2Very low39.3Very low101 Ų101143.1 Ų143.184%0.83575%0.75SS**  trans-71.9105.2175.600000109.9S6 A10S6-A8 PolarHBondContact O-N 2.88Å; A8-A10 PolarHBondContact O-N 3.07Å
9V37.9Very low39Very low123 Ų123146 Ų14675%0.74575%0.75SS**  trans-72.792.3177.4-1790000109.5P7 M11P7-V9 PolarHBondContact O-N 2.71Å; P7-V9 VanDerWaalsContact O-N 3.13Å; V9-M11 PolarHBondContact O-N 3.26Å
10A37.7Very low38.7Very low92 Ų92146.5 Ų146.576%0.7675%0.747SS**  trans-65.2101.2176.500000110.9A8 L12A8-A10 PolarHBondContact O-N 3.07Å; A10-L12 VanDerWaalsContact C-N 3.32Å; A10-L12 PolarHBondContact O-N 3.36Å
11M34.3Very low38.5Very low102 Ų102146.9 Ų146.950%0.50275%0.75SS.*  trans-7678.6179.6-98.6-71.2-71.600111.5V9 C13 R298V9-M11 PolarHBondContact O-N 3.26Å; M11-C13 PolarHBondContact O-N 3.12Å; M11-R298 PolarHBondContact SD-NH2 3.08Å
12L39.1Very low38.3Very low131 Ų131140.7 Ų140.769%0.68673%0.725SS**  trans-77.783.4-179.8-168.256.5000111.4A10 F14A10-L12 VanDerWaalsContact C-N 3.32Å; A10-L12 PolarHBondContact O-N 3.36Å; L12-F14 VanDerWaalsContact C-N 3.3Å; L12-F14 HydrophobicContact CD2-CD2 4.17Å; L12-F14 HydrophobicContact CD2-CE2 3.42Å; L12-F14 VanDerWaalsContact CD2-CE2 3.42Å; L12-F14 HydrophobicContact CD2-CZ 3.98Å; L12-F14 HydrophobicContact CG-CD2 3.95Å; L12-F14 HydrophobicContact CG-CE2 3.66Å; L12-F14 HydrophobicContact CG-CZ 4.27Å; L12-F14 PolarHBondContact O-N 3.01Å
13C39.1Very low38.1Very low94 Ų94132.1 Ų132.164%0.63570%0.704SS**  trans-7173.2-179.3-71.90000113.2M11 N15M11-C13 PolarHBondContact O-N 3.12Å; C13-N15 PolarHBondContact O-N 3.08Å
14F41.9Very low38.2Very low132 Ų132126.9 Ų126.958%0.57968%0.684SS**  trans-61.9105169-82.4-68.2000111.1L12 Y16L12-F14 VanDerWaalsContact C-N 3.3Å; L12-F14 HydrophobicContact CD2-CD2 4.17Å; L12-F14 HydrophobicContact CD2-CE2 3.42Å; L12-F14 VanDerWaalsContact CD2-CE2 3.42Å; L12-F14 HydrophobicContact CD2-CZ 3.98Å; L12-F14 HydrophobicContact CG-CD2 3.95Å; L12-F14 HydrophobicContact CG-CE2 3.66Å; L12-F14 HydrophobicContact CG-CZ 4.27Å; L12-F14 PolarHBondContact O-N 3.01Å; F14-Y16 VanDerWaalsContact C-N 3.29Å; F14-Y16 HydrophobicContact CB-CD2 4.17Å; F14-Y16 HydrophobicContact CB-CE2 4.48Å; F14-Y16 PolarHBondContact O-N 2.81Å
15N41Very low38.1Very low136 Ų136122.4 Ų122.473%0.72767%0.672SS**  trans-72.885.9169.8-121.4-77.3000109C13 T17C13-N15 PolarHBondContact O-N 3.08Å; N15-T17 PolarHBondContact O-N 3.47Å
16Y38.5Very low38Very low148 Ų148116.4 Ų116.458%0.5866%0.66SS**  trans-71.577.7176.2-106.2-71.5000110.9F14 V18 W158F14-Y16 VanDerWaalsContact C-N 3.29Å; F14-Y16 HydrophobicContact CB-CD2 4.17Å; F14-Y16 HydrophobicContact CB-CE2 4.48Å; F14-Y16 PolarHBondContact O-N 2.81Å; Y16-V18 HydrophobicContact CD1-CG2 3.69Å; Y16-V18 HydrophobicContact CG-CG2 4.34Å; Y16-V18 PolarHBondContact O-N 3.11Å; Y16-W158 WeakPolarHBondContact OH-CH2 3.36Å; Y16-W158 WeakPolarHBondContact OH-CZ3 3.48Å
17T36.2Very low37.9Very low116 Ų116116.6 Ų116.671%0.71265%0.653SS**  trans-69.767.1158.2-51.90000108.3N15 R19N15-T17 PolarHBondContact O-N 3.47Å; T17-R19 PolarHBondContact O-N 3.12Å
18V34.1Very low37.7Very low92 Ų92114.2 Ų114.256%0.55864%0.639SS**  trans-55125.6170178.10000106.7Y16 F20Y16-V18 HydrophobicContact CD1-CG2 3.69Å; Y16-V18 HydrophobicContact CG-CG2 4.34Å; Y16-V18 PolarHBondContact O-N 3.11Å; V18-F20 PolarHBondContact O-N 3.46Å
19R33.9Very low37.8Very low199 Ų199118.7 Ų118.775%0.75163%0.634SS**  trans-74.870.7-174.2-62.4168.196.4141.8-0.9109.9T17 L21 V22T17-R19 PolarHBondContact O-N 3.12Å; R19-L21 PolarHBondContact O-N 2.7Å; R19-V22 HydrophobicContact CB-CG2 4.04Å; R19-V22 WeakPolarHBondContact O-CG2 3.33Å; R19-V22 PolarHBondContact O-N 2.93Å
20F34Very low37.8Very low155 Ų155119 Ų11968%0.6863%0.631SS**G310 helixtrans-56.4-13.2173.8-117.2-82.8000113.1V18 V22 V24V18-F20 PolarHBondContact O-N 3.46Å; F20-V22 PolarHBondContact O-N 3.48Å; F20-V24 VanDerWaalsContact O-CG2 3.32Å; F20-V24 WeakPolarHBondContact O-CG2 3.42Å
21L34.9Very low37.9Very low155 Ų155122.1 Ų122.181%0.81263%0.627SS**G310 helixtrans-64-15.8170.1-62.6171.5000114.4R19R19-L21 PolarHBondContact O-N 2.7Å
22V35.9Very low38.3Very low113 Ų113122.8 Ų122.869%0.68563%0.633SS**G310 helixtrans-84.9-13.2-177.3-176.50000113.1R19 F20R19-V22 HydrophobicContact CB-CG2 4.04Å; R19-V22 WeakPolarHBondContact O-CG2 3.33Å; R19-V22 PolarHBondContact O-N 2.93Å; F20-V22 PolarHBondContact O-N 3.48Å
23S36.4Very low38.3Very low72 Ų72120.3 Ų120.350%0.50363%0.632SS.*SBendtrans-121.56.1-173.7-49.60000115.1
24V41.1Very low38.3Very low72 Ų72119.4 Ų119.444%0.43664%0.638SS.*Hα-helixtrans-61.1-31.8-176.5-170.10000115.4F20 V26 S28F20-V24 VanDerWaalsContact O-CG2 3.32Å; F20-V24 WeakPolarHBondContact O-CG2 3.42Å; V24-V26 PolarHBondContact O-N 3.38Å; V24-V26 VanDerWaalsContact O-N 3.08Å; V24-S28 PolarHBondContact O-OG 3.13Å
25P40.7Very low38.3Very low90 Ų90122.9 Ų122.958%0.58465%0.648SS**Hα-helixtrans-62.7-17.9-175.1-2736000116.9
26V40.4Very low38.1Very low104 Ų104121.3 Ų121.363%0.6365%0.647SS**Hα-helixtrans-98.2-47-172.5-174.90000111.8V24 S28 R29V24-V26 PolarHBondContact O-N 3.38Å; V24-V26 VanDerWaalsContact O-N 3.08Å; V26-S28 VanDerWaalsContact C-N 3.3Å; V26-S28 PolarHBondContact O-N 2.9Å; V26-R29 WeakPolarHBondContact O-CB 3.22Å; V26-R29 PolarHBondContact O-N 2.79Å
27L36.6Very low37.8Very low107 Ų107117.8 Ų117.856%0.5666%0.656SS**Hα-helixtrans-63.7-33.3-178.1-78.6160.1000112.9R29 L30 F31L27-R29 PolarHBondContact O-N 2.95Å; L27-L30 PolarHBondContact O-N 3.16Å; L27-F31 PolarHBondContact O-N 3.21Å
28S39.9Very low37.6Very low65 Ų65120.4 Ų120.446%0.45567%0.665SS.*Hα-helixtrans-61.8-22.8174.9-58.50000113.6V24 V26 N32V24-S28 PolarHBondContact O-OG 3.13Å; V26-S28 VanDerWaalsContact C-N 3.3Å; V26-S28 PolarHBondContact O-N 2.9Å; S28-N32 PolarHBondContact O-N 2.83Å
29R40.3Very low37.5Very low194 Ų194121.2 Ų121.273%0.73268%0.675SS**Hα-helixtrans-77.7-42.9175.1-56.6-172.8-171.7-155.6-0.4111.3V26 L27 A33V26-R29 WeakPolarHBondContact O-CB 3.22Å; V26-R29 PolarHBondContact O-N 2.79Å; L27-R29 PolarHBondContact O-N 2.95Å; R29-A33 WeakPolarHBondContact O-CB 3.42Å; R29-A33 PolarHBondContact O-N 3.41Å; R29-A33 VanDerWaalsContact O-N 3.12Å
30L38.3Very low37.5Very low129 Ų129122.7 Ų122.768%0.67568%0.68SS**Hα-helixtrans-63.1-44.7176.1-110.970.6000112L27 A33 G34L27-L30 PolarHBondContact O-N 3.16Å; L30-A33 PolarHBondContact O-N 3.01Å; L30-G34 PolarHBondContact O-N 2.94Å
31F39.9Very low37.5Very low158 Ų158120.4 Ų120.469%0.69369%0.69SS**Hα-helixtrans-76.5-25.6-172.6-141.5-97.2000114L27L27-F31 PolarHBondContact O-N 3.21Å
32N43.2Very low37.5Very low117 Ų117116.5 Ų116.563%0.62669%0.687SS**Hα-helixtrans-81.6-33.2170.3-83.4-18.5000112.7S28 G34 R35 S36S28-N32 PolarHBondContact O-N 2.83Å; N32-G34 VanDerWaalsContact C-N 3.29Å; N32-G34 PolarHBondContact O-N 3.5Å; N32-R35 PolarHBondContact O-N 2.89Å; N32-S36 PolarHBondContact O-OG 3.39Å
