A0A3Q0KQ43_SCHMA Loading...

Tantalus domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KQ43, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 259 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
1M39.9Very low45.3Very low239 Ų239173.8 Ų173.8100%1.17786%0.855SS**  0109.10-57.2-161.193.800108.3N3M1-N3 PolarHBondContact O-N 3.48Å
2S40.4Very low46Very low120 Ų120174 Ų17484%0.83985%0.852SS**  trans-86.4107.3-171.357.50000111.5S4S2-S4 PolarHBondContact O-N 3.13Å; S2-S4 VanDerWaalsContact O-N 3.13Å
3N45.3Very low46.3Very low158 Ų158169.5 Ų169.585%0.84583%0.826SS**  trans-74.898.5169.1-77.5-30.9000109.6M1 K5M1-N3 PolarHBondContact O-N 3.48Å; N3-K5 PolarHBondContact O-N 3.03Å; N3-K5 VanDerWaalsContact O-N 3.15Å
4S45Very low46.8Very low118 Ų118164.2 Ų164.283%0.82580%0.802SS**  trans-63.3109.2171.1-174.80000109.8S2 R6S2-S4 PolarHBondContact O-N 3.13Å; S2-S4 VanDerWaalsContact O-N 3.13Å; S4-R6 PolarHBondContact O-N 3.15Å
5K50.8Low47Very low197 Ų197163.7 Ų163.786%0.85780%0.797SS**  trans-67.699.1173.1-77.2177.2178.5173.90108.7N3 R7N3-K5 PolarHBondContact O-N 3.03Å; N3-K5 VanDerWaalsContact O-N 3.15Å; K5-R7 PolarHBondContact O-N 3.3Å
6R47.2Very low47.3Very low243 Ų243158.1 Ų158.192%0.91777%0.772SS**  trans-48.8107.2166.3-119.2177.7177.6-176.2-0.8109S4 R8S4-R6 PolarHBondContact O-N 3.15Å; R6-R8 PolarHBondContact O-N 2.99Å
7R43.9Very low47.6Very low244 Ų244162.1 Ų162.192%0.92178%0.776SS**PPolyproline II helixtrans-61.6123.3169.9-70.4178.285.3-1724.2107.1K5 S9K5-R7 PolarHBondContact O-N 3.3Å; R7-S9 PolarHBondContact O-N 3.41Å
8R43.2Very low47.6Very low243 Ų243161.1 Ų161.192%0.91778%0.776SS**PPolyproline II helixtrans-63.8119.4170.3-75.1177.4173.1149.9-2.4106.9R6R6-R8 PolarHBondContact O-N 2.99Å
9S47.5Very low47.8Very low103 Ų103157.4 Ų157.472%0.7276%0.76SS**PPolyproline II helixtrans-53.1147.8175.349.10000111.4R7 V11R7-S9 PolarHBondContact O-N 3.41Å; S9-V11 PolarHBondContact O-N 3.25Å
10D45.5Very low47.8Very low160 Ų160153.5 Ų153.586%0.85674%0.742SS**PPolyproline II helixtrans-49.6116.7-178.1-59.3-51.9000111.2E12D10-E12 PolarHBondContact O-N 3.41Å
11V49.9Very low47.8Very low87 Ų87155.3 Ų155.353%0.52775%0.75SS.*  trans-80.5102.5172.4176.10000106.2S9 F13S9-V11 PolarHBondContact O-N 3.25Å; V11-F13 WeakPolarHBondContact O-CD2 3.37Å; V11-F13 PolarHBondContact O-N 3.24Å; V11-F13 VanDerWaalsContact O-N 3.15Å
12E53.4Low48.4Very low176 Ų176147.8 Ų147.882%0.82272%0.721SS**  trans-61.3115.2168.1-73.1-173.5169.700108.8D10 L14D10-E12 PolarHBondContact O-N 3.41Å; E12-L14 PolarHBondContact O-N 3.4Å
13F49.3Very low48.9Very low116 Ų116146.6 Ų146.651%0.50971%0.71SS.*  trans-81.3116.4171.9-71.4-86.3000108V11 E15V11-F13 WeakPolarHBondContact O-CD2 3.37Å; V11-F13 PolarHBondContact O-N 3.24Å; V11-F13 VanDerWaalsContact O-N 3.15Å; F13-E15 PolarHBondContact O-N 3.36Å
14L53.5Low49Very low95 Ų95145.3 Ų145.350%0.49771%0.71SS.*  trans-57.1113.6167.8-106.469.2000109.7E12 L16 I19E12-L14 PolarHBondContact O-N 3.4Å; L14-L16 PolarHBondContact O-N 3.2Å; L14-I19 HydrophobicContact CB-CD1 4.27Å; L14-I19 HydrophobicContact CD2-CD1 3.25Å; L14-I19 HydrophobicContact CG-CD1 3.67Å
15E50Low49.2Very low156 Ų156145.2 Ų145.273%0.72971%0.705SS**  trans-68.7117.7171.7-99-171.9166.500110.3F13 R17F13-E15 PolarHBondContact O-N 3.36Å; E15-R17 PolarHBondContact O-N 3.28Å
16L52Low48.9Very low75 Ų75142.5 Ų142.539%0.39370%0.699SS.*THydrogen-bonded Turntrans-73.618-169-66.8166.6000114.8L14L14-L16 PolarHBondContact O-N 3.2Å
17R52.8Low49Very low225 Ų225137.5 Ų137.585%0.84969%0.69SS**THydrogen-bonded Turntrans-89.9-24.2180-67.9-169.8-180-172.62.7113.1E15E15-R17 PolarHBondContact O-N 3.28Å
18N47.7Very low49.1Very low144 Ų144131.6 Ų131.677%0.7768%0.677SS**SBendtrans-113.36.9-167.2-63.3-11.1000114.5
19I51.1Low49.4Very low91 Ų91123.7 Ų123.747%0.46766%0.664SS.*SBendtrans-126.6104.4-167.9-52174.5000108.3L14L14-I19 HydrophobicContact CB-CD1 4.27Å; L14-I19 HydrophobicContact CD2-CD1 3.25Å; L14-I19 HydrophobicContact CG-CD1 3.67Å
20I48.5Very low49.3Very low79 Ų79125.6 Ų125.641%0.40567%0.666SS.*  trans9676176.2-50150.8000113.5S22I20-S22 PolarHBondContact O-N 3.15Å; I20-S22 VanDerWaalsContact O-N 3.17Å
21E46.8Very low49.2Very low193 Ų193124.6 Ų124.690%0.90266%0.656SS**  trans-63.4105.7143.4-154.7168.3-154.200106.5
22S52.7Low48.7Very low81 Ų81127.3 Ų127.357%0.56667%0.668SS**  trans-67.1138.5169.339.70000108.5I20I20-S22 PolarHBondContact O-N 3.15Å; I20-S22 VanDerWaalsContact O-N 3.17Å
23P51Low48.3Very low94 Ų94125.5 Ų125.561%0.6166%0.662SS**  trans-56.1148.6169.625.7-32.1000108.8T25P23-T25 PolarHBondContact O-N 2.99Å
24P48.3Very low48Very low131 Ų131130.6 Ų130.685%0.85168%0.678SS**  trans-59.2106.5-179.824.5-31.6000108.3D26P24-D26 PolarHBondContact O-N 3.5Å
25T49.1Very low47.4Very low117 Ų117136.1 Ų136.172%0.71870%0.698SS**  trans-63.5118.6166.19.60000106.8P23 L27P23-T25 PolarHBondContact O-N 2.99Å; T25-L27 PolarHBondContact O-N 3.13Å
26D43.7Very low47Very low139 Ų139132.8 Ų132.874%0.74369%0.692SS**  trans-42.2104.9170.2-128-12.7000109.5P24 D28P24-D26 PolarHBondContact O-N 3.5Å; D26-D28 PolarHBondContact O-N 3.15Å; D26-D28 VanDerWaalsContact O-N 3.11Å
27L48.8Very low46.7Very low139 Ų139138.5 Ų138.573%0.72871%0.714SS**THydrogen-bonded Turntrans-72.61-173.3-83.2165000112.5T25 Q31T25-L27 PolarHBondContact O-N 3.13Å; L27-Q31 WeakPolarHBondContact O-CG 3.49Å; L27-Q31 PolarHBondContact O-NE2 3.49Å; L27-Q31 VanDerWaalsContact O-NE2 3.17Å
28D46.6Very low46.4Very low119 Ų119139 Ų13964%0.63672%0.716SS**THydrogen-bonded Turntrans-95.2-18-176.7-85.6-19000114.7D26D26-D28 PolarHBondContact O-N 3.15Å; D26-D28 VanDerWaalsContact O-N 3.11Å
29A48.6Very low46.3Very low78 Ų78139.7 Ų139.765%0.64572%0.718SS**SBendtrans-81.6-24.6-176.900000114.1
30D46.2Very low46Very low143 Ų143146.1 Ų146.177%0.76574%0.737SS**SBendtrans-105.6-2.7-176.2-93.6-16.1000114.2N32D30-N32 VanDerWaalsContact C-N 3.26Å; D30-N32 PolarHBondContact O-N 3.29Å
31Q43.6Very low45.8Very low138 Ų138153.4 Ų153.465%0.64576%0.759SS**THydrogen-bonded Turntrans-76.6-7.8178-80.2-165.954.300114.7L27L27-Q31 WeakPolarHBondContact O-CG 3.49Å; L27-Q31 PolarHBondContact O-NE2 3.49Å; L27-Q31 VanDerWaalsContact O-NE2 3.17Å
32N39.9Very low45.4Very low144 Ų144151.7 Ų151.777%0.7776%0.756SS**THydrogen-bonded Turntrans-95.78.8-174.3-75.9-43.8000115.8D30D30-N32 VanDerWaalsContact C-N 3.26Å; D30-N32 PolarHBondContact O-N 3.29Å
33I44.2Very low44.7Very low139 Ų139152.9 Ų152.971%0.71377%0.765SS**SBendtrans-132.444-173-38.7177.5000112.9
34R42.2Very low44.2Very low223 Ų223155.4 Ų155.484%0.84277%0.771SS**  trans-161.247.2161.4-134.9173.3-169.6-171.23.2118S36R34-S36 PolarHBondContact O-N 3.06Å
35K41.5Very low43.6Very low210 Ų210155.5 Ų155.591%0.91377%0.774SS**  trans-86.957.8159.6-66.7-171.5-178.3177.40111K37K35-K37 PolarHBondContact O-N 3.29Å
36S41.7Very low43.2Very low86 Ų86156.9 Ų156.960%0.60178%0.776SS**  trans-74.995.8166.258.40000108R34 R38R34-S36 PolarHBondContact O-N 3.06Å; S36-R38 VanDerWaalsContact C-N 3.34Å; S36-R38 PolarHBondContact O-N 3.09Å
37K46.3Very low43.1Very low195 Ų195155.2 Ų155.285%0.84878%0.775SS**  trans-54.597.4167.6-72.5-176.7175.4-179.10108.4K35 L39K35-K37 PolarHBondContact O-N 3.29Å; K37-L39 PolarHBondContact O-N 3.39Å
38R45.1Very low42.4Very low236 Ų236156.1 Ų156.189%0.89178%0.781SS**  trans-70.488.9156.8-83.8-178.4165.3-177.3-4.9105.8S36 R40S36-R38 VanDerWaalsContact C-N 3.34Å; S36-R38 PolarHBondContact O-N 3.09Å; R38-R40 VanDerWaalsContact C-N 3.28Å; R38-R40 PolarHBondContact O-N 3.36Å
39L45.7Very low42.2Very low158 Ų158155.7 Ų155.783%0.82779%0.787SS**  trans-59.4101.3158.9-83.2159.8000105.9K37 R41K37-L39 PolarHBondContact O-N 3.39Å; L39-R41 PolarHBondContact O-N 2.77Å
40R45.6Very low41.8Very low227 Ų227160.1 Ų160.186%0.85780%0.795SS**  trans-58.4108.8160.9-76.5-179.3169.4143.8-4.4105.2R38 D42R38-R40 VanDerWaalsContact C-N 3.28Å; R38-R40 PolarHBondContact O-N 3.36Å; R40-D42 PolarHBondContact O-N 2.96Å; R40-D42 VanDerWaalsContact O-N 3.12Å
41R43.9Very low41.5Very low232 Ų232160 Ų16088%0.87579%0.794SS**SBendtrans-55.6110151.4-75.3178.1168.9120-2.7104.1L39L39-R41 PolarHBondContact O-N 2.77Å
42D39.2Very low41.6Very low156 Ų156163.1 Ų163.183%0.83481%0.805SS**  trans157.264.5162.2-73.4-16.8000108.2R40R40-D42 PolarHBondContact O-N 2.96Å; R40-D42 VanDerWaalsContact O-N 3.12Å
43S38.5Very low41.9Very low107 Ų107165.4 Ų165.475%0.74881%0.811SS**  trans165.477.115859.60000110.2
