G4V7U7_SCHMA Loading...

Bestrophin homolog

AlphaFold DB , UniProt , Accession G4V7U7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 313 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
1M54.3Low70.3Confident232 Ų232131.9 Ų131.9100%1.14365%0.652SS**  01.60-72.1176.6169.100114.4
2T61.9Low70.5Confident117 Ų117131.4 Ų131.472%0.71865%0.647SS**Hα-helixtrans-75.2-28.5-171.9390000115.9H4 L5 T6T2-H4 PolarHBondContact O-N 3.41Å; T2-L5 PolarHBondContact O-N 3.39Å; T2-T6 PolarHBondContact O-OG1 3.29Å
3S73.7Confident70.7Confident97 Ų97132.7 Ų132.768%0.67865%0.65SS**Hα-helixtrans-65.2-30.9-171.152.60000115.3R7S3-R7 WeakPolarHBondContact O-CB 3.48Å; S3-R7 PolarHBondContact O-N 3.37Å
4H69.2Low71Confident128 Ų128133.4 Ų133.459%0.59364%0.642SS**Hα-helixtrans-72.1-37.8-179.1-165.3-90.4000112.1T2 R7 M8T2-H4 PolarHBondContact O-N 3.41Å; H4-R7 PolarHBondContact O-N 3.5Å; H4-M8 WeakPolarHBondContact O-CG 3.43Å; H4-M8 PolarHBondContact O-N 3.46Å
5L73.2Confident70.6Confident118 Ų118132.5 Ų132.562%0.61864%0.641SS**Hα-helixtrans-69.4-44.1-177.1-134.1166.1000111.1T2 R7 M8 Q9T2-L5 PolarHBondContact O-N 3.39Å; L5-R7 VanDerWaalsContact C-N 3.29Å; L5-R7 PolarHBondContact O-N 3.27Å; L5-M8 PolarHBondContact O-N 3.05Å; L5-Q9 PolarHBondContact O-N 3.26Å
6T73.2Confident70.2Confident91 Ų91131.7 Ų131.756%0.55864%0.641SS**Hα-helixtrans-61.1-37.6173.4-40.70000112T2 Y10T2-T6 PolarHBondContact O-OG1 3.29Å; T6-Y10 PolarHBondContact O-N 3.32Å; T6-Y10 VanDerWaalsContact O-N 3.09Å
7R70.7Confident69.6Low182 Ų182128.4 Ų128.469%0.68763%0.634SS**Hα-helixtrans-67.4-40177.2-169.5174.8-177.4171.20.4112.3S3 H4 L5 Y10 E11S3-R7 WeakPolarHBondContact O-CB 3.48Å; S3-R7 PolarHBondContact O-N 3.37Å; H4-R7 PolarHBondContact O-N 3.5Å; L5-R7 VanDerWaalsContact C-N 3.29Å; L5-R7 PolarHBondContact O-N 3.27Å; R7-Y10 PolarHBondContact O-N 3.02Å; R7-E11 PolarHBondContact O-N 3.32Å; R7-E11 VanDerWaalsContact O-N 3.12Å
8M72.8Confident68.8Low113 Ų113128.2 Ų128.256%0.55764%0.635SS**Hα-helixtrans-66.3-43175.7-66.2-127.1-64.900112.3H4 L5 Y10 E11 Q12H4-M8 WeakPolarHBondContact O-CG 3.43Å; H4-M8 PolarHBondContact O-N 3.46Å; L5-M8 PolarHBondContact O-N 3.05Å; M8-Y10 VanDerWaalsContact C-N 3.32Å; M8-Y10 PolarHBondContact O-N 3.39Å; M8-E11 PolarHBondContact O-N 3.01Å; M8-Q12 WeakPolarHBondContact O-CB 3.36Å; M8-Q12 PolarHBondContact O-N 3.41Å
9Q73.5Confident67.8Low124 Ų124125.1 Ų125.158%0.57964%0.64SS**Hα-helixtrans-59.4-41.9174.2-83.8-175-52.600112.2L5 Q12 Q13L5-Q9 PolarHBondContact O-N 3.26Å; Q9-Q12 PolarHBondContact O-N 3.12Å; Q9-Q13 VanDerWaalsContact O-CB 3.31Å; Q9-Q13 WeakPolarHBondContact O-CB 3.31Å; Q9-Q13 PolarHBondContact O-N 3.41Å
10Y75.8Confident66.8Low163 Ų163130.1 Ų130.164%0.63965%0.65SS**Hα-helixtrans-63.8-44.8178.9-172.6-96.3000112.8T6 R7 M8 R14T6-Y10 PolarHBondContact O-N 3.32Å; T6-Y10 VanDerWaalsContact O-N 3.09Å; R7-Y10 PolarHBondContact O-N 3.02Å; M8-Y10 VanDerWaalsContact C-N 3.32Å; M8-Y10 PolarHBondContact O-N 3.39Å; Y10-R14 WeakPolarHBondContact O-CB 3.44Å; Y10-R14 PolarHBondContact O-N 3.48Å