33A39.1Very low37.5Very low79 Ų79120 Ų12065%0.65370%0.696SS**Hα-helixtrans-61-38.6175.600000112.3R29 L30 R35R29-A33 WeakPolarHBondContact O-CB 3.42Å; R29-A33 PolarHBondContact O-N 3.41Å; R29-A33 VanDerWaalsContact O-N 3.12Å; L30-A33 PolarHBondContact O-N 3.01Å; A33-R35 PolarHBondContact O-N 3.16Å
34G37.5Very low37.3Very low75 Ų75120.1 Ų120.177%0.77370%0.701SS**THydrogen-bonded Turntrans-741.4-179.500000116.4L30 N32L30-G34 PolarHBondContact O-N 2.94Å; N32-G34 VanDerWaalsContact C-N 3.29Å; N32-G34 PolarHBondContact O-N 3.5Å
35R41.6Very low37Very low205 Ų205125.4 Ų125.477%0.77472%0.72SS**THydrogen-bonded Turntrans-122.91.3-170.2-146.1170.7-175.21661.4115.8N32 A33N32-R35 PolarHBondContact O-N 2.89Å; A33-R35 PolarHBondContact O-N 3.16Å
36S38.6Very low36.8Very low102 Ų102127.4 Ų127.471%0.71373%0.731SS**  trans-104.50.7-173.9-54.10000114.7N32 L38N32-S36 PolarHBondContact O-OG 3.39Å; S36-L38 PolarHBondContact O-N 3.39Å; S36-L38 VanDerWaalsContact O-N 3.08Å
37G31.2Very low36.2Very low75 Ų75127.1 Ų127.177%0.77374%0.739SS**  trans-84.960-172.100000115.2
38L31.5Very low36Very low170 Ų170130 Ų13089%0.8975%0.75SS**  trans-162.248.9172.1-118.1170.5000116.1S36S36-L38 PolarHBondContact O-N 3.39Å; S36-L38 VanDerWaalsContact O-N 3.08Å
39S32.4Very low35.4Very low110 Ų110133.5 Ų133.577%0.76977%0.769SS**  trans-159.3113.4159.3-160.90000115.7
40R33.7Very low35.1Very low230 Ų230129.1 Ų129.187%0.86876%0.763SS**  trans52.396.5131.3-160.7177.1-169.6165.71.9120.9
41A34.4Very low34.5Very low107 Ų107133.6 Ų133.688%0.88477%0.771SS**  trans67.3143.5138.900000121
42G35.1Very low34.1Very low72 Ų72130.1 Ų130.174%0.74277%0.771SS**  trans140.8130.2168.300000113.8
43Q36Very low33.5Very low188 Ų188133.1 Ų133.188%0.87978%0.782SS**  trans-44.3132.8174.9-69.8134.4-100.200113.1
44A32.2Very low33.2Very low73 Ų73134.4 Ų134.460%0.60379%0.792SS**  89.1140.852.800000113.7
45H34.7Very low33Very low183 Ų183136 Ų13685%0.84779%0.791SS**  trans68141.6-175.2-39.4-79.4000114.1
46T35.6Very low32.7Very low133 Ų133134.3 Ų134.382%0.81680%0.797SS**  cis-127.3168.1-6.3470000110.4
47A28.6Very low32.5Very low97 Ų97135.1 Ų135.180%0.80280%0.8SS**  trans-97.8130.8169.600000110.8
48E31.7Very low32.7Very low168 Ų168138.6 Ų138.679%0.78581%0.806SS**  trans-120.4128162-91.1-128.9106.400109.8V50E48-V50 HydrophobicContact CB-CG2 4.49Å
49V28.9Very low32.8Very low139 Ų139135.2 Ų135.284%0.84280%0.803SS**  trans-112.980.5174.1179.60000107.9
50V32.8Very low33.2Very low102 Ų102134.7 Ų134.762%0.61881%0.805SS**  trans-101.893.3177.4-177.60000110.1E48 A52E48-V50 HydrophobicContact CB-CG2 4.49Å; V50-A52 HydrophobicContact CG1-CB 4.42Å; V50-A52 PolarHBondContact O-N 3.4Å
51R26.9Very low33.5Very low222 Ų222128.5 Ų128.584%0.83880%0.797SS**  trans-70.2106.5162.6170.9-168.4-82.5111.5-6.9108
52A29.8Very low33.8Very low85 Ų85131.4 Ų131.470%0.70279%0.792SS**  trans-119.9121170.700000110.4V50V50-A52 HydrophobicContact CG1-CB 4.42Å; V50-A52 PolarHBondContact O-N 3.4Å
53Q31.4Very low34Very low180 Ų180137.1 Ų137.184%0.84180%0.8SS**  trans-84138.6171.6-69.5171.2-34.700109.3
54A32.2Very low33.9Very low106 Ų106132.3 Ų132.388%0.87679%0.793SS**  trans-119.964.8179.400000111.1
55S33.5Very low34.4Very low108 Ų108134.7 Ų134.776%0.75580%0.802SS**  trans-92.8105.5170.550.90000109.9
56L35Very low34.5Very low171 Ų171137.3 Ų137.390%0.89580%0.804SS**PPolyproline II helixtrans-87.2133.6173.6-81.6160.8000110.3
57P34.5Very low34.7Very low119 Ų119139.4 Ų139.477%0.77381%0.809SS**PPolyproline II helixtrans-89.2152.9-170.434.8-36000113.9
58T35.1Very low35.2Very low147 Ų147146 Ų14690%0.90281%0.814SS**PPolyproline II helixtrans-87.1142.4161.2-540000109.4
59A35.3Very low35.7Very low100 Ų100145.4 Ų145.483%0.82682%0.821SS**PPolyproline II helixtrans-93.6139-17200000114
60A39.2Very low36.5Very low99 Ų99143.1 Ų143.182%0.81882%0.816SS**  trans-166.1160.9152.600000110.3
61S39.9Very low37Very low100 Ų100144.4 Ų144.470%0.69982%0.82SS**  trans-13.6152156.8-73.30000119.1
62E41.6Very low37.9Very low167 Ų167140.5 Ų140.578%0.7882%0.82SS**  cis-165.9-175.9-8.6-139.7150.312800109.4
63E37.9Very low38.5Very low192 Ų192146.4 Ų146.490%0.89783%0.825SS**  trans59.8147.9169.8-79.2-165.797.500119.6
64A34.7Very low39.2Very low88 Ų88147 Ų14773%0.72783%0.827SS**  trans-145.4150.6168.200000108.8
65P43.5Very low39.9Very low122 Ų122149.7 Ų149.779%0.79282%0.822SS**  -142.1118.4126.131.6-15.6000115.4
66R35.7Very low40.6Very low239 Ų239154.3 Ų154.390%0.90282%0.823SS**  trans17.7121.6134.6-59176.7176.3-174.2-1118.8
67L41.4Very low41.2Very low177 Ų177158.3 Ų158.393%0.92783%0.826SS**  trans-137.6150.2141.4-100.2171.6000110.4
68R37.4Very low41.7Very low236 Ų236156.3 Ų156.389%0.89183%0.827SS**  trans-129.4136.7178-76-178.9172.6176.7-3110
69V42.7Very low42.4Very low154 Ų154153.5 Ų153.593%0.93382%0.819SS**  trans-139.2151.9155-176.10000107.5
70A45.8Very low43.1Very low91 Ų91156.6 Ų156.675%0.75282%0.821SS**  trans-119.6172.5-165.500000114.8
71D42.6Very low43.7Very low130 Ų130161.7 Ų161.770%0.69583%0.825SS**  trans-36.5144.9176-171.820.5000117.1
72V46.3Very low44.1Very low139 Ų139162.4 Ų162.484%0.84283%0.827SS**  trans-138.6108.9159.9179.90000109
73R42.5Very low44.3Very low210 Ų210166.2 Ų166.279%0.79283%0.834SS**  trans-131.1152.1168.9-80.7-178.9162.2-169.3-2.7110.9
74Q46.7Very low44.6Very low191 Ų191161.4 Ų161.489%0.89383%0.827SS**  trans67.7105.9170.3-48.6-173.42400118.7
75Q47.3Very low45.2Very low163 Ų163169.1 Ų169.176%0.76284%0.838SS**  trans-155.993.6137-148157.1-125.800112.1
76R48.1Very low45.4Very low205 Ų205169.3 Ų169.377%0.77484%0.841SS**  87.5156.4103.8-75.1-176.9-161.7-141.67.7115.7
77R46.8Very low45.9Very low255 Ų255169.2 Ų169.296%0.96284%0.841SS**  trans71.3138.2173.2-39.8-178.9-163.6-138.32112.2
78G44.5Very low46.4Very low78 Ų78166.1 Ų166.180%0.80483%0.832SS**  cis153.51542.500000107.7
79A51.1Low46.7Very low87 Ų87159.7 Ų159.772%0.71983%0.829SS**  cis-156.7177.3-2.900000110.8
80D49Very low46.8Very low165 Ų165155.5 Ų155.588%0.88282%0.817SS**  trans70.8163.6158.5-56.7-36000122.4
81K52.1Low46.8Very low207 Ų207159.6 Ų159.690%0.982%0.821SS**  trans-147.2171.6-158.1-110.8-162.61681790112.3
82P48.5Very low47Very low114 Ų114160.8 Ų160.874%0.7483%0.827SS**  trans-112.6172.1-154.142.5-38.6000116.4
83R46.6Very low47Very low248 Ų248158.4 Ų158.494%0.93682%0.822SS**  trans-163.6165154.8-123.6175.2179.7-173.2-0.8115.9
84A44.3Very low47.6Very low90 Ų90155 Ų15574%0.74482%0.824SS**  trans64.6127.9171.200000117
85R46.6Very low47.6Very low251 Ų251152 Ų15295%0.94782%0.822SS**  cis84.498.142.4-86.1-163.2168.3-161.3-0.6115.2
86S48.2Very low47.6Very low125 Ų125147.7 Ų147.787%0.87482%0.821SS**  trans-166.5141.5138.950.40000110.6
87R45.7Very low47.8Very low238 Ų238147.6 Ų147.690%0.89883%0.826SS**  trans-167.9122.7172-175-179.6-176.3177.92111.7
88P52.6Low47.5Very low111 Ų111147.4 Ų147.472%0.72183%0.826SS**  trans-117.5161.2143.725.9-8.8000110.2
89A42Very low47.6Very low101 Ų101149.2 Ų149.284%0.83583%0.826SS**  cis89133.221.600000114.7
90G45.4Very low47.6Very low66 Ų66149.8 Ų149.868%0.6882%0.824SS**  trans114.4106.7-163.400000110.1