44I39.6Very low41.7Very low146 Ų146164.8 Ų164.875%0.74982%0.817SS**  trans-124.779.7156.5-60.1-179.4000105.1L46I44-L46 VanDerWaalsContact C-N 3.33Å; I44-L46 HydrophobicContact CG2-CB 4.19Å; I44-L46 HydrophobicContact CG2-CD1 3.47Å; I44-L46 VanDerWaalsContact CG2-CD1 3.47Å; I44-L46 HydrophobicContact CG2-CG 3.49Å; I44-L46 VanDerWaalsContact CG2-CG 3.49Å; I44-L46 PolarHBondContact O-N 3.13Å
45C35.4Very low41.9Very low133 Ų133159.9 Ų159.990%0.89982%0.816SS**  trans-75.894.7155.3-69.60000105.5
46L41.7Very low42.2Very low147 Ų147159.4 Ų159.477%0.7781%0.814SS**  trans-102.8122163-75.4170.7000107.6I44I44-L46 VanDerWaalsContact C-N 3.33Å; I44-L46 HydrophobicContact CG2-CB 4.19Å; I44-L46 HydrophobicContact CG2-CD1 3.47Å; I44-L46 VanDerWaalsContact CG2-CD1 3.47Å; I44-L46 HydrophobicContact CG2-CG 3.49Å; I44-L46 VanDerWaalsContact CG2-CG 3.49Å; I44-L46 PolarHBondContact O-N 3.13Å
47S40.7Very low42.4Very low104 Ų104161.4 Ų161.473%0.72783%0.825SS**  trans-59.7133.1-179.844.50000112.8
48N34.4Very low42.4Very low158 Ų158157.6 Ų157.685%0.84582%0.823SS**  trans27.2107143.7-57.4-10.1000118.3
49S43.1Very low42.2Very low110 Ų110158.1 Ų158.177%0.76983%0.825SS**  -164.3114.6124.8510000111
50E40Very low42.4Very low171 Ų171155.1 Ų155.180%0.79982%0.823SS**  trans49.7120.9137.7-70.4-175.2146.700121.9
51N40Very low42.5Very low141 Ų141150.3 Ų150.375%0.75482%0.821SS**  trans100.5116.6139.4-62.5-33.6000119.8
52K45.3Very low42.5Very low202 Ų202149.2 Ų149.288%0.87882%0.823SS**  trans90.998.2151.8-70.2-173.6172.6-1760119.9
53E45.8Very low42.8Very low192 Ų192153.6 Ų153.690%0.89783%0.828SS**  trans56.6120.3141.4-99-168.1152.600121.2
54P40.5Very low43.2Very low127 Ų127158.4 Ų158.483%0.82584%0.835SS**  trans-105116.9168.835.1-23000111.9
55S47Very low43.5Very low119 Ų119156.7 Ų156.783%0.83284%0.836SS**  trans-95.1125.7158.359.40000109.8
56K46.9Very low43.8Very low200 Ų200155.8 Ų155.887%0.8783%0.831SS**  trans-66156.9-173.2-65.4167.9179.7169.10111.9
57P46.9Very low44Very low128 Ų128159.9 Ų159.983%0.83184%0.836SS**  -132.2124124.431.4-18.2000114.5
58S45.2Very low44.3Very low115 Ų115160 Ų16080%0.80484%0.836SS**  trans18.3123141.9-160.50000120.8
59R41Very low44.8Very low248 Ų248158.4 Ų158.494%0.93683%0.834SS**  trans-56.1131.8162.5-89.9170.1163.5168.4-4.2112.1
60A49.5Very low44.9Very low94 Ų94161.3 Ų161.378%0.77784%0.84SS**  trans-123.2144.6153.500000110.2
61P47.3Very low45.1Very low127 Ų127162.8 Ų162.883%0.82584%0.844SS**  trans-92.2149.9-157.613.34.3000114.2R63P61-R63 PolarHBondContact O-N 3.48Å
62K44.4Very low45.1Very low208 Ų208164.6 Ų164.690%0.90485%0.848SS**  trans-53.6118.9175.7-67.6175.3174.1177.50112.1K64K62-K64 PolarHBondContact O-N 3.36Å
63R46.5Very low44.9Very low249 Ų249163.1 Ų163.194%0.9485%0.849SS**  trans-74.3115.7164.6-69178.882.2165.64109.4P61P61-R63 PolarHBondContact O-N 3.48Å
64K45.4Very low44.4Very low208 Ų208159.8 Ų159.890%0.90484%0.837SS**  trans-73.5121.5168.4-65.4177.3177.8179.60108.4K62K62-K64 PolarHBondContact O-N 3.36Å
65S46.1Very low44.4Very low110 Ų110159.2 Ų159.277%0.76984%0.836SS**  trans-101103167.71610000108.1R67S65-R67 PolarHBondContact O-N 2.94Å
66S43.1Very low44.1Very low114 Ų114160.9 Ų160.980%0.79783%0.83SS**  trans-70.9103.4167.141.90000109.3
67R44.8Very low43.6Very low233 Ų233159.3 Ų159.388%0.87983%0.832SS**  trans-104.1104.8164.4-148.4177.1-1581806.1107.3S65S65-R67 PolarHBondContact O-N 2.94Å
68C47.1Very low43Very low107 Ų107157.9 Ų157.972%0.72383%0.825SS**PPolyproline II helixtrans-58.7140177-59.80000110.7
69P44.3Very low42.5Very low124 Ų124159.3 Ų159.381%0.80583%0.828SS**PPolyproline II helixtrans-75.1134.2170.72.213.5000110K71P69-K71 PolarHBondContact O-N 3.4Å
70L45.6Very low42Very low170 Ų170152.3 Ų152.389%0.8982%0.818SS**PPolyproline II helixtrans-61.4128.4167-99.394.1000109.3Q72L70-Q72 PolarHBondContact O-N 3.24Å
71K44.4Very low41.4Very low203 Ų203153.7 Ų153.788%0.88382%0.816SS**PPolyproline II helixtrans-60.9124.9171.7-69.1-178.8173.6-175.70110P69P69-K71 PolarHBondContact O-N 3.4Å
72Q39.8Very low40.8Very low178 Ų178154.5 Ų154.583%0.83281%0.814SS**PPolyproline II helixtrans-75.3120.8166.1-69.2178.1-74.100108.6L70L70-Q72 PolarHBondContact O-N 3.24Å
73L41.1Very low40.1Very low172 Ų172153.6 Ų153.690%0.90181%0.812SS**  trans-90100.6163.1-82.5164.1000107.3
74N35.9Very low39.6Very low121 Ų121147.9 Ų147.965%0.64781%0.805SS**  trans-86.7120160.1-75.21000107.3
75S39.9Very low38.9Very low115 Ų115146 Ų14680%0.80480%0.8SS**  trans-123.3104.6154.256.40000106.7
76H40.3Very low38.4Very low154 Ų154148.4 Ų148.471%0.71380%0.803SS**  trans-62.3136.6162.6-68.9-94.6000108.3
77D36.3Very low37.8Very low168 Ų168148.8 Ų148.890%0.89880%0.801SS**  trans-146.9132.7140.5-120.6-21.3000110.1
78S34Very low37.5Very low98 Ų98143.6 Ų143.669%0.68580%0.795SS**  trans-101.3124.2-167.2-53.70000108.4
79T36.6Very low37Very low144 Ų144143.9 Ų143.988%0.88380%0.796SS**  trans-152.1107.9154.934.70000110.7
80S30Very low36.5Very low102 Ų102146.3 Ų146.371%0.71380%0.798SS**  trans-62.4141.1155.9164.70000110.2
81T37.3Very low36.2Very low122 Ų122147.9 Ų147.975%0.74880%0.798SS**  trans-178.5114.7133.234.30000112
82N33Very low36Very low144 Ų144144.8 Ų144.877%0.7779%0.791SS**  trans55.9115.5135-56.7-28.1000122.1
83H30.7Very low35.9Very low189 Ų189144.3 Ų144.388%0.87579%0.794SS**  trans-54.7136.5160.1-107.9-84.6000112.5
84T36.6Very low35.6Very low129 Ų129144 Ų14479%0.79179%0.793SS**  trans-138123.6154.4-46.10000108.8
85Q30.7Very low36Very low170 Ų170146.3 Ų146.379%0.79480%0.804SS**  trans-84121.4-177.1-175.2177.511.800108.5
86L35.7Very low35.9Very low160 Ų160146.4 Ų146.484%0.83880%0.802SS**  trans-123.3107.3168.4-75.8175000109.9
87T29.4Very low35.8Very low121 Ų121146.6 Ų146.674%0.74281%0.805SS**  trans-78.6125.7167.1-53.70000108.2
88V39.6Very low35.6Very low124 Ų124146 Ų14675%0.75280%0.801SS**  trans-127.8128.7166.7-176.50000108.8
89P35.6Very low35.8Very low114 Ų114148.4 Ų148.474%0.7481%0.805SS**  trans-79.3144-175.331.5-33000112.2
90M33.4Very low35.8Very low175 Ų175146.1 Ų146.186%0.86280%0.795SS**  trans-63.2131.2170.5-68.9-79.2147.800110.8
91K40.3Very low36.1Very low203 Ų203146 Ų14688%0.88379%0.794SS**  trans-130.6113.7158.2-112.3176.3177.6179.30108.2
92N38.8Very low36Very low138 Ų138148.7 Ų148.774%0.73880%0.802SS**  trans-69.7134.2170.2-65.6-25.6000108.7
93D37.7Very low36.1Very low167 Ų167148.6 Ų148.689%0.89380%0.802SS**  trans-142.5110.5150.4-86-37.5000107.7
94L36.5Very low36.2Very low167 Ų167146 Ų14687%0.87480%0.799SS**  trans-82.4139173.5-73.8160.8000108.9
95L42.9Very low36.1Very low168 Ų168145.4 Ų145.488%0.8880%0.795SS**  trans-116132159.3-70.9175.9000108.9
96P38.1Very low36.2Very low117 Ų117142.6 Ų142.676%0.7680%0.795SS**  trans-88.3140.8175.834.7-29.3000110.3
97M37.6Very low36.3Very low158 Ų158144.1 Ų144.178%0.77880%0.795SS**  trans-135.5108.7167.7-98.8-68.8-64.400109.4I99M97-I99 HydrophobicContact CE-CD1 3.86Å; M97-I99 HydrophobicContact CE-CG1 3.84Å
98D32.9Very low36.7Very low155 Ų155141.1 Ų141.183%0.82979%0.788SS**  trans-73128165.6-74.7-40.2000109.8
99I38.3Very low36.6Very low150 Ų150142.9 Ų142.977%0.76979%0.793SS**  trans-140.7107.8156.1-52.1178000108M97M97-I99 HydrophobicContact CE-CD1 3.86Å; M97-I99 HydrophobicContact CE-CG1 3.84Å
100S36.9Very low36.8Very low95 Ų95145.3 Ų145.366%0.66480%0.799SS**  trans-69.1152.9168.844.90000111.9
101S35.5Very low36.9Very low100 Ų100142.9 Ų142.970%0.69980%0.799SS**  trans62.2113.8150.546.70000118.9
102I35.5Very low36.9Very low178 Ų178140.9 Ų140.991%0.91380%0.797SS**  -153.9136.4125.1-89136.1000109.4
103N35.5Very low36.8Very low143 Ų143139.6 Ų139.677%0.76580%0.798SS**  trans-81.7152.5-168.2-81.6-26.5000114.3
104T32Very low36.7Very low133 Ų133137 Ų13782%0.81679%0.794SS**  trans29.7128.2145.941.80000121.5
105V34.2Very low37.2Very low118 Ų118134.8 Ų134.872%0.71579%0.789SS**  trans-130.5122.1148.4-168.20000109.1F107V105-F107 HydrophobicContact CB-CE2 4.39Å; V105-F107 HydrophobicContact CG1-CD2 3.99Å; V105-F107 HydrophobicContact CG1-CE1 4.39Å; V105-F107 HydrophobicContact CG1-CE2 3.37Å; V105-F107 HydrophobicContact CG1-CZ 3.61Å
106S33.4Very low36.9Very low111 Ų111134.4 Ų134.478%0.77679%0.788SS**  trans-105.2135171.8175.50000108.3
107F38.2Very low37.2Very low191 Ų191138.1 Ų138.184%0.83879%0.792SS**  trans-117.4116.1170.7-73.6-74.3000110.2V105V105-F107 HydrophobicContact CB-CE2 4.39Å; V105-F107 HydrophobicContact CG1-CD2 3.99Å; V105-F107 HydrophobicContact CG1-CE1 4.39Å; V105-F107 HydrophobicContact CG1-CE2 3.37Å; V105-F107 HydrophobicContact CG1-CZ 3.61Å
108G39Very low37.4Very low59 Ų59135.7 Ų135.761%0.60879%0.79SS**  trans-79.1143.2174.800000113.3
109N37.5Very low37.9Very low161 Ų161137.3 Ų137.386%0.86179%0.793SS**  trans17.4107.8148.4-51.8-6.9000117.6