11E74.8Confident65.6Low86 Ų86129.6 Ų129.640%0.40265%0.654SS.*Hα-helixtrans-60.6-44.9174-76.4-69.8152.900111.8R7 M8 Q13 R14 L15R7-E11 PolarHBondContact O-N 3.32Å; R7-E11 VanDerWaalsContact O-N 3.12Å; M8-E11 PolarHBondContact O-N 3.01Å; E11-Q13 PolarHBondContact O-N 3.37Å; E11-R14 WeakPolarHBondContact O-CB 3.33Å; E11-R14 PolarHBondContact O-N 3.22Å; E11-L15 PolarHBondContact O-N 3.38Å
12Q73.3Confident64.8Low126 Ų126122.1 Ų122.159%0.58964%0.636SS**Hα-helixtrans-68.9-36.8-177.6-161.7162.816.600112.6M8 Q9 R14 L15 N16M8-Q12 WeakPolarHBondContact O-CB 3.36Å; M8-Q12 PolarHBondContact O-N 3.41Å; Q9-Q12 PolarHBondContact O-N 3.12Å; Q12-R14 VanDerWaalsContact C-N 3.33Å; Q12-L15 PolarHBondContact O-N 3.09Å; Q12-N16 PolarHBondContact O-N 2.94Å; Q12-N16 VanDerWaalsContact O-N 3.11Å
13Q73.3Confident63.7Low148 Ų148122 Ų12269%0.69264%0.641SS**Hα-helixtrans-70.4-30.5174.2-158.9167.612.900112Q9 E11 S17Q9-Q13 VanDerWaalsContact O-CB 3.31Å; Q9-Q13 WeakPolarHBondContact O-CB 3.31Å; Q9-Q13 PolarHBondContact O-N 3.41Å; E11-Q13 PolarHBondContact O-N 3.37Å; Q13-S17 PolarHBondContact O-N 3.28Å; Q13-S17 PolarHBondContact O-OG 3.11Å
14R74.1Confident62Low143 Ų143123 Ų12354%0.5465%0.647SS.*Hα-helixtrans-69.6-44.7172.8-171.5177.6178.5-130.6-1.1111.9Y10 E11 Q12 N16 S17 L18Y10-R14 WeakPolarHBondContact O-CB 3.44Å; Y10-R14 PolarHBondContact O-N 3.48Å; E11-R14 WeakPolarHBondContact O-CB 3.33Å; E11-R14 PolarHBondContact O-N 3.22Å; Q12-R14 VanDerWaalsContact C-N 3.33Å; R14-N16 PolarHBondContact O-N 3.03Å; R14-S17 PolarHBondContact O-N 3.02Å; R14-S17 PolarHBondContact O-OG 3.49Å; R14-L18 HydrophobicContact CG-CD1 4.38Å; R14-L18 WeakPolarHBondContact O-CD1 3.42Å; R14-L18 PolarHBondContact O-N 2.95Å
15L65.5Low60.6Low120 Ų120122.3 Ų122.363%0.62866%0.657SS**Hα-helixtrans-62.4-43.2176.6-73.6165.2000112.2E11 Q12 S17 L18 G19E11-L15 PolarHBondContact O-N 3.38Å; Q12-L15 PolarHBondContact O-N 3.09Å; L15-S17 PolarHBondContact O-N 3.43Å; L15-L18 PolarHBondContact O-N 3.28Å; L15-G19 PolarHBondContact O-N 3.25Å; L15-G19 VanDerWaalsContact O-N 3.09Å
16N64.2Low59Low119 Ų119122.3 Ų122.364%0.63667%0.667SS**Hα-helixtrans-65.9-22.2176.5-79.7-15.6000114.1Q12 R14Q12-N16 PolarHBondContact O-N 2.94Å; Q12-N16 VanDerWaalsContact O-N 3.11Å; R14-N16 PolarHBondContact O-N 3.03Å
17S59.4Low57.3Low75 Ų75125.9 Ų125.952%0.52468%0.682SS.*Hα-helixtrans-83.9-28.6174.863.20000113.4Q13 R14 L15Q13-S17 PolarHBondContact O-N 3.28Å; Q13-S17 PolarHBondContact O-OG 3.11Å; R14-S17 PolarHBondContact O-N 3.02Å; R14-S17 PolarHBondContact O-OG 3.49Å; L15-S17 PolarHBondContact O-N 3.43Å
18L56.3Low55.9Low125 Ų125128.7 Ų128.765%0.65469%0.693SS**Hα-helixtrans-78.5-25.4172.2-88.580000113.3R14 L15 R20R14-L18 HydrophobicContact CG-CD1 4.38Å; R14-L18 WeakPolarHBondContact O-CD1 3.42Å; R14-L18 PolarHBondContact O-N 2.95Å; L15-L18 PolarHBondContact O-N 3.28Å; L18-R20 PolarHBondContact O-N 3.25Å
19G49.9Very low54.2Low70 Ų70128.3 Ų128.372%0.72270%0.701SS**THydrogen-bonded Turntrans-74.61.9-179.100000116.3L15L15-G19 PolarHBondContact O-N 3.25Å; L15-G19 VanDerWaalsContact O-N 3.09Å