91E45.3Very low47.9Very low178 Ų178146.4 Ų146.483%0.83281%0.814SS**  cis100.5152.829.1-64.1-171133.400114.4
92N47.8Very low47.7Very low154 Ų154142 Ų14282%0.82480%0.8SS**  trans78.7112.6-175.9-48.4-59.3000114.2
93A46.6Very low47.7Very low90 Ų90147.5 Ų147.574%0.74481%0.806SS**  85.7139.767.200000112.1
94T54.2Low47.6Very low137 Ų137145.5 Ų145.584%0.8481%0.808SS**  cis-152.7167.93.5-0.60000109.1
95P48.1Very low47.7Very low129 Ų129146.8 Ų146.884%0.83881%0.811SS**  trans-92.1160.8-16636.6-35.9000115.9
96G46.8Very low47.7Very low73 Ų73139.5 Ų139.575%0.75381%0.805SS**  trans-128.4127.6-178.800000116
97K51Low47.4Very low203 Ų203140.1 Ų140.188%0.88380%0.803SS**  trans19.9108.6152.3-53.6177.5-175.4178.60117.3
98R42.2Very low47.5Very low251 Ų251132.7 Ų132.795%0.94779%0.793SS**  46.1108.881.2-70.9-171.1178.8178.20.6115.4
99S44.8Very low47.3Very low116 Ų116132.5 Ų132.581%0.81179%0.792SS**  trans-161.7161.6130.2-154.30000113.2
100S51.6Low47.5Very low98 Ų98133.9 Ų133.969%0.68579%0.785SS**  trans-19.2157.6159.2540000120.6
101S55.3Low47.3Very low94 Ų94136.5 Ų136.566%0.65779%0.788SS**  cis-170177.9-20.363.70000110.2
102D48.6Very low47.2Very low116 Ų116136.7 Ų136.762%0.6279%0.794SS**  trans58111.8155.8-64.6-67000122.2
103R47.2Very low47Very low228 Ų228139.5 Ų139.586%0.8679%0.793SS**  trans60.576.6131.3-59.1176.6-177178.9-0.5117.8S105R103-S105 PolarHBondContact O-N 3.15Å
104Q45.4Very low46.5Very low207 Ų207140.8 Ų140.897%0.96780%0.796SS**  trans-66.5120.4147.6-69.6178.2-27.300109.8
105S46.9Very low46.3Very low116 Ų116141.7 Ų141.781%0.81179%0.794SS**  trans-136.7155.5165.2-167.70000109R103 T107R103-S105 PolarHBondContact O-N 3.15Å; S105-T107 PolarHBondContact O-N 2.89Å
106A46.8Very low45.6Very low99 Ų99141 Ų14182%0.81879%0.792SS**  trans-65.7127.5-153.500000115.5A108A106-A108 PolarHBondContact O-N 3.3Å; A106-A108 VanDerWaalsContact O-N 3.14Å
107T41Very low45.7Very low138 Ų138142.9 Ų142.985%0.84779%0.791SS**  trans-7398.2169-54.90000111.2S105S105-T107 PolarHBondContact O-N 2.89Å
108A48.6Very low45.2Very low82 Ų82140.5 Ų140.568%0.67879%0.794SS**  trans52.3177.3130.900000119.6A106A106-A108 PolarHBondContact O-N 3.3Å; A106-A108 VanDerWaalsContact O-N 3.14Å
109P47Very low45.2Very low107 Ų107131.2 Ų131.270%0.69578%0.776SS**  cis-134.8-156.8-2.135.1-11.7000114
110N46.3Very low45Very low130 Ų130131.4 Ų131.470%0.69578%0.778SS**  trans8760155.8-59.6-13.9000120.2L112N110-L112 PolarHBondContact O-N 3.16Å
111T42.6Very low44.3Very low121 Ų121130.8 Ų130.874%0.74278%0.778SS**  20.286.6114.4-34.70000117.8R113T111-R113 HydrophobicContact CG2-CB 4.23Å; T111-R113 PolarHBondContact O-N 2.85Å
112L43.3Very low43.8Very low182 Ų182134.7 Ų134.795%0.95379%0.791SS**  trans-77.297.4163.2-83.4168.7000110.4N110N110-L112 PolarHBondContact O-N 3.16Å
113R43.3Very low43.6Very low212 Ų212140.9 Ų140.980%0.881%0.806SS**  trans-129111.8177.2-132.7176.7-176.91740.2111.4T111T111-R113 HydrophobicContact CG2-CB 4.23Å; T111-R113 PolarHBondContact O-N 2.85Å
114S35.8Very low43.7Very low117 Ų117134.7 Ų134.782%0.81880%0.803SS**  trans38.787.8150.5-179.10000118.2
115I49.5Very low43.8Very low156 Ų156131 Ų13180%0.879%0.79SS**  trans-134.1112154.9-55.4179.4000108.8
116S34.4Very low44Very low114 Ų114131 Ų13180%0.79779%0.787SS**  trans-97.6114.9168.4-670000109.4
117P48.5Very low43.9Very low113 Ų113130.5 Ų130.573%0.73478%0.777SS**  trans-101.785.5179.935.4-28.3000111.5G119P117-G119 PolarHBondContact O-N 2.95Å
118T41.1Very low44.6Very low154 Ų154129 Ų12995%0.94577%0.772SS**  trans-71.480.7158.5-56.10000107.8
119G40.9Very low44.6Very low55 Ų55132.5 Ų132.557%0.56777%0.774SS**  trans-16688.2-167.700000115P117P117-G119 PolarHBondContact O-N 2.95Å
120S40.6Very low44.8Very low121 Ų121130.8 Ų130.885%0.84678%0.777SS**  trans30.2143.9139.660.30000122.9
121A38Very low45.2Very low84 Ų84131 Ų13169%0.69478%0.782SS**  trans85.489.814900000119.9
122L44.4Very low45.6Very low177 Ų177128.6 Ų128.693%0.92777%0.765SS**  48.876.6126.3-59.3173.5000118.2
123R44.8Very low46.4Very low246 Ų246124.4 Ų124.493%0.92875%0.749SS**  trans-153138.4157.6-120.2171.1-172.8-124.9-0.8115.4
124A49.1Very low47Very low98 Ų98122.5 Ų122.581%0.8175%0.747SS**  trans62.8129.3165.100000119.5
125N46.5Very low47.9Very low129 Ų129121.1 Ų121.169%0.6974%0.736SS**  trans-76.7123.9167168.937.7000110.4C127N125-C127 PolarHBondContact ND2-SG 3.02Å; N125-C127 PolarHBondContact O-N 3.24Å
126P51.5Low48Very low116 Ų116121.7 Ų121.775%0.75373%0.728SS**  trans-81.878-177.933.8-35.9000112.4S128P126-S128 VanDerWaalsContact C-N 3.35Å; P126-S128 PolarHBondContact O-N 3.48Å
127C44.9Very low49.3Very low89 Ų89120.2 Ų120.260%0.60171%0.711SS**  trans-72.390.2161.8-74.40000109.5N125 E129N125-C127 PolarHBondContact ND2-SG 3.02Å; N125-C127 PolarHBondContact O-N 3.24Å; C127-E129 PolarHBondContact O-N 3.36Å
128S54.8Low49.6Very low106 Ų106119 Ų11974%0.74170%0.703SS**  trans-59.8132.5-178.147.80000112.5P126 G130P126-S128 VanDerWaalsContact C-N 3.35Å; P126-S128 PolarHBondContact O-N 3.48Å; S128-G130 PolarHBondContact O-N 3.12Å
129E48.5Very low50.4Low155 Ų155117.9 Ų117.972%0.72469%0.691SS**THydrogen-bonded Turntrans-77104.8-176.5-178146.9-125.400110.6C127 R136C127-E129 PolarHBondContact O-N 3.36Å; E129-R136 IonicContact OE1-CZ 3.19Å; E129-R136 IonicContact OE1-NH1 2.78Å; E129-R136 PolarHBondContact OE1-NH1 2.97Å; E129-R136 IonicContact OE1-NH2 2.69Å; E129-R136 PolarHBondContact OE1-NH2 2.88Å; E129-R136 IonicContact OE2-NH2 3.94Å
130G52.5Low51.1Low72 Ų72119.3 Ų119.374%0.74269%0.692SS**THydrogen-bonded Turntrans170.4-27172.600000119.3S128S128-G130 PolarHBondContact O-N 3.12Å
131T53.3Low51.7Low133 Ų133115.9 Ų115.982%0.81667%0.671SS**SBendtrans-134.2-4-156-15.50000119.1
132D52.3Low52.4Low72 Ų72117.2 Ų117.239%0.38567%0.666SS.*  trans-150111.3176.2-169.40.5000114.2F134 C135D132-F134 VanDerWaalsContact C-N 3.28Å; D132-F134 PolarHBondContact O-N 3.44Å; D132-F134 VanDerWaalsContact OD1-CB 3.31Å; D132-F134 WeakPolarHBondContact OD1-CB 3.26Å; D132-F134 WeakPolarHBondContact OD1-CD2 3.37Å; D132-F134 PolarHBondContact OD1-N 3.17Å; D132-C135 HydrophobicContact CB-CB 4.06Å; D132-C135 PolarHBondContact O-N 2.96Å; D132-C135 PolarHBondContact OD2-SG 3.08Å
133P58.8Low52.8Low93 Ų93116.1 Ų116.160%0.60465%0.654SS**G310 helixtrans-67.3-26.6173.629.2-34.6000112.8C135 R136P133-C135 PolarHBondContact O-N 3.42Å; P133-R136 PolarHBondContact O-N 2.84Å; P133-R136 VanDerWaalsContact O-N 3.16Å
134F57.5Low52.7Low172 Ų172111.2 Ų111.275%0.75465%0.646SS**G310 helixtrans-70.8-18.6177.3-60.4-76.7000112.4D132D132-F134 VanDerWaalsContact C-N 3.28Å; D132-F134 PolarHBondContact O-N 3.44Å; D132-F134 VanDerWaalsContact OD1-CB 3.31Å; D132-F134 WeakPolarHBondContact OD1-CB 3.26Å; D132-F134 WeakPolarHBondContact OD1-CD2 3.37Å; D132-F134 PolarHBondContact OD1-N 3.17Å
135C53.6Low52.6Low89 Ų89115 Ų11560%0.60164%0.64SS**G310 helixtrans-84.4-2.2172.9-74.20000114.2D132 P133D132-C135 HydrophobicContact CB-CB 4.06Å; D132-C135 PolarHBondContact O-N 2.96Å; D132-C135 PolarHBondContact OD2-SG 3.08Å; P133-C135 PolarHBondContact O-N 3.42Å