110L38.2Very low38.1Very low164 Ų164137.6 Ų137.686%0.85980%0.796SS**  trans-115.7102.4160.5-70.4172.3000109.6
111S36.9Very low38.5Very low124 Ų124139.4 Ų139.487%0.86780%0.803SS**  trans-86.4125.1160.9-60.40000108.4
112I39Very low38.8Very low162 Ų162144.4 Ų144.483%0.83181%0.813SS**  trans-114.5112.6176.2-36.4176000107.9
113S37.8Very low39.3Very low110 Ų110143.2 Ų143.277%0.76981%0.807SS**PPolyproline II helixtrans-78.6139.3171.651.20000111.3
114S35.9Very low39.6Very low114 Ų114141.3 Ų141.380%0.79781%0.805SS**PPolyproline II helixtrans-75.8138175.7-169.50000112.1
115P46.9Very low39.8Very low119 Ų119146 Ų14677%0.77381%0.808SS**PPolyproline II helixtrans-96.5124.2173.934.1-26.2000111.7
116N36.1Very low40.3Very low160 Ų160146 Ų14686%0.85681%0.81SS**PPolyproline II helixtrans-88132.6154.4-83.5-27.5000108.5
117K43.2Very low40.7Very low196 Ų196145.8 Ų145.885%0.85281%0.809SS**  trans-173.5106.1153.3-101.8176.1-174.3-168.50106.9
118S43.3Very low40.8Very low106 Ų106142 Ų14274%0.74181%0.806SS**  56.7119.597.571.40000113.2
119E43.8Very low40.7Very low190 Ų190144.6 Ų144.689%0.88882%0.815SS**  -173.7145.1118.5-151.1157.1-167.700111.7
120N41.2Very low40.9Very low155 Ų155145.1 Ų145.183%0.82982%0.816SS**  trans-77141.1-177.7-67.3-59.2000112
121T45.8Very low41Very low133 Ų133144.6 Ų144.682%0.81681%0.813SS**  trans-147.3113.1154.7-5.70000110.1
122K41.2Very low41.3Very low206 Ų206143.7 Ų143.790%0.89680%0.804SS**  trans-69121.8173.5-71.6172.5176.6176.80109.2
123L45.5Very low41.6Very low153 Ų153139.7 Ų139.780%0.80180%0.795SS**  trans-144.4113.6165.3-97.8146.8000110.5
124S43.2Very low42.3Very low102 Ų102143.9 Ų143.971%0.71380%0.8SS**  trans42.3108.7150.458.70000120.2P126S124-P126 WeakPolarHBondContact O-CD 3.37Å
125R36.1Very low43Very low232 Ų232144 Ų14488%0.87580%0.796SS**  trans-44.9130.1158.2-177-177.1-169.7-173.53113.3
126P44.9Very low43.5Very low119 Ų119141.5 Ų141.577%0.77378%0.781SS**  trans-104.5130.5139.729.6-18.6000109S124 S128S124-P126 WeakPolarHBondContact O-CD 3.37Å; P126-S128 PolarHBondContact O-N 3.36Å
127S40.5Very low44.4Very low106 Ų106139.6 Ų139.674%0.74177%0.771SS**  trans-64.4109.6171.146.60000111.4
128S40.1Very low45.1Very low111 Ų111137.7 Ų137.778%0.77676%0.763SS**  trans-158.4121.7140.1690000109.6P126 L130P126-S128 PolarHBondContact O-N 3.36Å; S128-L130 PolarHBondContact O-N 2.92Å
129S37.7Very low45.7Very low114 Ų114141.4 Ų141.480%0.79776%0.762SS**  trans-81.9104.4-177.649.10000109.6
130L42.2Very low46.5Very low171 Ų171139 Ų13990%0.89575%0.754SS**  trans-164.950.6159-100.1153.1000108.6S128S128-L130 PolarHBondContact O-N 2.92Å
131I39.4Very low47.5Very low154 Ų154134.2 Ų134.279%0.7973%0.733SS**  trans-95.3120.8163.8-60.2175000105.9A133I131-A133 PolarHBondContact O-N 3.43Å
132P43.7Very low48.6Very low105 Ų105138.4 Ų138.468%0.68274%0.74SS**  trans-62.6108.9171.5-11.725.7000107.8F134P132-F134 PolarHBondContact O-N 3.08Å
133A46Very low49.8Very low78 Ų78139 Ų13965%0.64574%0.737SS**SBendtrans-59.3134.5161.400000107.1I131I131-A133 PolarHBondContact O-N 3.43Å
134F52.6Low50.9Low197 Ų197138 Ų13886%0.86472%0.723SS**  trans81.374.7-173.9-50.1-78.4000115.7P132 S136P132-F134 PolarHBondContact O-N 3.08Å; F134-S136 VanDerWaalsContact C-N 3.31Å; F134-S136 PolarHBondContact O-N 3.21Å; F134-S136 VanDerWaalsContact O-N 3.16Å
135V49.2Very low52.2Low117 Ų117138.5 Ų138.571%0.70972%0.722SS**  trans-75.794.1149.9-175.90000106.1
136S57.2Low53.8Low67 Ų67131.1 Ų131.147%0.46970%0.704SS.*  trans-66.9134.9172.256.80000109.5F134 F138F134-S136 VanDerWaalsContact C-N 3.31Å; F134-S136 PolarHBondContact O-N 3.21Å; F134-S136 VanDerWaalsContact O-N 3.16Å; S136-F138 PolarHBondContact O-N 2.73Å; S136-F138 WeakPolarHBondContact OG-CD2 3.49Å
137D55.9Low55Low119 Ų119130.6 Ų130.664%0.63670%0.701SS**  trans-68.836.1-179.5-70.2-33.3000113.6Y139 L140D137-Y139 PolarHBondContact O-N 3.19Å; D137-Y139 VanDerWaalsContact O-N 3.09Å; D137-L140 HydrophobicContact CB-CB 4.41Å; D137-L140 HydrophobicContact CB-CD1 4.18Å; D137-L140 PolarHBondContact O-N 3.17Å
138F58Low56.1Low157 Ų157134.3 Ų134.369%0.68970%0.704SS**G310 helixtrans-58.9-22.8176.2-99.9-91.5000112.6S136 L140 S141S136-F138 PolarHBondContact O-N 2.73Å; S136-F138 WeakPolarHBondContact OG-CD2 3.49Å; F138-L140 VanDerWaalsContact C-N 3.29Å; F138-L140 PolarHBondContact O-N 2.98Å; F138-S141 WeakPolarHBondContact O-CB 3.22Å; F138-S141 PolarHBondContact O-N 2.73Å
139Y56.3Low56.9Low184 Ų184138 Ų13872%0.72271%0.708SS**G310 helixtrans-74-16.7175.2-55.5-79.4000113.7D137D137-Y139 PolarHBondContact O-N 3.19Å; D137-Y139 VanDerWaalsContact O-N 3.09Å
140L59.9Low57.6Low138 Ų138143.9 Ų143.972%0.72371%0.713SS**G310 helixtrans-98.21.3175.9-66.7171.5000112.8D137 F138 K142D137-L140 HydrophobicContact CB-CB 4.41Å; D137-L140 HydrophobicContact CB-CD1 4.18Å; D137-L140 PolarHBondContact O-N 3.17Å; F138-L140 VanDerWaalsContact C-N 3.29Å; F138-L140 PolarHBondContact O-N 2.98Å; L140-K142 PolarHBondContact O-N 2.9Å
141S62.3Low57.9Low55 Ų55139 Ų13939%0.38570%0.704SS.*  trans-62128.6172.6171.10000110.6F138 R143 Y144F138-S141 WeakPolarHBondContact O-CB 3.22Å; F138-S141 PolarHBondContact O-N 2.73Å; S141-R143 PolarHBondContact O-N 2.82Å; S141-R143 PolarHBondContact OG-N 3.37Å; S141-Y144 PolarHBondContact O-N 3.37Å
142K68.6Low58.8Low221 Ų221139 Ų13996%0.96170%0.704SS**SBendtrans-59.3-5.5172.3-66-160.9179.5-172.10113.8L140L140-K142 PolarHBondContact O-N 2.9Å
143R66.6Low59.2Low218 Ų218138.6 Ų138.682%0.82371%0.71SS**SBendtrans-127.663.2177.3-62-175.7-178.2-174.31.1110S141 V145S141-R143 PolarHBondContact O-N 2.82Å; S141-R143 PolarHBondContact OG-N 3.37Å; R143-V145 PolarHBondContact O-N 3.16Å; R143-V145 VanDerWaalsContact O-N 3.11Å
144Y69.6Low59.7Low132 Ų132140.3 Ų140.352%0.51871%0.713SS.*  trans-61.7113.6171.4176-107.1000109.9S141 P146S141-Y144 PolarHBondContact O-N 3.37Å; Y144-P146 HydrophobicContact CD1-CB 4.5Å; Y144-P146 HydrophobicContact CE1-CB 3.65Å; Y144-P146 HydrophobicContact CE1-CG 4.15Å
145V69.8Low60.1Low114 Ų114137 Ų13769%0.69171%0.708SS**  trans-100.4107.8168.3-179.20000106.4R143R143-V145 PolarHBondContact O-N 3.16Å; R143-V145 VanDerWaalsContact O-N 3.11Å
146P69.8Low60.5Low77 Ų77139.4 Ų139.450%0.572%0.715SS.*  trans-56.9139.2178.616.7-26000110Y144 K148Y144-P146 HydrophobicContact CD1-CB 4.5Å; Y144-P146 HydrophobicContact CE1-CB 3.65Å; Y144-P146 HydrophobicContact CE1-CG 4.15Å; P146-K148 PolarHBondContact O-N 3.17Å
147P69.4Low60.8Low108 Ų108140 Ų14070%0.70171%0.711SS**  trans-52.4116173.9-24.833.1000109.3H149P147-H149 PolarHBondContact O-N 2.93Å; P147-H149 VanDerWaalsContact O-N 3.15Å
148K64.9Low61.4Low184 Ų184139 Ų13980%0.871%0.705SS**  trans-51.8125.9170.6-66.8-177.8180-179.50106.2P146 R150P146-K148 PolarHBondContact O-N 3.17Å; K148-R150 PolarHBondContact O-N 3.46Å
149H55.2Low61.8Low187 Ų187136 Ų13687%0.86670%0.704SS**  trans-48.881.7-177.4-66.5-81.1000112.1P147 G151P147-H149 PolarHBondContact O-N 2.93Å; P147-H149 VanDerWaalsContact O-N 3.15Å; H149-G151 PolarHBondContact O-N 3.43Å
150R52.7Low62.3Low239 Ų239131.3 Ų131.390%0.90269%0.694SS**  trans-74.4105.8160.8-73-165.4175.8-164.20.3103.3K148 L152K148-R150 PolarHBondContact O-N 3.46Å; R150-L152 PolarHBondContact O-N 3.12Å
151G49.6Very low62.6Low68 Ų68131 Ų13170%0.70169%0.687SS**  trans-33.3118.8-16200000112.8H149 A153H149-G151 PolarHBondContact O-N 3.43Å; G151-A153 PolarHBondContact O-N 2.92Å
152L58.2Low62.7Low153 Ų153136 Ų13680%0.80170%0.698SS**  trans-47120.6161.8-69.8171.1000105.8R150 T154R150-L152 PolarHBondContact O-N 3.12Å; L152-T154 VanDerWaalsContact C-N 3.31Å; L152-T154 PolarHBondContact O-N 3.33Å
153A51.8Low62.3Low97 Ų97129 Ų12980%0.80268%0.676SS**  trans-52.6103.2174.600000107G151 V155G151-A153 PolarHBondContact O-N 2.92Å; A153-V155 PolarHBondContact O-N 3.48Å
154T55.7Low62.1Low115 Ų115125.9 Ų125.971%0.70667%0.671SS**  trans-68.4103.3178.245.80000105.3L152 I156L152-T154 VanDerWaalsContact C-N 3.31Å; L152-T154 PolarHBondContact O-N 3.33Å; T154-I156 PolarHBondContact O-N 3.07Å; T154-I156 VanDerWaalsContact O-N 3.12Å
155V60.5Low61.6Low126 Ų126127.7 Ų127.776%0.76468%0.677SS**  trans-47.8123.5160.1178.40000105.6A153 E157A153-V155 PolarHBondContact O-N 3.48Å; V155-E157 PolarHBondContact O-N 2.98Å
156I59.5Low61.1Low169 Ų169132.3 Ų132.387%0.86768%0.682SS**  trans-62.692.6179.8-60.5171.3000106.6T154T154-I156 PolarHBondContact O-N 3.07Å; T154-I156 VanDerWaalsContact O-N 3.12Å
157E63.1Low60.5Low80 Ų80133.8 Ų133.837%0.37469%0.692SS.*  trans-75.9128.5173.9-72.6-164.8157.100108.7V155 S159 R165V155-E157 PolarHBondContact O-N 2.98Å; E157-S159 PolarHBondContact O-N 3.46Å; E157-R165 IonicContact OE1-CZ 3.8Å; E157-R165 IonicContact OE1-NH1 2.63Å; E157-R165 PolarHBondContact OE1-NH1 3.23Å; E157-R165 IonicContact OE2-NH1 3.42Å; E157-R165 PolarHBondContact OE2-NH1 2.89Å