20R46Very low52.9Low225 Ų225128.2 Ų128.285%0.84971%0.714SS**THydrogen-bonded Turntrans-121.510.6-164.6-135.6174.2-174176.71.8116.6L18L18-R20 PolarHBondContact O-N 3.25Å
21T43.1Very low51.1Low119 Ų119127.5 Ų127.573%0.7372%0.721SS**  trans-112.554.1175.457.10000112.4S23T21-S23 PolarHBondContact O-N 2.88Å
22G36.5Very low49.7Very low75 Ų75128.8 Ų128.877%0.77374%0.737SS**  trans-92.663.7168.300000111.5S24G22-S24 PolarHBondContact O-N 3.13Å; G22-S24 VanDerWaalsContact O-N 3.1Å
23S38.4Very low48Very low115 Ų115128.6 Ų128.680%0.80474%0.744SS**  trans-79.592.7-178.6-61.90000111.4T21 S25T21-S23 PolarHBondContact O-N 2.88Å; S23-S25 PolarHBondContact O-N 3.39Å
24S38.4Very low46.4Very low117 Ų117133.3 Ų133.382%0.81876%0.755SS**  trans-68.3107168.651.10000111.2G22G22-S24 PolarHBondContact O-N 3.13Å; G22-S24 VanDerWaalsContact O-N 3.1Å
25S39.8Very low45Very low115 Ų115132.3 Ų132.380%0.80477%0.765SS**  trans-95103.9166.658.30000110S23S23-S25 PolarHBondContact O-N 3.39Å
26S40.9Very low44.1Very low117 Ų117132.1 Ų132.182%0.81877%0.771SS**  trans-72.7129178.249.30000112.4
27L37.4Very low42.9Very low167 Ų167131.3 Ų131.387%0.87478%0.775SS**  trans-96.7121.5167-74.6168.3000110.1
28R40.6Very low41.7Very low241 Ų241134.1 Ų134.191%0.90979%0.789SS**  trans150.9148.8163.4-92.4171.6170.4-169.2-4.6108.5
29S37.6Very low41Very low104 Ų104136.1 Ų136.173%0.72780%0.799SS**  cis-175.3128.2-16.745.30000108.7
30S44.9Very low40.4Very low123 Ų123136.9 Ų136.986%0.8679%0.793SS**  trans-170.5107.7164.450.50000111.6
31D39Very low40.2Very low147 Ų147133.7 Ų133.779%0.78679%0.791SS**  trans-67.6173.7158.5-113-46.3000110.2
32P44.8Very low40Very low113 Ų113139.6 Ų139.673%0.73480%0.8SS**  cis-144.6153.635.439-17.5000120.1
33V38.9Very low40.2Very low122 Ų122141.2 Ų141.274%0.73980%0.797SS**  trans41110.7132.7-172.10000119.7
34R39.8Very low40.3Very low247 Ų247141.7 Ų141.793%0.93279%0.794SS**  trans-156.6129.7137.9-131.2175.3-162.3163.26.9112.9
35V44.5Very low40.2Very low122 Ų122142.5 Ų142.574%0.73979%0.79SS**  trans-102.3160.5169-155.80000108.2
36P44.9Very low40.2Very low116 Ų116145.7 Ų145.775%0.75379%0.792SS**  -146.9140.1113.736.3-20.2000117.3
37S40.7Very low40Very low103 Ų103144.4 Ų144.472%0.7278%0.783SS**  trans44.3116.1142.2620000123.1
38T33.6Very low40.2Very low134 Ų134143.2 Ų143.282%0.82278%0.776SS**  trans-67.6145.5145.742.40000113.7
39I42.5Very low40.2Very low167 Ų167138.5 Ų138.586%0.85677%0.769SS**  trans-175.6157.4149.8-92.5145.5000106.6
40S37.1Very low40.5Very low86 Ų86143.1 Ų143.160%0.60178%0.779SS**  -160.8171.5-62.366.90000109.2
41I40.2Very low40.5Very low158 Ų158146 Ų14681%0.8178%0.779SS**  trans77.595.3159.9-56.8159000118.9
42R39.9Very low40.9Very low243 Ų243143.4 Ų143.492%0.91777%0.77SS**  49.2157.7125.6-87.3-158.2167168.4-2124.9
43P40.3Very low40.8Very low109 Ų109145.4 Ų145.471%0.70878%0.78SS**  trans-112.9-178.4-163.244.5-35.4000114.6
44V41.4Very low40.9Very low124 Ų124143.1 Ų143.175%0.75278%0.781SS**  trans177.6131.7130.6145.70000113
45N35.3Very low40.7Very low135 Ų135136.7 Ų136.772%0.72277%0.774SS**  trans48.8148152.4-72-10.9000126.2