136R51.6Low52.7Low167 Ų167113.7 Ų113.763%0.6364%0.638SS**SBendtrans-107.4-5.6174.3-80.7-167169.4178.9-2.2115.1E129 P133 P138E129-R136 IonicContact OE1-CZ 3.19Å; E129-R136 IonicContact OE1-NH1 2.78Å; E129-R136 PolarHBondContact OE1-NH1 2.97Å; E129-R136 IonicContact OE1-NH2 2.69Å; E129-R136 PolarHBondContact OE1-NH2 2.88Å; E129-R136 IonicContact OE2-NH2 3.94Å; P133-R136 PolarHBondContact O-N 2.84Å; P133-R136 VanDerWaalsContact O-N 3.16Å; R136-P138 WeakPolarHBondContact O-CD 3.45Å
137L61.8Low52.8Low83 Ų83114.4 Ų114.444%0.43563%0.631SS.*SBendtrans-75124.6168.1-86.179.5000109.8L139 L142L137-L139 PolarHBondContact O-N 2.78Å; L137-L142 HydrophobicContact CD2-CD2 3.91Å; L137-L142 HydrophobicContact CD2-CG 4.16Å
138P56.2Low53.1Low87 Ų87112.3 Ų112.357%0.56562%0.62SS**  trans-63.1133.8164.228.1-32.5000108.3R136 S140 A141R136-P138 WeakPolarHBondContact O-CD 3.45Å; P138-S140 PolarHBondContact O-N 3.27Å; P138-A141 HydrophobicContact CG-CB 4.35Å; P138-A141 WeakPolarHBondContact O-CB 3.21Å; P138-A141 PolarHBondContact O-N 2.88Å
139L57.7Low52.8Low131 Ų131112 Ų11269%0.68661%0.613SS**G310 helixtrans-49.8-35.2-175.7-81.5157.1000113.1L137 A141 L142 F143L137-L139 PolarHBondContact O-N 2.78Å; L139-A141 PolarHBondContact O-N 3.46Å; L139-A141 VanDerWaalsContact O-N 3.14Å; L139-L142 PolarHBondContact O-N 3.22Å; L139-L142 VanDerWaalsContact O-N 3.11Å; L139-F143 WeakPolarHBondContact O-CD2 3.49Å
140S54.3Low53.2Low85 Ų85109.9 Ų109.959%0.59460%0.603SS**G310 helixtrans-54.5-26.9176-37.10000114.8P138 L142P138-S140 PolarHBondContact O-N 3.27Å; S140-L142 VanDerWaalsContact C-N 3.34Å
141A53.8Low53.4Low50 Ų50111.5 Ų111.541%0.41359%0.594SS.*G310 helixtrans-73-24.3179.700000113.2P138 L139P138-A141 HydrophobicContact CG-CB 4.35Å; P138-A141 WeakPolarHBondContact O-CB 3.21Å; P138-A141 PolarHBondContact O-N 2.88Å; L139-A141 PolarHBondContact O-N 3.46Å; L139-A141 VanDerWaalsContact O-N 3.14Å
142L53.6Low54Low111 Ų111107.3 Ų107.358%0.58158%0.578SS**G310 helixtrans-88.1-10.7179.8-66.7174000113.5L137 L139 S140L137-L142 HydrophobicContact CD2-CD2 3.91Å; L137-L142 HydrophobicContact CD2-CG 4.16Å; L139-L142 PolarHBondContact O-N 3.22Å; L139-L142 VanDerWaalsContact O-N 3.11Å; S140-L142 VanDerWaalsContact C-N 3.34Å
143F52.4Low54.4Low155 Ų155107.3 Ų107.368%0.6858%0.578SS**THydrogen-bonded Turntrans-109.6-2.4-179.6-68.8-75.1000114.2L139L139-F143 WeakPolarHBondContact O-CD2 3.49Å
144N43.1Very low54.3Low143 Ų143108.4 Ų108.477%0.76558%0.578SS**  trans-97.911.5173-96.9-36.1000113.6
145W46.8Very low54.6Low178 Ų178105.2 Ų105.267%0.67457%0.568SS**  trans-78.3120.2169.7-150.1-98.3000108.5E147 A148W145-E147 PolarHBondContact NE1-OE2 2.84Å; W145-E147 PolarHBondContact O-N 2.92Å; W145-A148 WeakPolarHBondContact O-CB 3.34Å; W145-A148 PolarHBondContact O-N 3.28Å
146P48.5Very low55.1Low100 Ų100109.1 Ų109.165%0.64957%0.57SS**THydrogen-bonded Turntrans-63.7-20.6-167.423.5-33.8000114A148 V149P146-A148 PolarHBondContact O-N 3.41Å; P146-V149 PolarHBondContact O-N 2.98Å
147E53.8Low55.5Low132 Ų132106.6 Ų106.662%0.61757%0.568SS**THydrogen-bonded Turntrans-60.7-24.8174.2-153.7168.3-178.500113.2W145 V149 H150 L151W145-E147 PolarHBondContact NE1-OE2 2.84Å; W145-E147 PolarHBondContact O-N 2.92Å; E147-V149 VanDerWaalsContact C-N 3.31Å; E147-V149 PolarHBondContact O-N 2.99Å; E147-H150 PolarHBondContact O-N 3.44Å; E147-L151 WeakPolarHBondContact O-CD1 3.46Å
148A50.3Low55.5Low44 Ų44108.4 Ų108.436%0.36457%0.569SS.*Hα-helixtrans-69.6-23.9-179.300000114W145 P146 H150 L151W145-A148 WeakPolarHBondContact O-CB 3.34Å; W145-A148 PolarHBondContact O-N 3.28Å; P146-A148 PolarHBondContact O-N 3.41Å; A148-H150 VanDerWaalsContact C-N 3.29Å; A148-H150 PolarHBondContact O-N 3.37Å; A148-L151 PolarHBondContact O-N 2.99Å
149V48.9Very low55.5Low99 Ų99107.6 Ų107.660%0.656%0.563SS**Hα-helixtrans-60.9-42.6177.4-179.20000110.2P146 E147 L151 G152P146-V149 PolarHBondContact O-N 2.98Å; E147-V149 VanDerWaalsContact C-N 3.31Å; E147-V149 PolarHBondContact O-N 2.99Å; V149-L151 PolarHBondContact O-N 3.43Å; V149-G152 PolarHBondContact O-N 3.43Å
150H57.1Low55.4Low111 Ų111110 Ų11051%0.51456%0.563SS.*Hα-helixtrans-78.1-15-175.5-55.8-50.9000114.1E147 A148 G152 D153 L154E147-H150 PolarHBondContact O-N 3.44Å; A148-H150 VanDerWaalsContact C-N 3.29Å; A148-H150 PolarHBondContact O-N 3.37Å; H150-G152 VanDerWaalsContact C-N 3.27Å; H150-G152 PolarHBondContact O-N 3.38Å; H150-D153 PolarHBondContact O-N 3.39Å; H150-L154 WeakPolarHBondContact O-CB 3.17Å; H150-L154 VanDerWaalsContact O-CD1 3.31Å; H150-L154 WeakPolarHBondContact O-CD1 3.42Å; H150-L154 PolarHBondContact O-N 3.42Å
151L56.9Low55.3Low106 Ų106107.9 Ų107.956%0.55555%0.55SS**Hα-helixtrans-64.9-33.7171.4-91.874.2000111.7E147 A148 V149 L155E147-L151 WeakPolarHBondContact O-CD1 3.46Å; A148-L151 PolarHBondContact O-N 2.99Å; V149-L151 PolarHBondContact O-N 3.43Å; L151-L155 WeakPolarHBondContact O-CB 3.32Å; L151-L155 WeakPolarHBondContact O-CG 3.41Å; L151-L155 PolarHBondContact O-N 2.91Å; L151-L155 VanDerWaalsContact O-N 3.08Å
152G65.2Low55.2Low46 Ų46107.5 Ų107.547%0.47455%0.545SS..Hα-helixtrans-62.1-45.5172.700000111.7V149 H150 R156V149-G152 PolarHBondContact O-N 3.43Å; H150-G152 VanDerWaalsContact C-N 3.27Å; H150-G152 PolarHBondContact O-N 3.38Å; G152-R156 VanDerWaalsContact O-CB 3.22Å; G152-R156 WeakPolarHBondContact O-CB 3.31Å; G152-R156 PolarHBondContact O-N 3.34Å
153D59.9Low54.9Low71 Ų71106.8 Ų106.838%0.3855%0.545SS..Hα-helixtrans-70.9-41.5178.8-68.7-42000112.8H150 L155 R156 I157H150-D153 PolarHBondContact O-N 3.39Å; D153-L155 VanDerWaalsContact C-N 3.35Å; D153-L155 PolarHBondContact O-N 3.02Å; D153-R156 PolarHBondContact O-N 2.93Å; D153-I157 WeakPolarHBondContact O-CB 3.25Å; D153-I157 WeakPolarHBondContact O-CD1 3.41Å; D153-I157 WeakPolarHBondContact O-CG1 3.47Å; D153-I157 PolarHBondContact O-N 3.01Å
154L57.9Low54.8Low117 Ų117105.2 Ų105.261%0.61354%0.544SS*.Hα-helixtrans-58.7-45.2174.4-98.772.2000111.5H150 W158H150-L154 WeakPolarHBondContact O-CB 3.17Å; H150-L154 VanDerWaalsContact O-CD1 3.31Å; H150-L154 WeakPolarHBondContact O-CD1 3.42Å; H150-L154 PolarHBondContact O-N 3.42Å; L154-W158 VanDerWaalsContact O-CB 3.25Å; L154-W158 WeakPolarHBondContact O-CB 3.35Å; L154-W158 PolarHBondContact O-N 3.25Å
155L64.3Low54.9Low104 Ų104104.4 Ų104.455%0.54554%0.539SS..Hα-helixtrans-66.2-38176-71.8170.4000111.9L151 D153 W158 V159L151-L155 WeakPolarHBondContact O-CB 3.32Å; L151-L155 WeakPolarHBondContact O-CG 3.41Å; L151-L155 PolarHBondContact O-N 2.91Å; L151-L155 VanDerWaalsContact O-N 3.08Å; D153-L155 VanDerWaalsContact C-N 3.35Å; D153-L155 PolarHBondContact O-N 3.02Å; L155-W158 PolarHBondContact O-N 2.89Å; L155-V159 WeakPolarHBondContact O-CB 3.31Å; L155-V159 VanDerWaalsContact O-CG2 3.26Å; L155-V159 WeakPolarHBondContact O-CG2 3.43Å; L155-V159 PolarHBondContact O-N 3.33Å