158D67.5Low59.9Low96 Ų96139.3 Ų139.351%0.51370%0.698SS.*  trans-44.3124167.7-96.2-35.7000110.3V160 K161 R162D158-V160 PolarHBondContact O-N 3.37Å; D158-K161 HydrophobicContact CB-CB 4.09Å; D158-K161 HydrophobicContact CB-CD 4.13Å; D158-K161 HydrophobicContact CB-CG 3.92Å; D158-K161 PolarHBondContact O-N 3.17Å; D158-K161 IonicContact OD2-NZ 3.98Å; D158-R162 PolarHBondContact O-N 3.03Å
159S66.6Low59.4Low95 Ų95134.8 Ų134.866%0.66469%0.69SS**Hα-helixtrans-53-31.7176.462.20000112E157 S163E157-S159 PolarHBondContact O-N 3.46Å; S159-S163 WeakPolarHBondContact O-CB 3.33Å; S159-S163 PolarHBondContact O-N 3.4Å
160V66.1Low59Low86 Ų86136.6 Ų136.652%0.52169%0.69SS.*Hα-helixtrans-65.3-48.5174.9-1790000111.5D158 R162 S163 Q164D158-V160 PolarHBondContact O-N 3.37Å; V160-R162 VanDerWaalsContact C-N 3.34Å; V160-S163 PolarHBondContact O-N 3.04Å; V160-S163 PolarHBondContact O-OG 2.96Å; V160-Q164 WeakPolarHBondContact O-CG 3.42Å; V160-Q164 PolarHBondContact O-N 3.19Å
161K67.6Low58.8Low130 Ų130133.1 Ų133.157%0.56568%0.682SS**Hα-helixtrans-68.4-35.5178.6-66.2-177.8-175170.30111.5D158 Q164 R165D158-K161 HydrophobicContact CB-CB 4.09Å; D158-K161 HydrophobicContact CB-CD 4.13Å; D158-K161 HydrophobicContact CB-CG 3.92Å; D158-K161 PolarHBondContact O-N 3.17Å; D158-K161 IonicContact OD2-NZ 3.98Å; K161-Q164 PolarHBondContact O-N 3.42Å; K161-R165 PolarHBondContact O-N 2.85Å
162R63.9Low58.7Low162 Ų162138.8 Ų138.861%0.61169%0.687SS**Hα-helixtrans-65.4-38.9174.3-140.5176.1-170.4-178.51.3111.9D158 V160 Q164 R165D158-R162 PolarHBondContact O-N 3.03Å; V160-R162 VanDerWaalsContact C-N 3.34Å; R162-Q164 VanDerWaalsContact C-N 3.3Å; R162-Q164 PolarHBondContact O-N 3.5Å; R162-R165 PolarHBondContact O-N 3.23Å
163S60.2Low58.2Low72 Ų72138.9 Ų138.950%0.50370%0.695SS.*Hα-helixtrans-67.6-2917682.20000113.3S159 V160S159-S163 WeakPolarHBondContact O-CB 3.33Å; S159-S163 PolarHBondContact O-N 3.4Å; V160-S163 PolarHBondContact O-N 3.04Å; V160-S163 PolarHBondContact O-OG 2.96Å
164Q61.8Low58Low153 Ų153139.7 Ų139.772%0.71568%0.682SS**Hα-helixtrans-76.2-27.1175.3-70.6-178.29.500112.5V160 K161 R162 R166V160-Q164 WeakPolarHBondContact O-CG 3.42Å; V160-Q164 PolarHBondContact O-N 3.19Å; K161-Q164 PolarHBondContact O-N 3.42Å; R162-Q164 VanDerWaalsContact C-N 3.3Å; R162-Q164 PolarHBondContact O-N 3.5Å; Q164-R166 PolarHBondContact O-N 2.69Å; Q164-R166 VanDerWaalsContact O-N 3.16Å
165R60.5Low57.9Low171 Ų171137.3 Ų137.365%0.64566%0.664SS**THydrogen-bonded Turntrans-83.537.1173.6-70.4-178.6170168-2.5112.9E157 K161 R162 P167E157-R165 IonicContact OE1-CZ 3.8Å; E157-R165 IonicContact OE1-NH1 2.63Å; E157-R165 PolarHBondContact OE1-NH1 3.23Å; E157-R165 IonicContact OE2-NH1 3.42Å; E157-R165 PolarHBondContact OE2-NH1 2.89Å; K161-R165 PolarHBondContact O-N 2.85Å; R162-R165 PolarHBondContact O-N 3.23Å; R165-P167 WeakPolarHBondContact O-CD 3.35Å
166R59Low57.9Low210 Ų210133.4 Ų133.479%0.79264%0.643SS**  trans-61.6124.8167.2-86.7-175.3175.6174.70.3108Q164 R168Q164-R166 PolarHBondContact O-N 2.69Å; Q164-R166 VanDerWaalsContact O-N 3.16Å; R166-R168 PolarHBondContact O-N 3.01Å; R166-R168 VanDerWaalsContact O-N 3.17Å
167P57.5Low58Low109 Ų109129.1 Ų129.171%0.70863%0.626SS**  trans-51.3129165.3-18.229.2000106.3R165 S169R165-P167 WeakPolarHBondContact O-CD 3.35Å; P167-S169 VanDerWaalsContact C-N 3.27Å; P167-S169 PolarHBondContact O-N 3.3Å
168R55.8Low58.2Low224 Ų224126.5 Ų126.585%0.84561%0.614SS**  trans-55101.7171-86.9-178.2164.7177.3-3.9105.9R166 Y170R166-R168 PolarHBondContact O-N 3.01Å; R166-R168 VanDerWaalsContact O-N 3.17Å; R168-Y170 WeakPolarHBondContact O-CD1 3.39Å; R168-Y170 PolarHBondContact O-N 3.13Å
169S53.8Low57.9Low88 Ų88125.9 Ų125.962%0.61561%0.605SS**  trans-60.8113.8173.851.60000105.4P167 K171P167-S169 VanDerWaalsContact C-N 3.27Å; P167-S169 PolarHBondContact O-N 3.3Å; S169-K171 PolarHBondContact O-N 3.37Å
170Y48.2Very low57.9Low225 Ų225129.8 Ų129.888%0.88261%0.605SS**  trans-67.175.4169.219.8-92000106.2R168R168-Y170 WeakPolarHBondContact O-CD1 3.39Å; R168-Y170 PolarHBondContact O-N 3.13Å
171K47.4Very low58.3Low166 Ų166128.1 Ų128.172%0.72259%0.591SS**  trans-100.5122.6172.9-83.8-161.7174.8-169.80108.5S169S169-K171 PolarHBondContact O-N 3.37Å
172K49Very low58.5Low187 Ų187122 Ų12281%0.81356%0.564SS**SBendtrans79139.9170.6-59.3-173.7175.2-171.90114.9E174K172-E174 WeakPolarHBondContact O-CG 3.43Å; K172-E174 PolarHBondContact O-N 2.94Å
173T47.1Very low59Low156 Ų156120.4 Ų120.496%0.95756%0.563SS**  trans-54.772178.2-38.40000110.4
174E46.4Very low59.3Low114 Ų114120.3 Ų120.353%0.53356%0.559SS.*  trans-82.6141.3-174-70.9-100.9162.200108.6K172 S176 P177K172-E174 WeakPolarHBondContact O-CG 3.43Å; K172-E174 PolarHBondContact O-N 2.94Å; E174-S176 PolarHBondContact O-N 3.11Å; E174-P177 VanDerWaalsContact O-CD 3.25Å; E174-P177 WeakPolarHBondContact O-CD 3.48Å
175L55.1Low59.9Low64 Ų64116.9 Ų116.934%0.33557%0.565SS.*SBendtrans-53.119.2162.5-67.6157.1000114.1I178 R179 L206L175-I178 HydrophobicContact CD2-CD1 4.33Å; L175-R179 WeakPolarHBondContact O-CB 3.42Å; L175-R179 WeakPolarHBondContact O-CG 3.47Å; L175-R179 PolarHBondContact O-N 2.63Å; L175-R179 VanDerWaalsContact O-N 3.11Å; L175-L206 HydrophobicContact CD2-CD1 3.79Å
176S59.7Low60.7Low45 Ų45111.9 Ų111.932%0.31555%0.549SS..Hα-helixtrans-66.8-36.5-176.7-93.40000115.1E174 R179 R180E174-S176 PolarHBondContact O-N 3.11Å; S176-R179 PolarHBondContact O-N 3.48Å; S176-R180 WeakPolarHBondContact O-CG 3.46Å; S176-R180 PolarHBondContact O-N 2.93Å; S176-R180 VanDerWaalsContact O-N 3.14Å
177P62.6Low61.7Low79 Ų79104.9 Ų104.951%0.51353%0.53SS..Hα-helixtrans-64-50.8177.2-19.430.7000110.8E174 R179 R180 Q181E174-P177 VanDerWaalsContact O-CD 3.25Å; E174-P177 WeakPolarHBondContact O-CD 3.48Å; P177-R179 VanDerWaalsContact C-N 3.29Å; P177-R179 PolarHBondContact O-N 3.16Å; P177-R180 WeakPolarHBondContact O-CA 3.34Å; P177-R180 WeakPolarHBondContact O-CB 3.36Å; P177-R180 PolarHBondContact O-N 3.3Å; P177-Q181 WeakPolarHBondContact O-CG 3.33Å; P177-Q181 PolarHBondContact O-N 2.92Å
178I65.3Low62.7Low25 Ų25101.2 Ų101.213%0.12850%0.504CS..Hα-helixtrans-60.3-41179.1-63.9152.4000110.8L175 R180 Q181 I182 L202 L206 V210L175-I178 HydrophobicContact CD2-CD1 4.33Å; I178-R180 PolarHBondContact O-N 3.42Å; I178-Q181 PolarHBondContact O-N 3.19Å; I178-Q181 VanDerWaalsContact O-N 3.17Å; I178-I182 HydrophobicContact CG2-CD1 3.44Å; I178-I182 VanDerWaalsContact CG2-CD1 3.44Å; I178-I182 HydrophobicContact CG2-CG1 4.18Å; I178-I182 WeakPolarHBondContact O-CG1 3.49Å; I178-I182 PolarHBondContact O-N 3.44Å; I178-L202 HydrophobicContact CG1-CD1 4.47Å; I178-L202 HydrophobicContact CG1-CD2 3.93Å; I178-L202 HydrophobicContact CG2-CD1 4.26Å; I178-L206 HydrophobicContact CD1-CD2 3.32Å; I178-L206 HydrophobicContact CD1-CG 4.08Å; I178-L206 HydrophobicContact CG1-CD2 4.45Å; I178-V210 HydrophobicContact CG2-CG2 4.12Å
179R62.7Low63.8Low83 Ų8398.4 Ų98.431%0.31350%0.5SS..Hα-helixtrans-66.4-18.5175-77.7176.4-178.2-170.38.8114.1L175 S176 P177 V210 R214L175-R179 WeakPolarHBondContact O-CB 3.42Å; L175-R179 WeakPolarHBondContact O-CG 3.47Å; L175-R179 PolarHBondContact O-N 2.63Å; L175-R179 VanDerWaalsContact O-N 3.11Å; S176-R179 PolarHBondContact O-N 3.48Å; P177-R179 VanDerWaalsContact C-N 3.29Å; P177-R179 PolarHBondContact O-N 3.16Å; R179-V210 HydrophobicContact CG-CG1 3.98Å; R179-R214 PolarHBondContact O-NH2 3.14Å
180R67Low65.2Low177 Ų17799.2 Ų99.267%0.66849%0.494SS*.Hα-helixtrans-90.6-26173.1-70.8175.9-173.2-1684.8111.9S176 P177 I178 F183S176-R180 WeakPolarHBondContact O-CG 3.46Å; S176-R180 PolarHBondContact O-N 2.93Å; S176-R180 VanDerWaalsContact O-N 3.14Å; P177-R180 WeakPolarHBondContact O-CA 3.34Å; P177-R180 WeakPolarHBondContact O-CB 3.36Å; P177-R180 PolarHBondContact O-N 3.3Å; I178-R180 PolarHBondContact O-N 3.42Å; R180-F183 WeakPolarHBondContact O-CE2 3.38Å; R180-F183 WeakPolarHBondContact O-CZ 3.41Å
181Q73.8Confident66.9Low50 Ų5088.8 Ų88.823%0.23446%0.455CS..Hα-helixtrans-82.6-40.3-178.3-71.3169.3-33.400112.6P177 I178 F183 Q186 T195 L202P177-Q181 WeakPolarHBondContact O-CG 3.33Å; P177-Q181 PolarHBondContact O-N 2.92Å; I178-Q181 PolarHBondContact O-N 3.19Å; I178-Q181 VanDerWaalsContact O-N 3.17Å; Q181-F183 VanDerWaalsContact O-CD2 3.24Å; Q181-F183 WeakPolarHBondContact O-CD2 3.36Å; Q181-F183 WeakPolarHBondContact O-CE2 3.38Å; Q181-F183 PolarHBondContact O-N 3.31Å; Q181-Q186 PolarHBondContact O-OE1 3.12Å; Q181-T195 HydrophobicContact CG-CG2 4.22Å; Q181-T195 PolarHBondContact NE2-OG1 3.49Å; Q181-L202 HydrophobicContact CB-CD1 4.47Å