46Q40.3Very low40.7Very low182 Ų182137.3 Ų137.385%0.8578%0.778SS**  trans69.9140.9157.7-70.116313.600117.2
47S36.4Very low40.4Very low90 Ų90138.5 Ų138.563%0.62978%0.783SS**  cis-168.5174.9-16.455.60000109.8
48I41.7Very low40.4Very low141 Ų141138.9 Ų138.972%0.72379%0.785SS**  trans81.3104.9159-60.4161.3000118.3
49N40.6Very low40.5Very low143 Ų143135.4 Ų135.477%0.76578%0.777SS**  trans48.5112.5137.2-51.5-8.7000121.6
50Q44.4Very low40.2Very low201 Ų201132.5 Ų132.594%0.93977%0.771SS**  -168.6163.796.6-99.7175.55.900112
51E43.9Very low40.5Very low184 Ų184139.3 Ų139.386%0.8679%0.785SS**  trans-106.3-167.2-155.4-138.4-152.3142.600113.1
52P47Very low40.5Very low91 Ų91139.6 Ų139.659%0.59179%0.787SS**  -123177.7-120.441.8-24.2000114.7
53T43.8Very low40.5Very low155 Ų155133.8 Ų133.895%0.95178%0.784SS**  trans178.6148.6137.920.90000111.9
54G40.8Very low40.4Very low74 Ų74132.7 Ų132.776%0.76378%0.778SS**  trans126.876.2166.400000115.4
55S36.4Very low40.3Very low113 Ų113136.2 Ų136.279%0.7978%0.784SS**  trans-73.2132.9-179.662.70000113.6
56V42.7Very low40.5Very low135 Ų135135.6 Ų135.682%0.81879%0.789SS**  trans-121.4108.2162.8-175.70000108.7S58V56-S58 PolarHBondContact O-N 3.23Å
57V40.5Very low40.2Very low141 Ų141138 Ų13886%0.85579%0.791SS**  trans-80.8103.8177.9177.50000109.4
58S39Very low40.1Very low110 Ų110138.7 Ų138.777%0.76979%0.793SS**  trans-118102168.9-164.40000109V56V56-S58 PolarHBondContact O-N 3.23Å
59G37.2Very low40Very low62 Ų62141.4 Ų141.464%0.63980%0.803SS**  trans-90.3108.6-176.700000112.1
60S35.6Very low39.6Very low106 Ų106143 Ų14374%0.74181%0.81SS**  trans-152.3100.7166.6-780000110
61Y43.6Very low39.1Very low228 Ų228136.7 Ų136.789%0.89480%0.798SS**  trans-100.1105.8172.6-65.3-75.1000109.8S63Y61-S63 PolarHBondContact O-N 3.35Å
62I39.6Very low38.4Very low164 Ų164134 Ų13484%0.84180%0.799SS**  trans-73.1118.4161.6-61.1167.6000106.5
63S40.6Very low37.9Very low122 Ų122136.6 Ų136.685%0.85381%0.813SS**  trans-105.3146.9161.6-167.90000109.3Y61Y61-S63 PolarHBondContact O-N 3.35Å
64S38.4Very low37.4Very low85 Ų85131.6 Ų131.659%0.59479%0.792SS**  trans-133.7157.5-159.366.20000113.1
65K39.5Very low37.3Very low199 Ų199136.7 Ų136.787%0.86580%0.802SS**  trans73.2145.8177.3-51.1172.2-1771780113.4
66S38Very low37.5Very low121 Ų121136.3 Ų136.385%0.84680%0.795SS**  cis-153.3150.80.226.80000112.1
67R33.8Very low37.2Very low233 Ų233140 Ų14088%0.87980%0.796SS**  trans-82.2169.1173.2174.6-177-176.1-149.62.6110.7
68P36.1Very low36.9Very low104 Ų104141.9 Ų141.968%0.67580%0.795SS**  cis-121.8163.5-29.632.8-18.2000113.3
69Q38.2Very low36.8Very low199 Ų199142.9 Ų142.993%0.9379%0.792SS**  trans-152.7159.7142.3-85.4-145.3-11.100112.6
70I33.7Very low36.8Very low177 Ų177146.5 Ų146.591%0.90880%0.795SS**  trans-82.5136.9-175.3-64.9152.9000109.5
71G32.1Very low36.8Very low67 Ų67149.6 Ų149.669%0.69180%0.8SS**  trans-175.5117.7177.100000114.7
72S30.5Very low36.3Very low127 Ų127148.9 Ų148.989%0.88880%0.801SS**  trans-72.5126.4176.4163.10000112.4
73V35.3Very low36Very low147 Ų147146.7 Ų146.789%0.89180%0.801SS**  trans-146.2133.5165.6-169.30000107.1