156R64.2Low54.7Low171 Ų171105.9 Ų105.965%0.64555%0.546SS*.Hα-helixtrans-68.8-38.3178.1-170.1179.7-169.7-175.54112.9G152 D153 R160G152-R156 VanDerWaalsContact O-CB 3.22Å; G152-R156 WeakPolarHBondContact O-CB 3.31Å; G152-R156 PolarHBondContact O-N 3.34Å; D153-R156 PolarHBondContact O-N 2.93Å; R156-R160 PolarHBondContact O-N 3.16Å
157I59.4Low54.1Low115 Ų115103.1 Ų103.159%0.5954%0.535SS*.Hα-helixtrans-67.9-46.8173.3-69164.3000109.5D153 R160 A161D153-I157 WeakPolarHBondContact O-CB 3.25Å; D153-I157 WeakPolarHBondContact O-CD1 3.41Å; D153-I157 WeakPolarHBondContact O-CG1 3.47Å; D153-I157 PolarHBondContact O-N 3.01Å; I157-R160 PolarHBondContact O-N 3.04Å; I157-A161 WeakPolarHBondContact O-CB 3.49Å; I157-A161 PolarHBondContact O-N 3.35Å
158W61.3Low53.5Low120 Ų120105.7 Ų105.746%0.45555%0.552SS.*Hα-helixtrans-66.1-42.3-178.8-166.958.6000112.5Y16 L154 L155 R160 A161 S162Y16-W158 WeakPolarHBondContact OH-CH2 3.36Å; Y16-W158 WeakPolarHBondContact OH-CZ3 3.48Å; L154-W158 VanDerWaalsContact O-CB 3.25Å; L154-W158 WeakPolarHBondContact O-CB 3.35Å; L154-W158 PolarHBondContact O-N 3.25Å; L155-W158 PolarHBondContact O-N 2.89Å; W158-R160 VanDerWaalsContact C-N 3.32Å; W158-R160 PolarHBondContact O-N 3.33Å; W158-A161 PolarHBondContact O-N 3.14Å; W158-A161 VanDerWaalsContact O-N 3.16Å; W158-S162 PolarHBondContact O-N 3.11Å; W158-S162 PolarHBondContact O-OG 3.08Å
159V55.8Low52.8Low71 Ų71106.3 Ų106.343%0.4356%0.563SS.*Hα-helixtrans-59.5-41.6172.6168.20000111.2L155 T163L155-V159 WeakPolarHBondContact O-CB 3.31Å; L155-V159 VanDerWaalsContact O-CG2 3.26Å; L155-V159 WeakPolarHBondContact O-CG2 3.43Å; L155-V159 PolarHBondContact O-N 3.33Å; V159-T163 PolarHBondContact O-N 3.16Å; V159-T163 VanDerWaalsContact O-N 3.15Å; V159-T163 PolarHBondContact O-OG1 2.83Å
160R55.4Low52.2Low182 Ų182110.3 Ų110.369%0.68757%0.573SS**Hα-helixtrans-67.1-36.1174.4-90.6-176.5159.8-174.3-7.3113.5R156 I157 W158 T163 N164R156-R160 PolarHBondContact O-N 3.16Å; I157-R160 PolarHBondContact O-N 3.04Å; W158-R160 VanDerWaalsContact C-N 3.32Å; W158-R160 PolarHBondContact O-N 3.33Å; R160-T163 WeakPolarHBondContact CA-OG1 3.45Å; R160-T163 PolarHBondContact O-N 3.29Å; R160-T163 PolarHBondContact O-OG1 3.03Å; R160-N164 PolarHBondContact O-N 3.46Å; R160-N164 PolarHBondContact O-ND2 2.96Å
161A53.3Low51.1Low39 Ų39111 Ų11132%0.32259%0.59SS.*Hα-helixtrans-67.9-47.8176.300000111.1I157 W158 T163 N164 L165I157-A161 WeakPolarHBondContact O-CB 3.49Å; I157-A161 PolarHBondContact O-N 3.35Å; W158-A161 PolarHBondContact O-N 3.14Å; W158-A161 VanDerWaalsContact O-N 3.16Å; A161-T163 PolarHBondContact O-N 2.76Å; A161-N164 PolarHBondContact O-N 3.21Å; A161-L165 PolarHBondContact O-N 3.15Å
162S50.3Low50.7Low43 Ų43117.2 Ų117.230%0.30161%0.606SS.*Hα-helixtrans-61.2-27.5175.9-66.20000113.3W158 Y166W158-S162 PolarHBondContact O-N 3.11Å; W158-S162 PolarHBondContact O-OG 3.08Å; S162-Y166 WeakPolarHBondContact O-CD2 3.34Å
163T48.1Very low49.3Very low96 Ų96121.4 Ų121.459%0.58962%0.622SS**THydrogen-bonded Turntrans-79.8-12.4171.750.80000115.1V159 R160 A161V159-T163 PolarHBondContact O-N 3.16Å; V159-T163 VanDerWaalsContact O-N 3.15Å; V159-T163 PolarHBondContact O-OG1 2.83Å; R160-T163 WeakPolarHBondContact CA-OG1 3.45Å; R160-T163 PolarHBondContact O-N 3.29Å; R160-T163 PolarHBondContact O-OG1 3.03Å; A161-T163 PolarHBondContact O-N 2.76Å
164N49.8Very low48.5Very low122 Ų122124.1 Ų124.165%0.65264%0.642SS**THydrogen-bonded Turntrans-100.1-23.9175.2-78.1-84.3000113.1R160 A161 Y166R160-N164 PolarHBondContact O-N 3.46Å; R160-N164 PolarHBondContact O-ND2 2.96Å; A161-N164 PolarHBondContact O-N 3.21Å; N164-Y166 VanDerWaalsContact C-N 3.26Å; N164-Y166 PolarHBondContact O-N 2.82Å
165L46.3Very low47.5Very low126 Ų126127.5 Ų127.566%0.6665%0.654SS**THydrogen-bonded Turntrans-79.2-1.8179.5-72164.9000114.6A161A161-L165 PolarHBondContact O-N 3.15Å
166Y41.3Very low46.5Very low209 Ų209127.4 Ų127.482%0.8266%0.662SS**THydrogen-bonded Turntrans-126.554.3172-63-74.1000110.3S162 N164S162-Y166 WeakPolarHBondContact O-CD2 3.34Å; N164-Y166 VanDerWaalsContact C-N 3.26Å; N164-Y166 PolarHBondContact O-N 2.82Å
167G36.8Very low45.5Very low41 Ų41125.6 Ų125.642%0.42367%0.67SS.*  trans-135.5-2.4-167.300000118G169G167-G169 VanDerWaalsContact C-N 3.29Å; G167-G169 PolarHBondContact O-N 3.01Å
168L40.2Very low44.6Very low186 Ų186125.8 Ų125.897%0.97468%0.679SS**  trans-7283.3170.2-8285.7000109.7
169G36.3Very low43.7Very low58 Ų58127.7 Ų127.760%0.59870%0.698SS**  trans179.722.7-174.500000118.7G167G167-G169 VanDerWaalsContact C-N 3.29Å; G167-G169 PolarHBondContact O-N 3.01Å
170F35.4Very low43Very low183 Ų183128.3 Ų128.380%0.80371%0.711SS**  trans-135.564.7178-69.3-69.8000113.7R172F170-R172 PolarHBondContact O-N 3.4Å
171S35.6Very low42.3Very low125 Ų125126.6 Ų126.687%0.87472%0.721SS**  trans-57.1132.3168.6-56.90000111.2
172R48.5Very low41.8Very low236 Ų236127.9 Ų127.989%0.89174%0.737SS**  trans-116116.2166.1-59.1-176.2-161.3-117.51.2107.7F170F170-R172 PolarHBondContact O-N 3.4Å
173T34.6Very low41Very low134 Ų134133.4 Ų133.482%0.82276%0.764SS**  trans-69.5128.6-175.2-39.80000111.4
174V44.3Very low40.7Very low129 Ų129132.6 Ų132.678%0.78277%0.767SS**  trans-138.3131.8157.4154.20000106.5
175E35.5Very low40.4Very low187 Ų187130.9 Ų130.987%0.87477%0.769SS**  trans-81125.7176-70.8175.298.200111.2
176S44.4Very low40Very low103 Ų103134.9 Ų134.972%0.7278%0.782SS**  trans-154.799152.463.80000111.1
177V43.2Very low39.8Very low132 Ų132130.7 Ų130.780%0.878%0.781SS**  trans39.9108.8154.4-170.40000117.7
178P41Very low40Very low120 Ų120132 Ų13278%0.77980%0.795SS**  trans-78.6145171.533.6-33.8000111.9
179N41.4Very low39.7Very low159 Ų159130.7 Ų130.785%0.8579%0.789SS**  trans-159.7124.7151.5-116.5-28.4000113.4
180A40.5Very low40.2Very low85 Ų85135.1 Ų135.170%0.70280%0.798SS**  trans57128.4157.400000121.9
181T41Very low40.5Very low146 Ų146132 Ų13290%0.89679%0.794SS**  trans84.7126.1147.8-46.10000119.2
182G43Very low40.7Very low65 Ų65130.9 Ų130.967%0.6779%0.792SS**  trans97.793.7154.600000115.5A184G182-A184 PolarHBondContact O-N 2.69Å
183D33.2Very low40.3Very low160 Ų160126.9 Ų126.986%0.85679%0.786SS**  trans-65124.1160.2-174.73.9000109.1A185D183-A185 PolarHBondContact OD1-N 2.84Å
184A43Very low40.2Very low79 Ų79126.5 Ų126.565%0.65379%0.789SS**  trans-139.452.9-17300000110.5G182 F186G182-A184 PolarHBondContact O-N 2.69Å; A184-F186 PolarHBondContact O-N 2.78Å; A184-F186 VanDerWaalsContact O-N 3.16Å
185A43.8Very low39.9Very low86 Ų86123.7 Ų123.771%0.71179%0.787SS**  trans-57.7115.5173.300000111.3D183 C187D183-A185 PolarHBondContact OD1-N 2.84Å; A185-C187 PolarHBondContact O-N 3.44Å
186F36.5Very low39.8Very low209 Ų209124.2 Ų124.292%0.91779%0.789SS**  trans-65.4100.4176.6-81.4-96.7000111A184A184-F186 PolarHBondContact O-N 2.78Å; A184-F186 VanDerWaalsContact O-N 3.16Å
187C38.7Very low39.3Very low121 Ų121125 Ų12582%0.81879%0.791SS**  trans-72.9137.4166.8-160.80000109.8A185 D189A185-C187 PolarHBondContact O-N 3.44Å; C187-D189 PolarHBondContact O-N 2.98Å