182I72.5Confident68.7Low1 Ų182 Ų821%0.00543%0.428CS..  trans-77.1128.8177.3-55.5165.8000107.6I178 A191 V207 V210 T211 R214I178-I182 HydrophobicContact CG2-CD1 3.44Å; I178-I182 VanDerWaalsContact CG2-CD1 3.44Å; I178-I182 HydrophobicContact CG2-CG1 4.18Å; I178-I182 WeakPolarHBondContact O-CG1 3.49Å; I178-I182 PolarHBondContact O-N 3.44Å; I182-A191 HydrophobicContact CG1-CB 4.33Å; I182-A191 HydrophobicContact CG2-CB 4.36Å; I182-V207 HydrophobicContact CD1-CB 4.08Å; I182-V207 HydrophobicContact CD1-CG1 3.89Å; I182-V207 HydrophobicContact CD1-CG2 3.93Å; I182-V207 HydrophobicContact CG1-CG1 4.34Å; I182-V207 HydrophobicContact CG1-CG2 4.44Å; I182-V210 HydrophobicContact CD1-CB 3.9Å; I182-V210 HydrophobicContact CD1-CG1 3.88Å; I182-V210 HydrophobicContact CD1-CG2 4.46Å; I182-T211 HydrophobicContact CG2-CG2 3.86Å; I182-R214 VanDerWaalsContact C-NH1 3.29Å; I182-R214 PolarHBondContact O-NH1 2.9Å; I182-R214 PolarHBondContact O-NH2 2.74Å
183F74Confident70.2Confident130 Ų13075.3 Ų75.357%0.5741%0.408SS*.  trans-114167.6169.1-60.8-81.3000110.2R180 Q181 Q186R180-F183 WeakPolarHBondContact O-CE2 3.38Å; R180-F183 WeakPolarHBondContact O-CZ 3.41Å; Q181-F183 VanDerWaalsContact O-CD2 3.24Å; Q181-F183 WeakPolarHBondContact O-CD2 3.36Å; Q181-F183 WeakPolarHBondContact O-CE2 3.38Å; Q181-F183 PolarHBondContact O-N 3.31Å; F183-Q186 HydrophobicContact CB-CG 4.35Å
184T66.6Low71.8Confident69 Ų6971.6 Ų71.642%0.42339%0.386SS..THydrogen-bonded Turntrans-90.6122.6-177.959.10000109.4R218T184-R218 VanDerWaalsContact CB-CZ 3.41Å; T184-R218 VanDerWaalsContact CB-NH1 3.27Å; T184-R218 PolarHBondContact OG1-NH2 3.03Å
185G72.8Confident73.4Confident82 Ų8270.5 Ų70.585%0.84539%0.387SS*.THydrogen-bonded Turntrans111.1-14.6-171.400000113
186Q78.7Confident74.3Confident65 Ų6569.9 Ų69.930%0.30439%0.392SS..  trans-66.4143.1170.4-76.2178.9-27.100111.2Q181 F183 E190Q181-Q186 PolarHBondContact O-OE1 3.12Å; F183-Q186 HydrophobicContact CB-CG 4.35Å; Q186-E190 WeakPolarHBondContact CA-OE2 3.37Å; Q186-E190 HydrophobicContact CB-CB 4.28Å; Q186-E190 HydrophobicContact CG-CB 4.47Å
187T78.9Confident75.3Confident64 Ų6475.2 Ų75.239%0.39342%0.422SS..  trans-68.5159.8165.661.30000110.2E189 E190 A191T187-E189 PolarHBondContact O-N 3.04Å; T187-E190 WeakPolarHBondContact CG2-OE1 3.36Å; T187-E190 PolarHBondContact N-OE2 3.14Å; T187-E190 PolarHBondContact O-N 3.12Å; T187-E190 WeakPolarHBondContact OG1-CB 3.38Å; T187-E190 WeakPolarHBondContact OG1-CG 3.47Å; T187-E190 PolarHBondContact OG1-N 2.73Å; T187-E190 PolarHBondContact OG1-OE1 3.3Å; T187-A191 WeakPolarHBondContact O-CB 3.46Å; T187-A191 PolarHBondContact O-N 3.47Å
188L78.9Confident76Confident32 Ų3275.5 Ų75.517%0.16844%0.439CS..Hα-helixtrans-62.9-37.7178-175.750.1000111.1A191 C192 V207 L208 F243L188-A191 PolarHBondContact O-N 2.86Å; L188-C192 WeakPolarHBondContact O-CB 3.14Å; L188-C192 PolarHBondContact O-N 2.91Å; L188-C192 PolarHBondContact O-SG 3.2Å; L188-V207 HydrophobicContact CD1-CB 3.79Å; L188-V207 HydrophobicContact CD1-CG1 3.37Å; L188-L208 HydrophobicContact CD1-CD2 4.38Å; L188-L208 HydrophobicContact CD1-CG 4.2Å; L188-L208 HydrophobicContact CD2-CD1 4.16Å; L188-L208 HydrophobicContact CD2-CD2 3.79Å; L188-L208 HydrophobicContact CD2-CG 3.92Å; L188-F243 HydrophobicContact CB-CE2 4.36Å; L188-F243 HydrophobicContact CD2-CD1 3.53Å; L188-F243 HydrophobicContact CD2-CD2 3.78Å; L188-F243 HydrophobicContact CD2-CE1 3.17Å; L188-F243 HydrophobicContact CD2-CE2 3.43Å; L188-F243 VanDerWaalsContact CD2-CE2 3.43Å; L188-F243 HydrophobicContact CD2-CG 3.83Å; L188-F243 HydrophobicContact CD2-CZ 3.12Å; L188-F243 HydrophobicContact CG-CD2 4.38Å; L188-F243 HydrophobicContact CG-CE1 4.31Å; L188-F243 HydrophobicContact CG-CE2 3.82Å; L188-F243 HydrophobicContact CG-CZ 3.8Å
189E78.8Confident76.5Confident164 Ų16478 Ų7877%0.76645%0.452SS*.Hα-helixtrans-60.7-49.3173.9-172.7177.8-178.600112.2T187 A191 C192 A193T187-E189 PolarHBondContact O-N 3.04Å; E189-A191 VanDerWaalsContact C-N 3.27Å; E189-A191 PolarHBondContact O-N 2.91Å; E189-C192 PolarHBondContact O-N 2.94Å; E189-C192 VanDerWaalsContact O-N 3.16Å; E189-A193 PolarHBondContact O-N 3.05Å
190E83.1Confident77.3Confident105 Ų10577.6 Ų77.649%0.49147%0.466SS..Hα-helixtrans-59.5-37.9175.4-78.1162.3-137.200112.8Q186 T187Q186-E190 WeakPolarHBondContact CA-OE2 3.37Å; Q186-E190 HydrophobicContact CB-CB 4.28Å; Q186-E190 HydrophobicContact CG-CB 4.47Å; T187-E190 WeakPolarHBondContact CG2-OE1 3.36Å; T187-E190 PolarHBondContact N-OE2 3.14Å; T187-E190 PolarHBondContact O-N 3.12Å; T187-E190 WeakPolarHBondContact OG1-CB 3.38Å; T187-E190 WeakPolarHBondContact OG1-CG 3.47Å; T187-E190 PolarHBondContact OG1-N 2.73Å; T187-E190 PolarHBondContact OG1-OE1 3.3Å
191A84.2Confident78.1Confident7 Ų773.7 Ų73.76%0.05846%0.464CS..Hα-helixtrans-73.5-30.4179.500000112.2I182 T187 L188 E189 L202 V207I182-A191 HydrophobicContact CG1-CB 4.33Å; I182-A191 HydrophobicContact CG2-CB 4.36Å; T187-A191 WeakPolarHBondContact O-CB 3.46Å; T187-A191 PolarHBondContact O-N 3.47Å; L188-A191 PolarHBondContact O-N 2.86Å; E189-A191 VanDerWaalsContact C-N 3.27Å; E189-A191 PolarHBondContact O-N 2.91Å; A191-L202 WeakPolarHBondContact O-CD1 3.24Å; A191-V207 HydrophobicContact CB-CG1 3.56Å; A191-V207 HydrophobicContact CB-CG2 4.46Å
192C84.4Confident78.5Confident22 Ų2273 Ų7315%0.14946%0.462CS..Hα-helixtrans-80.7-23175.2-67.40000112.8L188 E189 P201 L202L188-C192 WeakPolarHBondContact O-CB 3.14Å; L188-C192 PolarHBondContact O-N 2.91Å; L188-C192 PolarHBondContact O-SG 3.2Å; E189-C192 PolarHBondContact O-N 2.94Å; E189-C192 VanDerWaalsContact O-N 3.16Å; C192-P201 CarbonylContact O-C 3.53Å; C192-P201 VanDerWaalsContact O-CA 3.24Å; C192-P201 WeakPolarHBondContact O-CA 2.99Å; C192-P201 VanDerWaalsContact O-CB 3.28Å; C192-P201 WeakPolarHBondContact O-CB 3.33Å; C192-L202 PolarHBondContact O-N 3.44Å
193A82.3Confident79Confident48 Ų4877.3 Ų77.340%0.39749%0.485SS..SBendtrans-60.2142.6-17900000112.3E189 T195E189-A193 PolarHBondContact O-N 3.05Å; A193-T195 PolarHBondContact O-N 3.12Å
194P78.9Confident79.3Confident77 Ų7773.2 Ų73.250%0.547%0.472SS..  trans-65.7131.4179.328.7-35.2000110.6A196 I199P194-A196 VanDerWaalsContact C-N 3.35Å; P194-I199 WeakPolarHBondContact CB-O 3.44Å
195T81.3Confident80Confident91 Ų9177 Ų7756%0.55849%0.485SS*.SBendtrans-76.6-21-177.637.50000113.8Q181 A193Q181-T195 HydrophobicContact CG-CG2 4.22Å; Q181-T195 PolarHBondContact NE2-OG1 3.49Å; A193-T195 PolarHBondContact O-N 3.12Å
196A74.8Confident80.5Confident52 Ų5275.5 Ų75.543%0.4346%0.457SS..SBendtrans-151.3161175.900000110.2P194 G198 I199P194-A196 VanDerWaalsContact C-N 3.35Å; A196-G198 PolarHBondContact O-N 3.01Å; A196-I199 HydrophobicContact CB-CD1 3.77Å; A196-I199 HydrophobicContact CB-CG1 4.28Å; A196-I199 PolarHBondContact O-N 3.49Å
197V79.2Confident80.7Confident157 Ų15772.5 Ų72.595%0.95244%0.443SS*.THydrogen-bonded Turntrans-58.2127.3176.3-175.90000109.6
198G78.3Confident80.8Confident84 Ų8472.1 Ų72.187%0.86644%0.439SS*.THydrogen-bonded Turntrans90.6-1179.200000115.8A196A196-G198 PolarHBondContact O-N 3.01Å
199I76.2Confident80.9Confident79 Ų7972.6 Ų72.641%0.40545%0.445SS..PPolyproline II helixtrans-91132.5172.8-57.8-178.9000109P194 A196P194-I199 WeakPolarHBondContact CB-O 3.44Å; A196-I199 HydrophobicContact CB-CD1 3.77Å; A196-I199 HydrophobicContact CB-CG1 4.28Å; A196-I199 PolarHBondContact O-N 3.49Å
200A78.6Confident81Confident74 Ų7465 Ų6561%0.61241%0.409SS*.PPolyproline II helixtrans-64.9145.317500000111.2
201P82.9Confident80.9Confident94 Ų9462.1 Ų62.161%0.6140%0.399SS*.PPolyproline II helixtrans-57.9147.3173.425.8-33.7000110.6C192C192-P201 CarbonylContact O-C 3.53Å; C192-P201 VanDerWaalsContact O-CA 3.24Å; C192-P201 WeakPolarHBondContact O-CA 2.99Å; C192-P201 VanDerWaalsContact O-CB 3.28Å; C192-P201 WeakPolarHBondContact O-CB 3.33Å
202L83.6Confident80.7Confident37 Ų3767.4 Ų67.419%0.19442%0.417CS..PPolyproline II helixtrans-73.7143.9177.3-67-179.3000110.4I178 Q181 A191 C192 S204 V207I178-L202 HydrophobicContact CG1-CD1 4.47Å; I178-L202 HydrophobicContact CG1-CD2 3.93Å; I178-L202 HydrophobicContact CG2-CD1 4.26Å; Q181-L202 HydrophobicContact CB-CD1 4.47Å; A191-L202 WeakPolarHBondContact O-CD1 3.24Å; C192-L202 PolarHBondContact O-N 3.44Å; L202-S204 PolarHBondContact O-N 3.31Å; L202-V207 HydrophobicContact CB-CG2 3.87Å; L202-V207 HydrophobicContact CD1-CG2 4.33Å