74G34.2Very low35.6Very low49 Ų49146.8 Ų146.851%0.50580%0.796SS.*  cis168.692.2-3.300000109.2V76G74-V76 PolarHBondContact O-N 3.18Å; G74-V76 VanDerWaalsContact O-N 3.14Å
75N39Very low35.5Very low182 Ų182151.7 Ų151.797%0.97381%0.807SS**  trans-78.395.7174.2-83.3-9.1000109.3
76V39.9Very low35.1Very low105 Ų105149.8 Ų149.864%0.63680%0.801SS**  trans-102.3155.5178.2-173.20000109.8G74G74-V76 PolarHBondContact O-N 3.18Å; G74-V76 VanDerWaalsContact O-N 3.14Å
77Y37.5Very low34.9Very low212 Ų212152.3 Ų152.383%0.83180%0.802SS**  trans87.257.2178-54.6-71.2000117.5
78Q33.7Very low34.6Very low181 Ų181148.5 Ų148.585%0.84680%0.799SS**  trans-71.8130.3130.7176.4-176.929.600108.5
79N35.9Very low34.8Very low131 Ų131148.5 Ų148.570%0.70180%0.799SS**  trans-178.8134.3147.1-102.8-25000115.1
80I37.6Very low34.5Very low138 Ų138144.5 Ų144.571%0.70879%0.792SS**  trans67.2127141.4-57.4163.4000116
81M36.2Very low34.6Very low170 Ų170141.5 Ų141.584%0.83778%0.781SS**  cis-150.6138.927.6-146.4149.8179.400111.9
82K33.6Very low34.7Very low213 Ų213147.8 Ų147.893%0.92679%0.785SS**  trans-99.7132.2156.1-73.8178.4176.1178.60107.5
83S32.7Very low34.9Very low119 Ų119150 Ų15083%0.83278%0.784SS**  trans-157.6137.5156.6-162.80000111.8
84T31.2Very low34.8Very low124 Ų124148.6 Ų148.676%0.76178%0.78SS**  trans-109.1137.2-175.7-55.10000109.7
85K36.1Very low34.9Very low187 Ų187150.8 Ų150.881%0.81379%0.788SS**  trans170.7124.8145.5-93155-175.3-171.60107.8
86Q31.4Very low34.5Very low159 Ų159149.1 Ų149.174%0.74378%0.779SS**  cis100.8130.545.1-169.2-171.814.200111.1
87M34.1Very low34.3Very low175 Ų175151 Ų15186%0.86278%0.783SS**  trans92.8101.6172.3-56-148164.500120.1
88D27.7Very low34.1Very low153 Ų153148.4 Ų148.482%0.81878%0.778SS**  trans-60.8-174144.7-114.2-31.5000112.5
89P39.8Very low34Very low103 Ų103145.2 Ų145.267%0.66977%0.771SS**  cis-138.3-153.6-12.632.8-8.6000113.8
90C33Very low33.9Very low116 Ų116145 Ų14578%0.78478%0.775SS**  trans85.4146.1163.5-73.30000117.4
91V34.8Very low34.1Very low113 Ų113146.4 Ų146.469%0.68578%0.778SS**  cis-161.8142.617.2110.20000112.1
92Y34.8Very low34.2Very low199 Ų199144.9 Ų144.978%0.7877%0.773SS**  trans63.5122.7152.9-73.7-116.4000122
93M34.2Very low34.3Very low173 Ų173138.5 Ų138.585%0.85277%0.768SS**  66.5142.895.4-72.9-163149.100115.7
94S33.7Very low34.5Very low118 Ų118137.8 Ų137.883%0.82576%0.763SS**  cis-149.5178.332.3-170.70000113.5
95S36.1Very low34.8Very low96 Ų96138 Ų13867%0.67177%0.765SS**  trans-138.3144.5-171.560.80000115.4
96N31.5Very low34.8Very low147 Ų147135.2 Ų135.279%0.78676%0.763SS**  trans71.6160.1144-85.2-2.2000122.9
97M34.5Very low35Very low145 Ų145135.2 Ų135.271%0.71477%0.767SS**  trans76.4107.5172.3-57.9-81.1102.800114.6
98Q33.3Very low35.2Very low156 Ų156134 Ų13473%0.72977%0.77SS**  cis89.213845.5-167.2-171.613.600112.6
99T32.7Very low35.5Very low114 Ų114131.3 Ų131.370%0.69976%0.763SS**  trans120.8104.5147-46.40000116.4
100V33.6Very low35.4Very low128 Ų128132.9 Ų132.978%0.77677%0.766SS**  trans68.9127.9140.4174.90000120.6