188G40.7Very low39.2Very low69 Ų69122.5 Ų122.571%0.71179%0.793SS**  trans-90.199.7-171.500000113.6I190G188-I190 PolarHBondContact O-N 2.94Å
189D33.4Very low39Very low158 Ų158122.3 Ų122.385%0.84579%0.794SS**  trans-67.788.4172-81.4-37.8000112.3C187C187-D189 PolarHBondContact O-N 2.98Å
190I46.6Very low39.2Very low152 Ų152119.7 Ų119.778%0.77979%0.788SS**  trans-121.294.4161.1-58.7-177.2000107.7G188 A192G188-I190 PolarHBondContact O-N 2.94Å; I190-A192 PolarHBondContact O-N 3.24Å; I190-A192 VanDerWaalsContact O-N 3.08Å
191V41.9Very low39.1Very low118 Ų118122.9 Ų122.972%0.71579%0.794SS**  trans-62.3107.7-170.9-177.90000111.9I193V191-I193 HydrophobicContact CG1-CG1 3.94Å; V191-I193 PolarHBondContact O-N 3.25Å
192A40.3Very low38.7Very low101 Ų101121.6 Ų121.684%0.83579%0.789SS**  trans-79.9101.5166.200000109.6I190I190-A192 PolarHBondContact O-N 3.24Å; I190-A192 VanDerWaalsContact O-N 3.08Å
193I39Very low38.9Very low152 Ų152125.2 Ų125.278%0.77980%0.798SS**  trans-75.5131.8-174.3-54.5173.3000111.3V191V191-I193 HydrophobicContact CG1-CG1 3.94Å; V191-I193 PolarHBondContact O-N 3.25Å
194S33.8Very low39.5Very low125 Ų125123 Ų12387%0.87479%0.792SS**  trans80.3113.6169-158.70000117.7
195G38Very low39.7Very low71 Ų71129.1 Ų129.173%0.73280%0.8SS**  trans157.678.7173.400000112.3P197G195-P197 WeakPolarHBondContact O-CD 3.32Å
196Q31.9Very low39.9Very low198 Ų198133.6 Ų133.693%0.92581%0.806SS**PPolyproline II helixtrans-66.8132.8-178.9-73.8-171.3-94.500113.1
197P35.4Very low40.4Very low119 Ų119131.1 Ų131.177%0.77380%0.797SS**PPolyproline II helixtrans-90.4151.3152.535.1-29.7000111.2G195G195-P197 WeakPolarHBondContact O-CD 3.32Å
198G39.6Very low40.9Very low80 Ų80133.8 Ų133.883%0.82580%0.795SS**PPolyproline II helixtrans-80.6158.2171.500000112.7
199S37.5Very low41.5Very low116 Ų116139.8 Ų139.881%0.81180%0.801SS**PPolyproline II helixtrans-90128.7-176.6-176.20000113.2
200S46Very low42Very low104 Ų104137.2 Ų137.273%0.72779%0.792SS**  trans-16695.7147.761.10000111.5
201D37.6Very low41.6Very low152 Ų152138.3 Ų138.381%0.81380%0.798SS**  trans44.6139141-47.4-35.3000122.6
202C33Very low41.4Very low119 Ų119138.4 Ų138.480%0.80480%0.804SS**  trans-103151.8-177.9-42.80000112.6
203V46.2Very low41.4Very low140 Ų140137.4 Ų137.485%0.84880%0.804SS**  trans-152.7120.6136.6-178.40000109.9
204P46.2Very low41.2Very low114 Ų114137.1 Ų137.174%0.7481%0.809SS**PPolyproline II helixtrans-86.6151.6157.734.9-31000111
205Y48.3Very low41.6Very low207 Ų207134.9 Ų134.981%0.81280%0.798SS**PPolyproline II helixtrans-91.7151.7-176.166-88.8000113.1
206E47.7Very low41.7Very low181 Ų181139.4 Ų139.485%0.84681%0.806SS**PPolyproline II helixtrans-98.8133.1174.6-75.8-70.6159.900110.9
207E47Very low42.1Very low156 Ų156133.2 Ų133.273%0.72980%0.795SS**PPolyproline II helixtrans-93.7123.2171.9-167.5-174142.500111.2
208K48Very low42.1Very low178 Ų178133.8 Ų133.877%0.77480%0.801SS**PPolyproline II helixtrans-94.8120.9-173.7178.2-176177.1-177.90112.3
209K54.4Low42.2Very low194 Ų194135 Ų13584%0.84380%0.797SS**  trans-132.8111.7165.9-133.1162.1-168156.90111.5
210T44.2Very low42.5Very low105 Ų105135.3 Ų135.364%0.64480%0.796SS**  trans-102.5139.5-173.7-550000110.9
211L37.6Very low41.9Very low174 Ų174135.8 Ų135.891%0.91180%0.799SS**  trans-126.9122.1171.6-78.3173000110.5
212S37.8Very low42.2Very low121 Ų121132.9 Ų132.985%0.84679%0.791SS**  trans-170.1136.9153.748.50000109.7
213G40Very low42.7Very low80 Ų80136.3 Ų136.383%0.82580%0.795SS**  trans178.292.9-175.300000111.6
214T34.8Very low42.4Very low146 Ų146133.8 Ų133.890%0.89679%0.788SS**  trans-84.5143.1-170.1-45.70000113
215A42.4Very low42Very low77 Ų77136.3 Ų136.364%0.63680%0.795SS**  trans170.8146.6131.100000113.7
216D41.1Very low41.7Very low166 Ų166131.6 Ų131.689%0.88879%0.789SS**  trans50.5138.5151-49.1-26.2000121.9
217G39.8Very low41.2Very low68 Ų68134.8 Ų134.870%0.70179%0.794SS**  cis166.9166.4-6.900000113.3
218C35.2Very low41.1Very low132 Ų132132.1 Ų132.189%0.89280%0.798SS**  trans69.4140.8169.5-153.40000116.8
219S41.6Very low40.8Very low106 Ų106129.7 Ų129.774%0.74180%0.801SS**  cis-160.5167.3-23.2-94.40000109.9
220P43.8Very low40.3Very low122 Ų122127 Ų12779%0.79280%0.801SS**  trans-110.9-170.5-163.742.6-36.5000116.7
221S33.1Very low40.6Very low113 Ų113127.9 Ų127.979%0.7981%0.808SS**  trans90140.4175.3-149.20000114.8
222S45.2Very low40.6Very low92 Ų92131.3 Ų131.364%0.64381%0.808SS**  cis-147164.324.7-59.90000114.2
223E43.1Very low40.5Very low191 Ų191130.1 Ų130.189%0.89381%0.806SS**  trans34.1150.5141.8-60.1-177.2129.100121.1
224A38.5Very low40.5Very low86 Ų86132.1 Ų132.171%0.71181%0.807SS**  cis-168.7178.310.300000107.4
225L39.3Very low40.7Very low168 Ų168130.9 Ų130.988%0.8881%0.805SS**  cis-158.4158.4-8.7-109.7166.4000107
226P41.6Very low40.7Very low107 Ų107138.9 Ų138.970%0.69582%0.818SS**  trans-114.5164.6-165.141.7-35.1000118.4
227R37.6Very low40.9Very low249 Ų249135 Ų13594%0.9481%0.809SS**  trans73.1127.4161.5-66.4-179.8174.9176.8-0.8121.1
228A43.5Very low41.3Very low100 Ų100138 Ų13883%0.82681%0.809SS**  trans-156.1156.5139.900000110.5
229P43.3Very low41.7Very low127 Ų127142 Ų14283%0.82581%0.806SS**  trans-111.3176.6-163.841.2-34.4000117.3
230V42.7Very low41.9Very low138 Ų138142.1 Ų142.184%0.83681%0.813SS**  trans-84.2141.7-172.4-151.80000113.9
231P49.9Very low42.1Very low122 Ų122143.9 Ų143.979%0.79282%0.816SS**  trans-88.7160.716335.2-33.4000112.9
232R37.8Very low42.7Very low246 Ų246144 Ų14493%0.92882%0.816SS**  trans-120.7163.1-172.7-136.2-179.8-173175.91.8111.8
233A36.5Very low43.1Very low97 Ų97142.9 Ų142.980%0.80282%0.819SS**  trans73.9123.1157.700000120.1
234S40.7Very low43.3Very low121 Ų121142.1 Ų142.185%0.84682%0.821SS**  trans-157.8101.9136.4-1750000108.6
235S37.7Very low43.9Very low120 Ų120144.3 Ų144.384%0.83982%0.817SS**  trans-90.2134.6173.846.80000109.8
236R43.8Very low44.9Very low246 Ų246139.8 Ų139.893%0.92880%0.804SS**  trans-141.3123.9169.4-140.8171.6-168.9168.83.8110.6
237A44.6Very low45.7Very low84 Ų84140.8 Ų140.869%0.69481%0.81SS**  trans-92.9148.4-171.900000112.7
238N47.8Very low46.5Very low130 Ų130138 Ų13870%0.69580%0.8SS**  trans-142.4111.3138.9-88.6-46.8000105.8
239R44.8Very low46.9Very low218 Ų218139.1 Ų139.182%0.82380%0.798SS**  70.5112.697.8-76.4-174.4174.184.40.9111.7
240A44Very low47.2Very low107 Ų107144.3 Ų144.388%0.88480%0.802SS**  trans-69.8146.3166.300000110
241D48.2Very low47.5Very low160 Ų160147.6 Ų147.686%0.85681%0.805SS**  trans-132140153.7-1698.8000106.9
242S46.7Very low47.3Very low115 Ų115152.1 Ų152.180%0.80481%0.806SS**  trans-122.488.5-168.457.40000110
243G53.5Low47.7Very low69 Ų69145.6 Ų145.671%0.71180%0.796SS**  trans-108.9132.9177.500000112.9E245G243-E245 PolarHBondContact O-N 3.2Å
244D47.2Very low48.1Very low175 Ų175146.7 Ų146.794%0.93680%0.795SS**  trans-69.985.9173.7-79.4-61.1000112.2A246D244-A246 PolarHBondContact O-N 3.37Å