203D82.7Confident80.5Confident91 Ų9171.3 Ų71.349%0.48743%0.432SS..PPolyproline II helixtrans-64.2126.7173.4176.117.2000110.9E205 L206 V207D203-E205 VanDerWaalsContact C-N 3.31Å; D203-E205 PolarHBondContact O-N 3.24Å; D203-E205 PolarHBondContact OD1-N 3.01Å; D203-L206 HydrophobicContact CB-CB 4.05Å; D203-L206 WeakPolarHBondContact O-CB 3.43Å; D203-L206 PolarHBondContact O-N 3.05Å; D203-L206 VanDerWaalsContact O-N 3.16Å; D203-V207 WeakPolarHBondContact O-CG2 3.48Å; D203-V207 PolarHBondContact O-N 3.32Å
204S80.6Confident80.4Confident43 Ų4371.5 Ų71.530%0.30142%0.422SS..Hα-helixtrans-60.5-37.6-177.668.50000112.7L202 L206 V207 L208L202-S204 PolarHBondContact O-N 3.31Å; S204-L206 VanDerWaalsContact C-N 3.32Å; S204-L206 PolarHBondContact O-N 3.34Å; S204-V207 PolarHBondContact O-N 2.91Å; S204-L208 WeakPolarHBondContact O-CB 3.32Å; S204-L208 VanDerWaalsContact O-CG 3.3Å; S204-L208 WeakPolarHBondContact O-CG 3.46Å; S204-L208 PolarHBondContact O-N 2.92Å
205E80.9Confident80.5Confident149 Ų14971.3 Ų71.370%0.69642%0.419SS*.Hα-helixtrans-66.3-39.7177.8-67.6-165.8174.800110.9D203 L208 S209D203-E205 VanDerWaalsContact C-N 3.31Å; D203-E205 PolarHBondContact O-N 3.24Å; D203-E205 PolarHBondContact OD1-N 3.01Å; E205-L208 PolarHBondContact O-N 3.47Å; E205-S209 WeakPolarHBondContact O-CB 3.4Å; E205-S209 PolarHBondContact O-N 3.45Å
206L82.4Confident80.5Confident51 Ų5169.4 Ų69.427%0.26741%0.405SS..Hα-helixtrans-65.9-42.7177.2-16856.4000111.3L175 I178 D203 S204 S209 V210L175-L206 HydrophobicContact CD2-CD1 3.79Å; I178-L206 HydrophobicContact CD1-CD2 3.32Å; I178-L206 HydrophobicContact CD1-CG 4.08Å; I178-L206 HydrophobicContact CG1-CD2 4.45Å; D203-L206 HydrophobicContact CB-CB 4.05Å; D203-L206 WeakPolarHBondContact O-CB 3.43Å; D203-L206 PolarHBondContact O-N 3.05Å; D203-L206 VanDerWaalsContact O-N 3.16Å; S204-L206 VanDerWaalsContact C-N 3.32Å; S204-L206 PolarHBondContact O-N 3.34Å; L206-S209 PolarHBondContact O-N 2.85Å; L206-S209 PolarHBondContact O-OG 3.25Å; L206-V210 WeakPolarHBondContact O-CG2 3.37Å; L206-V210 PolarHBondContact O-N 2.9Å
207V83.4Confident80.9Confident1 Ų174 Ų741%0.00641%0.412CS..Hα-helixtrans-61-46.8174.1174.80000110.8I182 L188 A191 L202 D203 S204 S209 V210 T211I182-V207 HydrophobicContact CD1-CB 4.08Å; I182-V207 HydrophobicContact CD1-CG1 3.89Å; I182-V207 HydrophobicContact CD1-CG2 3.93Å; I182-V207 HydrophobicContact CG1-CG1 4.34Å; I182-V207 HydrophobicContact CG1-CG2 4.44Å; L188-V207 HydrophobicContact CD1-CB 3.79Å; L188-V207 HydrophobicContact CD1-CG1 3.37Å; A191-V207 HydrophobicContact CB-CG1 3.56Å; A191-V207 HydrophobicContact CB-CG2 4.46Å; L202-V207 HydrophobicContact CB-CG2 3.87Å; L202-V207 HydrophobicContact CD1-CG2 4.33Å; D203-V207 WeakPolarHBondContact O-CG2 3.48Å; D203-V207 PolarHBondContact O-N 3.32Å; S204-V207 PolarHBondContact O-N 2.91Å; V207-S209 VanDerWaalsContact C-N 3.33Å; V207-S209 PolarHBondContact O-N 3.16Å; V207-V210 PolarHBondContact O-N 3.42Å; V207-T211 HydrophobicContact CG1-CG2 4.31Å; V207-T211 WeakPolarHBondContact O-CB 3.44Å; V207-T211 VanDerWaalsContact O-CG2 3.31Å; V207-T211 WeakPolarHBondContact O-CG2 3.43Å; V207-T211 PolarHBondContact O-N 3.2Å; V207-T211 PolarHBondContact O-OG1 3.03Å
208L82.3Confident81.1Confident57 Ų5772.8 Ų72.830%0.29839%0.39SS..Hα-helixtrans-59.8-41175.4-76172.9000112L188 S204 E205 V210 T211 R212 F243L188-L208 HydrophobicContact CD1-CD2 4.38Å; L188-L208 HydrophobicContact CD1-CG 4.2Å; L188-L208 HydrophobicContact CD2-CD1 4.16Å; L188-L208 HydrophobicContact CD2-CD2 3.79Å; L188-L208 HydrophobicContact CD2-CG 3.92Å; S204-L208 WeakPolarHBondContact O-CB 3.32Å; S204-L208 VanDerWaalsContact O-CG 3.3Å; S204-L208 WeakPolarHBondContact O-CG 3.46Å; S204-L208 PolarHBondContact O-N 2.92Å; E205-L208 PolarHBondContact O-N 3.47Å; L208-V210 PolarHBondContact O-N 2.9Å; L208-T211 VanDerWaalsContact CA-OG1 3.29Å; L208-T211 WeakPolarHBondContact CA-OG1 3.29Å; L208-T211 PolarHBondContact O-OG1 3.17Å; L208-R212 WeakPolarHBondContact O-CB 3.32Å; L208-R212 PolarHBondContact O-N 2.96Å; L208-F243 HydrophobicContact CD1-CE1 4.35Å
209S80.3Confident81.3Confident42 Ų4271 Ų7129%0.29436%0.359SS..Hα-helixtrans-64.5-40.3177.983.80000112.2E205 L206 V207 K213E205-S209 WeakPolarHBondContact O-CB 3.4Å; E205-S209 PolarHBondContact O-N 3.45Å; L206-S209 PolarHBondContact O-N 2.85Å; L206-S209 PolarHBondContact O-OG 3.25Å; V207-S209 VanDerWaalsContact C-N 3.33Å; V207-S209 PolarHBondContact O-N 3.16Å; S209-K213 WeakPolarHBondContact O-CG 3.35Å; S209-K213 PolarHBondContact O-N 3.42Å; S209-K213 VanDerWaalsContact O-N 3.08Å
210V81.1Confident81.7Confident4 Ų473.8 Ų73.82%0.02437%0.368CS..Hα-helixtrans-71.8-43.7-180171.60000110.6I178 R179 I182 L206 V207 L208 K213 R214I178-V210 HydrophobicContact CG2-CG2 4.12Å; R179-V210 HydrophobicContact CG-CG1 3.98Å; I182-V210 HydrophobicContact CD1-CB 3.9Å; I182-V210 HydrophobicContact CD1-CG1 3.88Å; I182-V210 HydrophobicContact CD1-CG2 4.46Å; L206-V210 WeakPolarHBondContact O-CG2 3.37Å; L206-V210 PolarHBondContact O-N 2.9Å; V207-V210 PolarHBondContact O-N 3.42Å; L208-V210 PolarHBondContact O-N 2.9Å; V210-K213 PolarHBondContact O-N 2.69Å; V210-R214 WeakPolarHBondContact O-CG 3.41Å; V210-R214 PolarHBondContact O-N 2.67Å; V210-R214 VanDerWaalsContact O-N 3.13Å
211T80.9Confident82.2Confident44 Ų4475.1 Ų75.127%0.2737%0.365SS..Hα-helixtrans-63.6-44.7175.7540000110.8I182 V207 L208 K213 R214 V215I182-T211 HydrophobicContact CG2-CG2 3.86Å; V207-T211 HydrophobicContact CG1-CG2 4.31Å; V207-T211 WeakPolarHBondContact O-CB 3.44Å; V207-T211 VanDerWaalsContact O-CG2 3.31Å; V207-T211 WeakPolarHBondContact O-CG2 3.43Å; V207-T211 PolarHBondContact O-N 3.2Å; V207-T211 PolarHBondContact O-OG1 3.03Å; L208-T211 VanDerWaalsContact CA-OG1 3.29Å; L208-T211 WeakPolarHBondContact CA-OG1 3.29Å; L208-T211 PolarHBondContact O-OG1 3.17Å; T211-K213 PolarHBondContact O-N 2.98Å; T211-R214 WeakPolarHBondContact O-CA 3.49Å; T211-R214 WeakPolarHBondContact O-CB 3.18Å; T211-R214 PolarHBondContact O-N 3.26Å; T211-V215 WeakPolarHBondContact O-CG2 3.33Å; T211-V215 PolarHBondContact O-N 2.76Å
212R80.2Confident82.3Confident119 Ų11971.4 Ų71.445%0.44934%0.342SS..Hα-helixtrans-54.6-48.3173.9-173.6177.1-175.5-173.33.8112L208 R214 V215 I216L208-R212 WeakPolarHBondContact O-CB 3.32Å; L208-R212 PolarHBondContact O-N 2.96Å; R212-R214 VanDerWaalsContact C-N 3.27Å; R212-R214 PolarHBondContact O-N 3.4Å; R212-V215 PolarHBondContact O-N 3.16Å; R212-I216 HydrophobicContact CG-CD1 4.04Å; R212-I216 VanDerWaalsContact O-CG1 3.32Å; R212-I216 WeakPolarHBondContact O-CG1 3.31Å; R212-I216 PolarHBondContact O-N 2.92Å
213K80.1Confident82.4Confident104 Ų10475.6 Ų75.645%0.45236%0.359SS..Hα-helixtrans-58.7-37.5176.1-76.6175.9-178.7172.90112.3S209 V210 T211 R217S209-K213 WeakPolarHBondContact O-CG 3.35Å; S209-K213 PolarHBondContact O-N 3.42Å; S209-K213 VanDerWaalsContact O-N 3.08Å; V210-K213 PolarHBondContact O-N 2.69Å; T211-K213 PolarHBondContact O-N 2.98Å; K213-R217 WeakPolarHBondContact O-CG 3.46Å; K213-R217 PolarHBondContact O-N 2.86Å; K213-R217 VanDerWaalsContact O-N 3.11Å
214R80.5Confident82.8Confident51 Ų5179.7 Ų79.719%0.19237%0.372CS..Hα-helixtrans-71.9-41.7177-70.8175179.4-177.7-0.9112.5R179 I182 V210 T211 R212 I216 R217 R218R179-R214 PolarHBondContact O-NH2 3.14Å; I182-R214 VanDerWaalsContact C-NH1 3.29Å; I182-R214 PolarHBondContact O-NH1 2.9Å; I182-R214 PolarHBondContact O-NH2 2.74Å; V210-R214 WeakPolarHBondContact O-CG 3.41Å; V210-R214 PolarHBondContact O-N 2.67Å; V210-R214 VanDerWaalsContact O-N 3.13Å; T211-R214 WeakPolarHBondContact O-CA 3.49Å; T211-R214 WeakPolarHBondContact O-CB 3.18Å; T211-R214 PolarHBondContact O-N 3.26Å; R212-R214 VanDerWaalsContact C-N 3.27Å; R212-R214 PolarHBondContact O-N 3.4Å; R214-I216 VanDerWaalsContact C-N 3.33Å; R214-R217 PolarHBondContact O-N 3.08Å; R214-R218 WeakPolarHBondContact O-CG 3.36Å; R214-R218 PolarHBondContact O-N 3.17Å
215V80.4Confident83.4Confident73 Ų7384 Ų8444%0.44239%0.391SS..Hα-helixtrans-58.8-47.5175.2172.50000109.8T211 R212 R217 R218 Q219T211-V215 WeakPolarHBondContact O-CG2 3.33Å; T211-V215 PolarHBondContact O-N 2.76Å; R212-V215 PolarHBondContact O-N 3.16Å; V215-R217 VanDerWaalsContact C-N 3.34Å; V215-R217 PolarHBondContact O-N 3.26Å; V215-R218 WeakPolarHBondContact O-CB 3.18Å; V215-R218 PolarHBondContact O-N 3.2Å; V215-R218 VanDerWaalsContact O-N 3.16Å; V215-Q219 HydrophobicContact CG1-CG 4.37Å; V215-Q219 WeakPolarHBondContact O-CB 3.4Å; V215-Q219 WeakPolarHBondContact O-CG 3.36Å; V215-Q219 PolarHBondContact O-N 2.76Å