101E40.5Very low35.7Very low166 Ų166133.9 Ų133.978%0.77676%0.763SS**  -164.8141.3116-103.4-168.4-174.100113.8
102N38.9Very low35.7Very low138 Ų138133.1 Ų133.174%0.73876%0.763SS**  trans40.2112.2146.6-52.6-35.2000118.9
103G36.7Very low35.9Very low79 Ų79134.9 Ų134.981%0.81477%0.768SS**  120.9173.165.100000109.5
104S36.4Very low36.1Very low104 Ų104133.2 Ų133.273%0.72777%0.768SS**  cis-165.3164.1-20.469.10000109.7
105T37.8Very low36.5Very low130 Ų130131.5 Ų131.580%0.79877%0.769SS**  trans60123.417562.80000117.3
106V36.2Very low36.4Very low128 Ų128132 Ų13278%0.77677%0.772SS**  cis85.5102.138.2-175.90000115
107L34.8Very low37Very low158 Ų158132.9 Ų132.983%0.82778%0.775SS**  trans51.9121.5151.4-65.5167.2000121.1
108T37.8Very low37.3Very low151 Ų151130.5 Ų130.593%0.92677%0.773SS**  -160.1152.3123.96.30000112.5
109S34.7Very low37.2Very low96 Ų96126.1 Ų126.167%0.67177%0.77SS**  trans-90147.7-179.2173.90000111.7
110N38.4Very low37.5Very low136 Ų136131.5 Ų131.573%0.72778%0.779SS**  169146.4118.4-83.3-19.8000115.7
111N37.5Very low37.5Very low136 Ų136132.5 Ų132.573%0.72778%0.775SS**  trans59.4101.2145-72.9-10.4000122.4
112S35.2Very low37.5Very low98 Ų98130.4 Ų130.469%0.68578%0.776SS**  44.6117.5116.668.80000120.5
113R39.6Very low37.6Very low235 Ų235127.8 Ų127.889%0.88777%0.769SS**  -177.4137.2115.5-104.1169.5177-168.9-1.4114.2
114T38.9Very low37.9Very low138 Ų138132.1 Ų132.185%0.84777%0.772SS**  trans65.5118.2141.9-45.80000120.3
115G40.6Very low38.1Very low82 Ų82135.2 Ų135.285%0.84578%0.78SS**  trans177.287.4167.600000112.7
116S35.3Very low38.3Very low106 Ų106137.2 Ų137.274%0.74179%0.785SS**  trans-95.8157.7-176.146.20000113.5
117I43.9Very low38.5Very low166 Ų166135.3 Ų135.385%0.85178%0.782SS**  trans178.1133.4135.9-91.7152.2000112
118S40.3Very low38.8Very low95 Ų95137.5 Ų137.566%0.66479%0.785SS**  trans12.3137.4154.6-138.70000120.6
119G31.4Very low38.8Very low64 Ų64135.7 Ų135.766%0.6678%0.779SS**  89.6122.353.800000109.5
120Y38.4Very low39.1Very low227 Ų227135 Ų13589%0.8978%0.778SS**  -156.1159.359.9-79-91.3000113.5
121Q34.4Very low39.1Very low150 Ų150138.3 Ų138.370%0.70179%0.789SS**  trans-127.7148.1161.9-171.8-136.21700108.5S123Q121-S123 PolarHBondContact NE2-OG 3.36Å; Q121-S123 PolarHBondContact OE1-OG 2.98Å
122P40.6Very low39.1Very low122 Ų122135.1 Ų135.179%0.79279%0.789SS**  trans-123.6112.215733.6-20.7000111.5
123S40.5Very low39.4Very low83 Ų83136.8 Ų136.858%0.5880%0.795SS**  trans-114.5113.4160.553.30000109.3Q121Q121-S123 PolarHBondContact NE2-OG 3.36Å; Q121-S123 PolarHBondContact OE1-OG 2.98Å
124L42.7Very low39.2Very low169 Ų169137.7 Ų137.789%0.88580%0.798SS**  trans-95.393.9175.1-93.1160.1000110
125L41.3Very low39.1Very low170 Ų170136 Ų13689%0.8979%0.792SS**  trans-85.3121.3152.1-80166.9000107.4
126L42.9Very low39.3Very low172 Ų172140.3 Ų140.390%0.90180%0.795SS**  trans-128.7139.3163.7-170.863.8000108.7
127A40.1Very low39.2Very low87 Ų87146.4 Ų146.472%0.71980%0.804SS**  trans-126.4157.2-158.600000113.4
128K39.4Very low38.9Very low204 Ų204142.4 Ų142.489%0.88780%0.795SS**  trans71.690139.2-157.8179.3-173.6-177.80119.4