245E51.6Low47.9Very low131 Ų131147.1 Ų147.161%0.61278%0.783SS**  trans-71.692.5166.4178.973-175.600109.3G243 R248G243-E245 PolarHBondContact O-N 3.2Å; E245-R248 IonicContact OE1-CZ 4Å; E245-R248 IonicContact OE1-NE 2.69Å; E245-R248 PolarHBondContact OE1-NE 3.34Å; E245-R248 IonicContact OE1-NH2 3.12Å; E245-R248 PolarHBondContact OE1-NH2 2.87Å; E245-R248 IonicContact OE2-NH2 3.24Å
246A59.7Low47.9Very low73 Ų73145.9 Ų145.960%0.60377%0.77SS**  trans-55.8146.1-177.900000112.7D244 R248D244-A246 PolarHBondContact O-N 3.37Å; A246-R248 PolarHBondContact O-N 3.22Å
247P57.9Low47.4Very low128 Ų128141.3 Ų141.383%0.83175%0.753SS**  trans-60.5103.6-172.7-24.834.6000113.1
248R55.1Low46.8Very low191 Ų191140.5 Ų140.572%0.72174%0.739SS**  trans-55.3133.3179.1-63.9-169.3-174.9-150.5-0.7110.3E245 A246 R250E245-R248 IonicContact OE1-CZ 4Å; E245-R248 IonicContact OE1-NE 2.69Å; E245-R248 PolarHBondContact OE1-NE 3.34Å; E245-R248 IonicContact OE1-NH2 3.12Å; E245-R248 PolarHBondContact OE1-NH2 2.87Å; E245-R248 IonicContact OE2-NH2 3.24Å; A246-R248 PolarHBondContact O-N 3.22Å; R248-R250 PolarHBondContact O-N 2.82Å
249P50.8Low46.2Very low123 Ų123140.1 Ų140.180%0.79973%0.729SS**  trans-62.3113.4-174.623.9-33.6000110.3K251P249-K251 PolarHBondContact O-N 3.19Å; P249-K251 VanDerWaalsContact O-N 3.07Å
250R49.6Very low45.8Very low237 Ų237134 Ų13489%0.89471%0.712SS**  trans-56.9115.9176.2-67.5-178.3178.8179.6-0.3108.5R248 R252R248-R250 PolarHBondContact O-N 2.82Å; R250-R252 PolarHBondContact O-N 3.07Å; R250-R252 VanDerWaalsContact O-N 3.12Å
251K49.1Very low45.4Very low206 Ų206135.3 Ų135.390%0.89670%0.698SS**PPolyproline II helixtrans-52.1121.3173.3-72.2-176.2176.8-179.40108.2P249P249-K251 PolarHBondContact O-N 3.19Å; P249-K251 VanDerWaalsContact O-N 3.07Å
252R45.6Very low44.9Very low217 Ų217132.2 Ų132.282%0.81969%0.685SS**PPolyproline II helixtrans-60.3139.5176.7-62.6-174.3-174-1743.3108.7R250R250-R252 PolarHBondContact O-N 3.07Å; R250-R252 VanDerWaalsContact O-N 3.12Å
253P45.8Very low44.3Very low110 Ų110129.9 Ų129.971%0.71467%0.668SS**PPolyproline II helixtrans-60.8152.2167.828.9-34.6000109.6E255P253-E255 PolarHBondContact O-N 3.08Å
254P45.8Very low43.4Very low120 Ų120137.2 Ų137.278%0.77967%0.674SS**PPolyproline II helixtrans-60.8136.2177.325.8-33.9000111.1T256P254-T256 PolarHBondContact O-N 3.33Å; P254-T256 VanDerWaalsContact O-N 3.11Å
255E37.6Very low42.9Very low130 Ų130135.1 Ų135.161%0.60766%0.657SS**  trans-74.694.8174.6-69.2-179.2176.600110.2P253 R257P253-E255 PolarHBondContact O-N 3.08Å; E255-R257 PolarHBondContact O-N 3.29Å; E255-R257 VanDerWaalsContact O-N 3.12Å; E255-R257 IonicContact OE2-CZ 2.81Å; E255-R257 IonicContact OE2-NE 2.7Å; E255-R257 PolarHBondContact OE2-NE 3.05Å; E255-R257 IonicContact OE2-NH2 2.71Å; E255-R257 PolarHBondContact OE2-NH2 3.2Å
256T37Very low42.2Very low93 Ų93140 Ų14057%0.57167%0.67SS**  trans-64.3111.2169.2-53.30000109.8P254 V258 I303P254-T256 PolarHBondContact O-N 3.33Å; P254-T256 VanDerWaalsContact O-N 3.11Å; T256-V258 HydrophobicContact CG2-CG2 4.5Å; T256-I303 HydrophobicContact CG2-CG2 4.31Å
257R32.7Very low41Very low151 Ų151142.7 Ų142.757%0.5767%0.674SS**  trans-97.5100.1-178.7-69.4179.7-178.9-171.7-1.2110.4E255 Y259E255-R257 PolarHBondContact O-N 3.29Å; E255-R257 VanDerWaalsContact O-N 3.12Å; E255-R257 IonicContact OE2-CZ 2.81Å; E255-R257 IonicContact OE2-NE 2.7Å; E255-R257 PolarHBondContact OE2-NE 3.05Å; E255-R257 IonicContact OE2-NH2 2.71Å; E255-R257 PolarHBondContact OE2-NH2 3.2Å; R257-Y259 HydrophobicContact CB-CE2 3.84Å; R257-Y259 WeakPolarHBondContact O-CD2 3.3Å; R257-Y259 PolarHBondContact O-N 3.43Å
258V32.7Very low39.9Very low66 Ų66146.4 Ų146.440%0.468%0.678SS.*  trans-80.7111176.1-1770000109.8T256 I260 L301T256-V258 HydrophobicContact CG2-CG2 4.5Å; V258-I260 HydrophobicContact CG1-CG1 4.23Å; V258-L301 HydrophobicContact CG1-CD2 3.94Å; V258-L301 HydrophobicContact CG1-CG 4.07Å
259Y35.3Very low38.9Very low123 Ų123142.2 Ų142.248%0.48267%0.67SS.*EExtended strand (participates in β ladder)trans-89.7123.2173.7-67.2-87.4000110.4R257R257-Y259 HydrophobicContact CB-CE2 3.84Å; R257-Y259 WeakPolarHBondContact O-CD2 3.3Å; R257-Y259 PolarHBondContact O-N 3.43Å
260I35.4Very low38Very low89 Ų89148.2 Ų148.246%0.45668%0.676SS.*EExtended strand (participates in β ladder)trans-108106.6-179.8-55.6-179.5000109.3V258 V262 L299V258-I260 HydrophobicContact CG1-CG1 4.23Å; I260-V262 HydrophobicContact CG2-CG2 4.2Å; I260-L299 HydrophobicContact CG2-CD1 3.54Å; I260-L299 HydrophobicContact CG2-CG 4.23Å
261F36.4Very low37.2Very low134 Ų134143.2 Ų143.259%0.58867%0.666SS**EExtended strand (participates in β ladder)trans-92.6123.9174-75.2-90.7000111
262V36.2Very low36.3Very low96 Ų96138.4 Ų138.458%0.58266%0.656SS**EExtended strand (participates in β ladder)trans-111.888.5178.9-175.20000110.1I260 F297 L299I260-V262 HydrophobicContact CG2-CG2 4.2Å; V262-F297 HydrophobicContact CG1-CD1 4.48Å; V262-L299 HydrophobicContact CG2-CD1 4.15Å
263S36Very low35.5Very low66 Ų66137.5 Ų137.546%0.46266%0.658SS.*EExtended strand (participates in β ladder)trans-86.1113.2179.1-65.10000111.9F265S263-F265 PolarHBondContact O-N 3.32Å
264R34.8Very low34.8Very low222 Ų222143.5 Ų143.584%0.83867%0.667SS**  trans-72.4106.8168.6-78.6-176.7174.9-179.1-1.3110.4F297R264-F297 HydrophobicContact CG-CE1 4.18Å
265F35.8Very low34.1Very low132 Ų132143.9 Ų143.958%0.57967%0.667SS**  trans-80.5122165.6-85-92.1000110.5S263S263-F265 PolarHBondContact O-N 3.32Å
266R36.6Very low33.9Very low232 Ų232144 Ų14488%0.87568%0.676SS**  trans-83.1141.1167.3-89.4-178.4163.9176.9-5.1110
267N34Very low33.6Very low130 Ų130151.4 Ų151.470%0.69569%0.693SS**  trans5795.4163.8-74.4-26.1000118.9
268F35.3Very low33.5Very low207 Ų207155.5 Ų155.591%0.90871%0.709SS**  trans-99.345.4141.1-91.5-81000111.6
269N33.5Very low33.3Very low103 Ų103156.2 Ų156.255%0.55172%0.722SS**  trans-102.469.5171.2-90.6-31.3000110.8
270R33.3Very low33.2Very low249 Ų249155.6 Ų155.694%0.9474%0.742SS**  trans-119.444.7165.1-90.4-166.9172.4-167.1-0.4111
271I31.5Very low33.1Very low132 Ų132156 Ų15668%0.67775%0.753SS**  trans-90.1122.5162.7-57178.7000106.9F273I271-F273 PolarHBondContact O-N 2.97Å
272P30.3Very low32.8Very low104 Ų104159.7 Ų159.768%0.67577%0.765SS**  trans-73.6112.3-17627.7-33.3000111.6R274P272-R274 VanDerWaalsContact C-N 3.27Å; P272-R274 PolarHBondContact O-N 2.91Å
273F29Very low32.5Very low198 Ų198159.4 Ų159.487%0.86878%0.78SS**  trans-67.677.2171.5-73.8-90.9000111.6I271I271-F273 PolarHBondContact O-N 2.97Å
274R31.2Very low32.2Very low237 Ų237164.9 Ų164.989%0.89480%0.799SS**  trans-130.4-9.4175.7-95.1-169.9172.1-166.7-2.6116.7P272P272-R274 VanDerWaalsContact C-N 3.27Å; P272-R274 PolarHBondContact O-N 2.91Å
275T31.9Very low31.9Very low127 Ų127162.9 Ų162.978%0.77980%0.799SS**SBendtrans-104.9-8.4-170.6-27.60000115R277T275-R277 PolarHBondContact O-N 3.44Å
276V32Very low31.7Very low133 Ų133162.6 Ų162.681%0.80681%0.808SS**THydrogen-bonded Turntrans-99.731.8-171.3-153.50000113.6