216I81.5Confident83.8Confident52 Ų5280.1 Ų80.127%0.26739%0.391SS..Hα-helixtrans-59.6-43.5176.3-67.1166.6000111.5R212 R214 R218 Q219 K220R212-I216 HydrophobicContact CG-CD1 4.04Å; R212-I216 VanDerWaalsContact O-CG1 3.32Å; R212-I216 WeakPolarHBondContact O-CG1 3.31Å; R212-I216 PolarHBondContact O-N 2.92Å; R214-I216 VanDerWaalsContact C-N 3.33Å; I216-R218 VanDerWaalsContact C-N 3.35Å; I216-R218 PolarHBondContact O-N 3.06Å; I216-Q219 PolarHBondContact O-N 2.99Å; I216-K220 HydrophobicContact CG2-CD 4.34Å; I216-K220 WeakPolarHBondContact O-CG 3.28Å; I216-K220 PolarHBondContact O-N 3.24Å
217R83.7Confident84Confident149 Ų14983.8 Ų83.856%0.56241%0.405SS*.Hα-helixtrans-62.4-42.2176.9-76.5175.6-178.8-174.2-0.3111.9K213 R214 V215 K220 L221K213-R217 WeakPolarHBondContact O-CG 3.46Å; K213-R217 PolarHBondContact O-N 2.86Å; K213-R217 VanDerWaalsContact O-N 3.11Å; R214-R217 PolarHBondContact O-N 3.08Å; V215-R217 VanDerWaalsContact C-N 3.34Å; V215-R217 PolarHBondContact O-N 3.26Å; R217-K220 PolarHBondContact O-N 3.42Å; R217-L221 WeakPolarHBondContact O-CG 3.44Å; R217-L221 PolarHBondContact O-N 2.96Å
218R82.4Confident83.9Confident130 Ų13094.4 Ų94.449%0.49145%0.445SS..Hα-helixtrans-64.5-43.8176-75.3172.8167.8-168.1-14.8111.8T184 R214 V215 I216 K220 L221 A222T184-R218 VanDerWaalsContact CB-CZ 3.41Å; T184-R218 VanDerWaalsContact CB-NH1 3.27Å; T184-R218 PolarHBondContact OG1-NH2 3.03Å; R214-R218 WeakPolarHBondContact O-CG 3.36Å; R214-R218 PolarHBondContact O-N 3.17Å; V215-R218 WeakPolarHBondContact O-CB 3.18Å; V215-R218 PolarHBondContact O-N 3.2Å; V215-R218 VanDerWaalsContact O-N 3.16Å; I216-R218 VanDerWaalsContact C-N 3.35Å; I216-R218 PolarHBondContact O-N 3.06Å; R218-K220 VanDerWaalsContact C-N 3.32Å; R218-K220 PolarHBondContact O-N 3.44Å; R218-L221 PolarHBondContact O-N 2.99Å; R218-L221 VanDerWaalsContact O-N 3.17Å; R218-A222 WeakPolarHBondContact O-CB 3.4Å; R218-A222 PolarHBondContact O-N 2.83Å
219Q82.6Confident83.4Confident48 Ų4892.8 Ų92.822%0.22444%0.442CS..Hα-helixtrans-57.1-45.9173.1-73.5170.8-11.100111.3V215 I216 L221 A222 K223 I230V215-Q219 HydrophobicContact CG1-CG 4.37Å; V215-Q219 WeakPolarHBondContact O-CB 3.4Å; V215-Q219 WeakPolarHBondContact O-CG 3.36Å; V215-Q219 PolarHBondContact O-N 2.76Å; I216-Q219 PolarHBondContact O-N 2.99Å; Q219-L221 PolarHBondContact O-N 3.4Å; Q219-A222 PolarHBondContact O-N 3.29Å; Q219-K223 WeakPolarHBondContact O-CG 3.41Å; Q219-K223 PolarHBondContact O-N 3.34Å; Q219-I230 HydrophobicContact CB-CD1 3.93Å; Q219-I230 HydrophobicContact CG-CD1 3.33Å
220K85.3Confident83.1Confident136 Ų13694.4 Ų94.459%0.59145%0.446SS*.Hα-helixtrans-62.2-40.4175.6-72.8-179.9-179.1-1750112.6I216 R217 R218 K224I216-K220 HydrophobicContact CG2-CD 4.34Å; I216-K220 WeakPolarHBondContact O-CG 3.28Å; I216-K220 PolarHBondContact O-N 3.24Å; R217-K220 PolarHBondContact O-N 3.42Å; R218-K220 VanDerWaalsContact C-N 3.32Å; R218-K220 PolarHBondContact O-N 3.44Å; K220-K224 WeakPolarHBondContact O-CG 3.35Å; K220-K224 PolarHBondContact O-N 3.05Å; K220-K224 VanDerWaalsContact O-N 3.12Å
221L88.6Confident82.8Confident103 Ų10398.2 Ų98.254%0.53947%0.473SS..Hα-helixtrans-68.7-42.3176.2-72.5173.1000112.1R217 R218 Q219 K223 K224 L225R217-L221 WeakPolarHBondContact O-CG 3.44Å; R217-L221 PolarHBondContact O-N 2.96Å; R218-L221 PolarHBondContact O-N 2.99Å; R218-L221 VanDerWaalsContact O-N 3.17Å; Q219-L221 PolarHBondContact O-N 3.4Å; L221-K223 PolarHBondContact O-N 2.98Å; L221-K224 WeakPolarHBondContact O-CB 3.24Å; L221-K224 PolarHBondContact O-N 3.16Å; L221-K224 VanDerWaalsContact O-N 3.13Å; L221-L225 WeakPolarHBondContact O-CG 3.45Å; L221-L225 PolarHBondContact O-N 3.37Å
222A85.3Confident82.5Confident16 Ų16101.3 Ų101.313%0.13249%0.487CS..Hα-helixtrans-60.8-44.6176.700000110.9R218 Q219 K224 L225 G226 F227 I230R218-A222 WeakPolarHBondContact O-CB 3.4Å; R218-A222 PolarHBondContact O-N 2.83Å; Q219-A222 PolarHBondContact O-N 3.29Å; A222-K224 VanDerWaalsContact C-N 3.33Å; A222-K224 PolarHBondContact O-N 3.37Å; A222-L225 CarbonylContact O-C 3.57Å; A222-L225 PolarHBondContact O-N 2.88Å; A222-L225 VanDerWaalsContact O-N 3.09Å; A222-G226 PolarHBondContact O-N 3.2Å; A222-G226 VanDerWaalsContact O-N 3.15Å; A222-F227 HydrophobicContact CB-CB 4.02Å; A222-F227 HydrophobicContact CB-CD2 3.96Å; A222-F227 HydrophobicContact CB-CG 4.26Å; A222-F227 WeakPolarHBondContact O-CB 3.3Å; A222-F227 WeakPolarHBondContact O-CD2 3.39Å; A222-F227 PolarHBondContact O-N 3.04Å; A222-I230 HydrophobicContact CB-CD1 4.01Å; A222-I230 HydrophobicContact CB-CG1 4.38Å
223K86Confident82.4Confident125 Ų12598.6 Ų98.654%0.54349%0.486SS..Hα-helixtrans-57.8-43.7172.2-74-176.6178.8-173.50112.2Q219 L221 L225 G226Q219-K223 WeakPolarHBondContact O-CG 3.41Å; Q219-K223 PolarHBondContact O-N 3.34Å; L221-K223 PolarHBondContact O-N 2.98Å; K223-L225 VanDerWaalsContact C-N 3.25Å; K223-L225 PolarHBondContact O-N 3.47Å; K223-G226 PolarHBondContact O-N 3.28Å; K223-G226 VanDerWaalsContact O-N 3.13Å
224K90.7Very high82.4Confident177 Ų177100.9 Ų100.977%0.7750%0.496SS*.Hα-helixtrans-63.7-29.6176.4-76-179.7178.7-171.10113.4K220 L221 A222 G226K220-K224 WeakPolarHBondContact O-CG 3.35Å; K220-K224 PolarHBondContact O-N 3.05Å; K220-K224 VanDerWaalsContact O-N 3.12Å; L221-K224 WeakPolarHBondContact O-CB 3.24Å; L221-K224 PolarHBondContact O-N 3.16Å; L221-K224 VanDerWaalsContact O-N 3.13Å; A222-K224 VanDerWaalsContact C-N 3.33Å; A222-K224 PolarHBondContact O-N 3.37Å; K224-G226 VanDerWaalsContact C-N 3.32Å
225L92Very high82.2Confident134 Ų134105 Ų10570%0.70252%0.517SS*.THydrogen-bonded Turntrans-86.80.4177.3-66.8172.1000113.1L221 A222 K223 F227L221-L225 WeakPolarHBondContact O-CG 3.45Å; L221-L225 PolarHBondContact O-N 3.37Å; A222-L225 CarbonylContact O-C 3.57Å; A222-L225 PolarHBondContact O-N 2.88Å; A222-L225 VanDerWaalsContact O-N 3.09Å; K223-L225 VanDerWaalsContact C-N 3.25Å; K223-L225 PolarHBondContact O-N 3.47Å; L225-F227 HydrophobicContact CB-CD2 3.85Å; L225-F227 HydrophobicContact CB-CE2 3.84Å; L225-F227 HydrophobicContact CD1-CE2 4.21Å
226G90.4Very high81.8Confident67 Ų67105.2 Ų105.269%0.69152%0.519SS*.THydrogen-bonded Turntrans88.112.417700000115.3A222 K223 K224 R228A222-G226 PolarHBondContact O-N 3.2Å; A222-G226 VanDerWaalsContact O-N 3.15Å; K223-G226 PolarHBondContact O-N 3.28Å; K223-G226 VanDerWaalsContact O-N 3.13Å; K224-G226 VanDerWaalsContact C-N 3.32Å; G226-R228 PolarHBondContact O-N 2.74Å
227F86Confident81.4Confident127 Ų127108.9 Ų108.956%0.55754%0.535SS*.  trans-70.3130.7173.9-68.9-85.9000111A222 L225A222-F227 HydrophobicContact CB-CB 4.02Å; A222-F227 HydrophobicContact CB-CD2 3.96Å; A222-F227 HydrophobicContact CB-CG 4.26Å; A222-F227 WeakPolarHBondContact O-CB 3.3Å; A222-F227 WeakPolarHBondContact O-CD2 3.39Å; A222-F227 PolarHBondContact O-N 3.04Å; L225-F227 HydrophobicContact CB-CD2 3.85Å; L225-F227 HydrophobicContact CB-CE2 3.84Å; L225-F227 HydrophobicContact CD1-CE2 4.21Å
228R82.1Confident81Confident225 Ų225106.1 Ų106.185%0.84953%0.528SS*.  trans-65.8-35.7-180-174.5176.6177.9-176.4-1.2113G226G226-R228 PolarHBondContact O-N 2.74Å
229G72.4Confident80.6Confident23 Ų23103.8 Ų103.824%0.23753%0.526CS..  trans-166.9176.2-177.900000111.3
230I73.1Confident80Confident75 Ų75106.8 Ų106.839%0.38554%0.538SS..  trans-120122.3172.3-73.3156.9000106.5Q219 A222Q219-I230 HydrophobicContact CB-CD1 3.93Å; Q219-I230 HydrophobicContact CG-CD1 3.33Å; A222-I230 HydrophobicContact CB-CD1 4.01Å; A222-I230 HydrophobicContact CB-CG1 4.38Å
231S75Confident79.4Confident84 Ų84103.1 Ų103.159%0.58753%0.533SS*.PPolyproline II helixtrans-83.1141.2170.151.90000109.8
232I75.4Confident78.9Confident110 Ų110104 Ų10456%0.56453%0.533SS*.PPolyproline II helixtrans-103.5138.2169.9-60.2173.6000106.1T236I232-T236 HydrophobicContact CG2-CG2 4.06Å
233S77.6Confident78Confident61 Ų61106 Ų10643%0.42754%0.538SS..PPolyproline II helixtrans-70.8142.7178.186.10000110Q235 T236 E237S233-Q235 PolarHBondContact O-N 3.11Å; S233-T236 WeakPolarHBondContact O-CA 3.25Å; S233-T236 WeakPolarHBondContact O-CB 3.39Å; S233-T236 PolarHBondContact O-N 2.9Å; S233-T236 PolarHBondContact OG-N 3.17Å; S233-T236 PolarHBondContact OG-OG1 3.31Å; S233-E237 PolarHBondContact O-N 2.94Å
234K79.2Confident77Confident153 Ų153103.8 Ų103.867%0.66553%0.532SS*.Hα-helixtrans-53.5-39.5177.9-172.2178.9178.7-177.20112.3T236 E237 E238K234-T236 VanDerWaalsContact C-N 3.3Å; K234-T236 PolarHBondContact O-N 3.09Å; K234-E237 WeakPolarHBondContact O-CB 3.36Å; K234-E237 PolarHBondContact O-N 3.48Å; K234-E238 WeakPolarHBondContact CE-OE1 3.43Å; K234-E238 WeakPolarHBondContact O-CG 3.42Å; K234-E238 PolarHBondContact O-N 3.49Å
235Q77.6Confident76.1Confident136 Ų13698.4 Ų98.464%0.63652%0.517SS*.Hα-helixtrans-61-37.9176.2-172.4178.81500112.6S233 N239S233-Q235 PolarHBondContact O-N 3.11Å; Q235-N239 WeakPolarHBondContact O-CB 3.37Å; Q235-N239 PolarHBondContact O-N 2.66Å; Q235-N239 VanDerWaalsContact O-N 3.08Å; Q235-N239 PolarHBondContact O-ND2 2.86Å