129S38.6Very low38.8Very low114 Ų114143.9 Ų143.980%0.79780%0.803SS**  -152.2127.1128.248.60000106.8
130A40.2Very low39.3Very low81 Ų81145.8 Ų145.867%0.66981%0.806SS**  cis76.5113.748.900000112.9
131Q39.8Very low39.3Very low205 Ų205143 Ų14396%0.95880%0.8SS**  trans70.7150.7176-62.2163.8-39.700117.3
132G37.7Very low39.4Very low69 Ų69145.5 Ų145.571%0.71181%0.809SS**  trans111.157.6157.900000118.7
133T41.5Very low39.2Very low134 Ų134151.2 Ų151.282%0.82282%0.815SS**  trans23.8110.813952.90000120.2
134R34.6Very low39Very low253 Ų253155.1 Ų155.196%0.95583%0.826SS**  55.678.2124.1-155.8-173.7-153.6-1707.2117.3
135S37.7Very low38.8Very low103 Ų103151.2 Ų151.272%0.7281%0.813SS**  trans-134.4132.6148.969.20000111.4
136L43.1Very low38.7Very low172 Ų172155.6 Ų155.690%0.90182%0.818SS**  trans-86.9112.6176.7-74.4159.3000108.3A138L136-A138 PolarHBondContact O-N 3.02Å
137Y34.3Very low38.4Very low235 Ų235151.6 Ų151.692%0.92280%0.804SS**  trans47.965.3165.1-91.2-94.9000116.3
138A36.8Very low38.7Very low81 Ų81154.4 Ų154.467%0.66981%0.806SS**  trans-75.9136.916300000111.1L136L136-A138 PolarHBondContact O-N 3.02Å
139P39.7Very low38.7Very low127 Ų127155 Ų15583%0.82581%0.809SS**  trans-94.6134.2-174.335-32.9000112.8
140S42.2Very low38.7Very low104 Ų104153.3 Ų153.373%0.72780%0.802SS**  trans-155.7141.617179.20000115.5
141H36.6Very low38.6Very low168 Ų168153.2 Ų153.278%0.77880%0.796SS**  trans49.280.8159.5-57.7-72.6000121
142F38.3Very low38.7Very low203 Ų203153.8 Ų153.889%0.8980%0.796SS**  -142.693129.5-93.9-69.8000111.6
143R34.9Very low38.7Very low242 Ų242155 Ų15591%0.91380%0.799SS**  trans-80.2141156.4-147.9178.5-174-159.63.3105.2
144M36.1Very low38.5Very low164 Ų164152.7 Ų152.781%0.80879%0.788SS**  trans70.9130.6-148.4-83.976.2154.700111.6
145S38.9Very low38.7Very low87 Ų87148.6 Ų148.661%0.60878%0.784SS**  cis-145.5121.219.5-62.40000113.7S147S145-S147 PolarHBondContact O-N 3.44Å
146R38.7Very low38.8Very low263 Ų263148.7 Ų148.799%0.99278%0.78SS**SBendtrans-80.679.1163.7-82.3-176.5168.2-176.9-2.1110.7
147S37.9Very low38.7Very low88 Ų88146.3 Ų146.362%0.61577%0.773SS**  trans-173.832.9171.151.90000118.4S145S145-S147 PolarHBondContact O-N 3.44Å
148L46.3Very low38.9Very low146 Ų146145 Ų14576%0.76477%0.768SS**  trans-121.345.7-176-66.8176.3000115.7
149K39.2Very low39.2Very low216 Ų216151.5 Ų151.594%0.93978%0.781SS**SBendtrans-122.816.5173.6-139.3172-175.6177.60115
150A38.7Very low39.2Very low79 Ų79149.2 Ų149.265%0.65377%0.768SS**SBendtrans-134.5-11178.400000114.9K152 A153A150-K152 PolarHBondContact O-N 3.5Å; A150-A153 PolarHBondContact O-N 3.09Å
151S38.5Very low39.1Very low79 Ų79148.2 Ų148.255%0.55278%0.775SS**THydrogen-bonded Turntrans-81.138.6-164.6-430000116.1
152K40.9Very low39.3Very low217 Ų217151.4 Ų151.494%0.94378%0.78SS**THydrogen-bonded Turntrans-118.815.6160.5-78.3-159.8173.3-172.20113.2A150A150-K152 PolarHBondContact O-N 3.5Å
153A37.6Very low40Very low95 Ų95145.8 Ų145.879%0.78576%0.762SS**SBendtrans-108.347.6173.800000112.1A150A150-A153 PolarHBondContact O-N 3.09Å