277R32.5Very low31.7Very low248 Ų248161.4 Ų161.494%0.93680%0.803SS**THydrogen-bonded Turntrans-120.18.7175.4-87.6-165.6178.1-168.30.6114.9T275T275-R277 PolarHBondContact O-N 3.44Å
278R28.8Very low31.7Very low237 Ų237162.1 Ų162.189%0.89481%0.807SS**SBendtrans-118.5-4.4-177.7-138.9178.9-167.5-177.53.3115.8
279A30.5Very low31.7Very low82 Ų82158.9 Ų158.968%0.67880%0.799SS**SBendtrans-90.4-13.1-177.500000114.5S281A279-S281 PolarHBondContact O-N 3.29Å
280A31.8Very low31.9Very low109 Ų109160.1 Ų160.190%0.90181%0.811SS**THydrogen-bonded Turntrans-79.131.7-171.800000114.7
281S34.7Very low32.3Very low98 Ų98154.2 Ų154.269%0.68580%0.802SS**THydrogen-bonded Turntrans-123.8-8.8-171.7-168.60000115A279A279-S281 PolarHBondContact O-N 3.29Å
282Y29.6Very low32.6Very low212 Ų212152.8 Ų152.883%0.83180%0.802SS**SBendtrans-131.7141173.3-89.1-96000109.3E284Y282-E284 PolarHBondContact O-N 3.12Å
283G28.4Very low32.9Very low89 Ų89155 Ų15592%0.91881%0.807SS**  trans-79.6100.9-172.900000112.3
284E30.6Very low33.3Very low182 Ų182156.5 Ų156.585%0.8581%0.807SS**  trans-125.2152.4170.1-118.9-174.3148.400111.2Y282 V286Y282-E284 PolarHBondContact O-N 3.12Å; E284-V286 PolarHBondContact O-N 3.22Å
285Q28.5Very low33.7Very low180 Ų180151.3 Ų151.384%0.84180%0.796SS**  trans-69.9117.9-173.5-66.9-177.24.300111.5R287Q285-R287 PolarHBondContact O-N 3.33Å
286V31.4Very low33.9Very low126 Ų126148 Ų14876%0.76479%0.787SS**  trans-7092173.2-177.30000109.8E284E284-V286 PolarHBondContact O-N 3.22Å
287R36.3Very low34.1Very low206 Ų206147.3 Ų147.378%0.77777%0.773SS**  trans-65.7134.1162.3-73.6-172.7173.6-166.1-0.8109Q285 D289Q285-R287 PolarHBondContact O-N 3.33Å; R287-D289 VanDerWaalsContact C-N 3.27Å; R287-D289 PolarHBondContact O-N 3.39Å
288N35Very low34.3Very low145 Ų145141.7 Ų141.778%0.77575%0.752SS**  trans-8269.1-177-70.6-73.2000111.3V290N288-V290 VanDerWaalsContact C-N 3.32Å; N288-V290 PolarHBondContact O-N 3.39Å
289D34.6Very low34.6Very low139 Ų139135.1 Ų135.174%0.74373%0.734SS**  trans-74.184.2176.3-74.2-19.3000111R287 T291R287-D289 VanDerWaalsContact C-N 3.27Å; R287-D289 PolarHBondContact O-N 3.39Å; D289-T291 VanDerWaalsContact C-N 3.31Å; D289-T291 PolarHBondContact O-N 3.44Å
290V38.8Very low35.1Very low130 Ų130134.4 Ų134.479%0.78872%0.721SS**  trans-70.984.8177.4-176.30000109.8N288 P292N288-V290 VanDerWaalsContact C-N 3.32Å; N288-V290 PolarHBondContact O-N 3.39Å; V290-P292 VanDerWaalsContact O-CD 3.3Å; V290-P292 WeakPolarHBondContact O-CD 3.45Å
291T40.2Very low35.2Very low124 Ų124133.8 Ų133.876%0.76170%0.702SS**  trans-58.8116.5176.4-54.70000110.7D289 L293D289-T291 VanDerWaalsContact C-N 3.31Å; D289-T291 PolarHBondContact O-N 3.44Å; T291-L293 PolarHBondContact O-N 3.14Å
292P38.5Very low35.4Very low103 Ų103136.4 Ų136.467%0.66970%0.697SS**  trans-75.5121.5-177.428.9-33.6000111.6V290 R294V290-P292 VanDerWaalsContact O-CD 3.3Å; V290-P292 WeakPolarHBondContact O-CD 3.45Å; P292-R294 PolarHBondContact O-N 3.43Å
293L37.3Very low35.9Very low149 Ų149132.1 Ų132.178%0.7869%0.688SS**  trans-63.1102.9171.8-79.3164.6000110.5T291 L295T291-L293 PolarHBondContact O-N 3.14Å; L293-L295 PolarHBondContact O-N 2.9Å
294R37.2Very low36.4Very low231 Ų231134.7 Ų134.787%0.87268%0.68SS**  trans-69.692177.2-71.7-172.1175.9-169-0.6111.5P292 G296P292-R294 PolarHBondContact O-N 3.43Å; R294-G296 PolarHBondContact O-N 2.93Å; R294-G296 VanDerWaalsContact O-N 3.16Å
295L38.1Very low36.6Very low127 Ų127132.4 Ų132.467%0.66567%0.672SS**  trans-80.588.7171.5-168.668.5000110.4L293 F297L293-L295 PolarHBondContact O-N 2.9Å; L295-F297 HydrophobicContact CD2-CE2 3.76Å; L295-F297 HydrophobicContact CD2-CZ 3.69Å; L295-F297 HydrophobicContact CG-CE2 3.89Å; L295-F297 HydrophobicContact CG-CZ 4.1Å
296G38Very low37.1Very low57 Ų57129.8 Ų129.859%0.58866%0.663SS**  trans-75.7127.1178.600000113.1R294R294-G296 PolarHBondContact O-N 2.93Å; R294-G296 VanDerWaalsContact O-N 3.16Å
297F36.1Very low37.4Very low119 Ų119130.1 Ų130.152%0.52266%0.657SS.*  trans-106141167.6-64.5-91.6000109.7V262 R264 L295V262-F297 HydrophobicContact CG1-CD1 4.48Å; R264-F297 HydrophobicContact CG-CE1 4.18Å; L295-F297 HydrophobicContact CD2-CE2 3.76Å; L295-F297 HydrophobicContact CD2-CZ 3.69Å; L295-F297 HydrophobicContact CG-CE2 3.89Å; L295-F297 HydrophobicContact CG-CZ 4.1Å
298R35.5Very low37.5Very low131 Ų131125.6 Ų125.649%0.49465%0.65SS.*EExtended strand (participates in β ladder)trans-108.6106.6171.9-174.1177.6-179.7-171.8-1.2108.8M11 V300M11-R298 PolarHBondContact SD-NH2 3.08Å; R298-V300 HydrophobicContact CG-CG2 4.33Å
299L34.9Very low37.6Very low98 Ų98124.4 Ų124.451%0.51364%0.642SS.*EExtended strand (participates in β ladder)trans-76.7135169.1-154.470.2000108.6I260 V262 L301I260-L299 HydrophobicContact CG2-CD1 3.54Å; I260-L299 HydrophobicContact CG2-CG 4.23Å; V262-L299 HydrophobicContact CG2-CD1 4.15Å; L299-L301 HydrophobicContact CD2-CD1 3.58Å; L299-L301 HydrophobicContact CG-CD1 3.95Å
300V41.9Very low37.8Very low68 Ų68123.4 Ų123.441%0.41264%0.636SS.*EExtended strand (participates in β ladder)trans-124.2108.8169.1-178.30000107.2R298R298-V300 HydrophobicContact CG-CG2 4.33Å
301L32.6Very low37.7Very low96 Ų96122.9 Ų122.950%0.50363%0.625SS.*EExtended strand (participates in β ladder)trans-83133.1163.9-89.973.4000108.3V258 L299V258-L301 HydrophobicContact CG1-CD2 3.94Å; V258-L301 HydrophobicContact CG1-CG 4.07Å; L299-L301 HydrophobicContact CD2-CD1 3.58Å; L299-L301 HydrophobicContact CG-CD1 3.95Å
302R40.5Very low37.5Very low153 Ų153122.8 Ų122.858%0.57761%0.614SS**EExtended strand (participates in β ladder)trans-108.7135158.3-178.6174.7172.31375.4107.7D304R302-D304 WeakPolarHBondContact CD-OD2 3.34Å; R302-D304 IonicContact CZ-OD1 3.59Å; R302-D304 VanDerWaalsContact CZ-OD1 3.24Å; R302-D304 IonicContact CZ-OD2 3.7Å; R302-D304 VanDerWaalsContact NE-CG 3.27Å; R302-D304 IonicContact NE-OD1 3.48Å; R302-D304 PolarHBondContact NE-OD1 3.38Å; R302-D304 IonicContact NE-OD2 2.79Å; R302-D304 PolarHBondContact NE-OD2 3.23Å; R302-D304 IonicContact NH2-OD1 2.93Å; R302-D304 PolarHBondContact NH2-OD1 3.25Å; R302-D304 IonicContact NH2-OD2 3.79Å
303I39.8Very low37.5Very low122 Ų122124.5 Ų124.563%0.62661%0.61SS**  trans-119.1125.7170.8-53.1176.5000105.2T256T256-I303 HydrophobicContact CG2-CG2 4.31Å
304D37.6Very low37.5Very low143 Ų143122.3 Ų122.377%0.76559%0.594SS**  trans-117.60172.2-65.1-72.5000108.5R302R302-D304 WeakPolarHBondContact CD-OD2 3.34Å; R302-D304 IonicContact CZ-OD1 3.59Å; R302-D304 VanDerWaalsContact CZ-OD1 3.24Å; R302-D304 IonicContact CZ-OD2 3.7Å; R302-D304 VanDerWaalsContact NE-CG 3.27Å; R302-D304 IonicContact NE-OD1 3.48Å; R302-D304 PolarHBondContact NE-OD1 3.38Å; R302-D304 IonicContact NE-OD2 2.79Å; R302-D304 PolarHBondContact NE-OD2 3.23Å; R302-D304 IonicContact NH2-OD1 2.93Å; R302-D304 PolarHBondContact NH2-OD1 3.25Å; R302-D304 IonicContact NH2-OD2 3.79Å

Retrieved 304 of 304 residues in 48.9 ms (Link to these results)