236T70.9Confident74.8Confident78 Ų7897.6 Ų97.648%0.47951%0.509SS..Hα-helixtrans-68-38.7177-50.70000111.5I232 S233 K234 F240I232-T236 HydrophobicContact CG2-CG2 4.06Å; S233-T236 WeakPolarHBondContact O-CA 3.25Å; S233-T236 WeakPolarHBondContact O-CB 3.39Å; S233-T236 PolarHBondContact O-N 2.9Å; S233-T236 PolarHBondContact OG-N 3.17Å; S233-T236 PolarHBondContact OG-OG1 3.31Å; K234-T236 VanDerWaalsContact C-N 3.3Å; K234-T236 PolarHBondContact O-N 3.09Å; T236-F240 WeakPolarHBondContact O-CB 3.16Å; T236-F240 PolarHBondContact O-N 3.21Å
237E72.9Confident73.3Confident130 Ų13096.8 Ų96.861%0.60749%0.493SS*.Hα-helixtrans-65.8-46.7177.4-175.1174.4-16300111.7S233 K234 N239 F240 A241S233-E237 PolarHBondContact O-N 2.94Å; K234-E237 WeakPolarHBondContact O-CB 3.36Å; K234-E237 PolarHBondContact O-N 3.48Å; E237-N239 VanDerWaalsContact C-N 3.34Å; E237-N239 PolarHBondContact O-N 3.19Å; E237-F240 PolarHBondContact O-N 2.61Å; E237-F240 VanDerWaalsContact O-N 3.17Å; E237-A241 PolarHBondContact O-N 2.74Å
238E76.8Confident71.8Confident90 Ų9096 Ų9642%0.42150%0.495SS..Hα-helixtrans-59.2-43.5175.5-71.6173-169.200112K234 F240 A241 K242K234-E238 WeakPolarHBondContact CE-OE1 3.43Å; K234-E238 WeakPolarHBondContact O-CG 3.42Å; K234-E238 PolarHBondContact O-N 3.49Å; E238-F240 VanDerWaalsContact C-N 3.33Å; E238-F240 PolarHBondContact O-N 2.96Å; E238-A241 PolarHBondContact O-N 3.17Å; E238-K242 WeakPolarHBondContact O-CG 3.21Å; E238-K242 PolarHBondContact O-N 3.35Å
239N74Confident70.5Confident81 Ų8190.4 Ų90.443%0.43348%0.481SS..Hα-helixtrans-65.3-35.9177.1-73.6-11.5000112.4Q235 E237 K242 F243Q235-N239 WeakPolarHBondContact O-CB 3.37Å; Q235-N239 PolarHBondContact O-N 2.66Å; Q235-N239 VanDerWaalsContact O-N 3.08Å; Q235-N239 PolarHBondContact O-ND2 2.86Å; E237-N239 VanDerWaalsContact C-N 3.34Å; E237-N239 PolarHBondContact O-N 3.19Å; N239-K242 PolarHBondContact O-N 3.13Å; N239-F243 PolarHBondContact O-N 3.21Å
240F68.9Low69.5Low112 Ų11295.3 Ų95.349%0.49150%0.502SS..Hα-helixtrans-67.3-40.7176.8-173.5-104.5000111.8T236 E237 E238 F243 L244T236-F240 WeakPolarHBondContact O-CB 3.16Å; T236-F240 PolarHBondContact O-N 3.21Å; E237-F240 PolarHBondContact O-N 2.61Å; E237-F240 VanDerWaalsContact O-N 3.17Å; E238-F240 VanDerWaalsContact C-N 3.33Å; E238-F240 PolarHBondContact O-N 2.96Å; F240-F243 PolarHBondContact O-N 3.38Å; F240-L244 HydrophobicContact CD1-CD1 3.87Å; F240-L244 HydrophobicContact CD1-CG 4.44Å; F240-L244 HydrophobicContact CE1-CD1 3.36Å; F240-L244 HydrophobicContact CE1-CG 4.08Å; F240-L244 HydrophobicContact CZ-CD1 3.83Å; F240-L244 HydrophobicContact CZ-CD2 4.35Å; F240-L244 HydrophobicContact CZ-CG 4.17Å; F240-L244 PolarHBondContact O-N 3.21Å
241A73.7Confident68.4Low58 Ų5895.5 Ų95.548%0.47951%0.51SS..Hα-helixtrans-62.9-40.9174.600000112.4E237 E238 F243 L244 S245E237-A241 PolarHBondContact O-N 2.74Å; E238-A241 PolarHBondContact O-N 3.17Å; A241-F243 VanDerWaalsContact C-N 3.34Å; A241-F243 PolarHBondContact O-N 3.18Å; A241-L244 PolarHBondContact O-N 3.29Å; A241-S245 PolarHBondContact O-N 3.31Å; A241-S245 VanDerWaalsContact O-N 3.12Å; A241-S245 PolarHBondContact O-OG 3.11Å
242K77.7Confident67.2Low123 Ų12395.7 Ų95.754%0.53551%0.511SS..Hα-helixtrans-61.7-40.7173.2-71.7176.1-175.9177.70112.2E238 N239 S245 Q246E238-K242 WeakPolarHBondContact O-CG 3.21Å; E238-K242 PolarHBondContact O-N 3.35Å; N239-K242 PolarHBondContact O-N 3.13Å; K242-S245 WeakPolarHBondContact CA-OG 3.41Å; K242-S245 PolarHBondContact O-N 3.48Å; K242-S245 PolarHBondContact O-OG 3.27Å; K242-Q246 WeakPolarHBondContact O-CG 3.37Å; K242-Q246 PolarHBondContact O-N 3.32Å; K242-Q246 VanDerWaalsContact O-N 3.14Å
243F66.1Low65.8Low57 Ų5797.6 Ų97.625%0.2552%0.517CS..Hα-helixtrans-66.9-44179.6-170.8-90.3000112.4L188 L208 N239 F240 A241 S245 Q246 S247L188-F243 HydrophobicContact CB-CE2 4.36Å; L188-F243 HydrophobicContact CD2-CD1 3.53Å; L188-F243 HydrophobicContact CD2-CD2 3.78Å; L188-F243 HydrophobicContact CD2-CE1 3.17Å; L188-F243 HydrophobicContact CD2-CE2 3.43Å; L188-F243 VanDerWaalsContact CD2-CE2 3.43Å; L188-F243 HydrophobicContact CD2-CG 3.83Å; L188-F243 HydrophobicContact CD2-CZ 3.12Å; L188-F243 HydrophobicContact CG-CD2 4.38Å; L188-F243 HydrophobicContact CG-CE1 4.31Å; L188-F243 HydrophobicContact CG-CE2 3.82Å; L188-F243 HydrophobicContact CG-CZ 3.8Å; L208-F243 HydrophobicContact CD1-CE1 4.35Å; N239-F243 PolarHBondContact O-N 3.21Å; F240-F243 PolarHBondContact O-N 3.38Å; A241-F243 VanDerWaalsContact C-N 3.34Å; A241-F243 PolarHBondContact O-N 3.18Å; F243-S245 VanDerWaalsContact C-N 3.31Å; F243-S245 PolarHBondContact O-N 2.72Å; F243-Q246 PolarHBondContact O-N 2.77Å; F243-S247 PolarHBondContact O-N 2.9Å
244L64.6Low64.3Low78 Ų7899.6 Ų99.641%0.40853%0.531SS..Hα-helixtrans-65.9-32.3178.1-72.3177.3000113.2F240 A241 S247 N248F240-L244 HydrophobicContact CD1-CD1 3.87Å; F240-L244 HydrophobicContact CD1-CG 4.44Å; F240-L244 HydrophobicContact CE1-CD1 3.36Å; F240-L244 HydrophobicContact CE1-CG 4.08Å; F240-L244 HydrophobicContact CZ-CD1 3.83Å; F240-L244 HydrophobicContact CZ-CD2 4.35Å; F240-L244 HydrophobicContact CZ-CG 4.17Å; F240-L244 PolarHBondContact O-N 3.21Å; A241-L244 PolarHBondContact O-N 3.29Å; L244-S247 PolarHBondContact O-OG 3.39Å; L244-N248 PolarHBondContact O-ND2 2.97Å
245S71.4Confident62.7Low64 Ų6497.4 Ų97.445%0.44854%0.535SS..Hα-helixtrans-70.9-35.8174.644.10000111.9A241 K242 F243A241-S245 PolarHBondContact O-N 3.31Å; A241-S245 VanDerWaalsContact O-N 3.12Å; A241-S245 PolarHBondContact O-OG 3.11Å; K242-S245 WeakPolarHBondContact CA-OG 3.41Å; K242-S245 PolarHBondContact O-N 3.48Å; K242-S245 PolarHBondContact O-OG 3.27Å; F243-S245 VanDerWaalsContact C-N 3.31Å; F243-S245 PolarHBondContact O-N 2.72Å
246Q65.1Low61Low117 Ų11796.1 Ų96.155%0.54754%0.541SS..Hα-helixtrans-70.8-36.6176.1-72.2177.7-5.200113.5K242 F243 N248 L249 N250K242-Q246 WeakPolarHBondContact O-CG 3.37Å; K242-Q246 PolarHBondContact O-N 3.32Å; K242-Q246 VanDerWaalsContact O-N 3.14Å; F243-Q246 PolarHBondContact O-N 2.77Å; Q246-N248 PolarHBondContact O-N 3.42Å; Q246-L249 PolarHBondContact O-N 3.39Å; Q246-L249 VanDerWaalsContact O-N 3.13Å; Q246-N250 PolarHBondContact O-N 3.47Å
247S58.5Low59.4Low50 Ų5097.4 Ų97.435%0.3556%0.56SS.*Hα-helixtrans-62.8-32.2178.656.80000112.8F243 L244 L249F243-S247 PolarHBondContact O-N 2.9Å; L244-S247 PolarHBondContact O-OG 3.39Å; S247-L249 VanDerWaalsContact C-N 3.3Å; S247-L249 PolarHBondContact O-N 3.15Å
248N55.6Low57.9Low110 Ų11096.7 Ų96.759%0.58857%0.569SS**Hα-helixtrans-74-21178.1-67.6-16.3000113.2L244 Q246 S251L244-N248 PolarHBondContact O-ND2 2.97Å; Q246-N248 PolarHBondContact O-N 3.42Å; N248-S251 PolarHBondContact O-OG 3.11Å
249L53.8Low56Low109 Ų109103.1 Ų103.157%0.57161%0.614SS**Hα-helixtrans-83.2-32.9176.9-65.2170.3000111.4Q246 S247 S251 S252 H253Q246-L249 PolarHBondContact O-N 3.39Å; Q246-L249 VanDerWaalsContact O-N 3.13Å; S247-L249 VanDerWaalsContact C-N 3.3Å; S247-L249 PolarHBondContact O-N 3.15Å; L249-S251 VanDerWaalsContact C-N 3.35Å; L249-S251 PolarHBondContact O-N 3.39Å; L249-S252 PolarHBondContact O-N 3.35Å; L249-H253 PolarHBondContact O-CD2 3.19Å
250N51.3Low55.1Low126 Ų126104.2 Ų104.267%0.67462%0.623SS**Hα-helixtrans-76.7-17.9-179.5-73.3-5000113.8Q246 S252Q246-N250 PolarHBondContact O-N 3.47Å; N250-S252 VanDerWaalsContact C-N 3.32Å
251S50.4Low54.4Low78 Ų78103.8 Ų103.855%0.54563%0.63SS.*THydrogen-bonded Turntrans-78.6-14173.561.20000113.9N248 L249N248-S251 PolarHBondContact O-OG 3.11Å; L249-S251 VanDerWaalsContact C-N 3.35Å; L249-S251 PolarHBondContact O-N 3.39Å
252S49.1Very low53.3Low88 Ų88106.3 Ų106.362%0.61564%0.638SS**SBendtrans-97.5-4.4-174.3-59.70000114.3L249 N250L249-S252 PolarHBondContact O-N 3.35Å; N250-S252 VanDerWaalsContact C-N 3.32Å
253H46.6Very low51.9Low151 Ų151105.4 Ų105.470%0.69964%0.644SS**SBendtrans-106.13-176.4-73.4-55.2000115.2L249L249-H253 PolarHBondContact O-CD2 3.19Å
254S47Very low51Low102 Ų102108.4 Ų108.471%0.71367%0.669SS**SBendtrans-99.713.5-177.839.60000114.7
255S45.1Very low50.1Low108 Ų108110.4 Ų110.476%0.75569%0.686SS**SBendtrans-112.212.4-176.6-44.50000115.7
256S41Very low48.5Very low108 Ų108113.7 Ų113.776%0.75570%0.703SS**  trans-127.672.7179.963.90000112
257A37.6Very low47.3Very low105 Ų105113.5 Ų113.587%0.86872%0.716SS**  trans-149.577.1165.100000108.9
258S41.2Very low46.3Very low115 Ų115118.8 Ų118.880%0.80475%0.746SS**  trans-146.9104164.554.30000107.8
259V37.3Very low45.5Very low225 Ų225119.5 Ų119.5100%1.36476%0.76SS**  trans-111.80156178.80000105.8

Retrieved 259 of 259 residues in 117.2 ms (Link to these results)