154S36.5Very low40.8Very low84 Ų84138.9 Ų138.959%0.58775%0.747SS**  trans-15754.1179.668.90000114.8V156S154-V156 PolarHBondContact O-N 3.28Å
155L39.4Very low41.4Very low167 Ų167137.1 Ų137.187%0.87474%0.739SS**  trans-83.880.1148.2-167.369.3000107.5T157L155-T157 PolarHBondContact O-N 3.25Å
156V40.9Very low41.8Very low105 Ų105140.3 Ų140.364%0.63675%0.745SS**  trans-72.493.2176.1173.40000108.1S154 Y158S154-V156 PolarHBondContact O-N 3.28Å; V156-Y158 HydrophobicContact CG1-CD2 4.3Å; V156-Y158 PolarHBondContact O-N 2.86Å
157T41.2Very low42.3Very low122 Ų122130.7 Ų130.775%0.74872%0.721SS**  trans-75.1106.6162.5-50.20000107.8L155 K159L155-T157 PolarHBondContact O-N 3.25Å; T157-K159 PolarHBondContact O-N 3.25Å; T157-K159 VanDerWaalsContact O-N 3.13Å
158Y36.7Very low42.7Very low209 Ų209131.3 Ų131.382%0.8272%0.715SS**THydrogen-bonded Turntrans-51.4111.8179.5-84.9-120.9000112.1V156V156-Y158 HydrophobicContact CG1-CD2 4.3Å; V156-Y158 PolarHBondContact O-N 2.86Å
159K43.6Very low42.9Very low216 Ų216131 Ų13194%0.93971%0.709SS**THydrogen-bonded Turntrans170-16.2135.8-99.5-179174.3-176.30116.4T157T157-K159 PolarHBondContact O-N 3.25Å; T157-K159 VanDerWaalsContact O-N 3.13Å
160S39.7Very low43.5Very low79 Ų79126.3 Ų126.355%0.55269%0.69SS**  trans-142.189.4-176.8-167.80000113.7R162S160-R162 PolarHBondContact O-N 3.21Å; S160-R162 VanDerWaalsContact O-N 3.13Å
161G40.4Very low44Very low84 Ų84126.4 Ų126.487%0.86668%0.68SS**THydrogen-bonded Turntrans-79.725.1-176.200000116.2
162R41.1Very low44.8Very low235 Ų235129.2 Ų129.289%0.88768%0.678SS**THydrogen-bonded Turntrans-120.5-7.2-176.2-89.6-174.5166128-1.9116S160S160-R162 PolarHBondContact O-N 3.21Å; S160-R162 VanDerWaalsContact O-N 3.13Å
163T52.7Low45.3Very low85 Ų85124.7 Ų124.752%0.52166%0.658SS.*SBendtrans-107.6-16.8-17053.40000115.4A167T163-A167 WeakPolarHBondContact O-CB 3.41Å; T163-A167 PolarHBondContact O-N 3.13Å
164T52.6Low45.9Very low96 Ų96121.7 Ų121.759%0.58963%0.63SS**Hα-helixtrans-74.5-40.5-167.751.10000114.3A167 E168T164-A167 PolarHBondContact O-N 2.68Å; T164-E168 PolarHBondContact O-N 3.17Å; T164-E168 VanDerWaalsContact O-N 3.13Å
165I47.5Very low46.6Very low127 Ų127122 Ų12265%0.65162%0.623SS**Hα-helixtrans-72-35.3-177.2-57.6174.5000111.2E168 H169I165-E168 PolarHBondContact O-N 3.24Å; I165-H169 PolarHBondContact O-N 2.98Å; I165-H169 VanDerWaalsContact O-N 3.16Å
166Q48.1Very low47.3Very low155 Ų155122.6 Ų122.672%0.72461%0.613SS**Hα-helixtrans-74.1-33.7178.4-148.8170.75.500111.5H169 H170Q166-H169 PolarHBondContact O-N 3.22Å; Q166-H170 PolarHBondContact O-N 3.23Å
167A48Very low47.8Very low60 Ų60122.7 Ų122.750%0.49661%0.607SS.*Hα-helixtrans-63.5-43.6170.900000112.3T163 T164 H169 H170 D171T163-A167 WeakPolarHBondContact O-CB 3.41Å; T163-A167 PolarHBondContact O-N 3.13Å; T164-A167 PolarHBondContact O-N 2.68Å; A167-H169 VanDerWaalsContact C-N 3.35Å; A167-H169 PolarHBondContact O-N 3.47Å; A167-H170 PolarHBondContact O-N 3.13Å; A167-D171 WeakPolarHBondContact O-CB 3.47Å; A167-D171 PolarHBondContact O-N 3.23Å
168E46.4Very low48.3Very low102 Ų102118.2 Ų118.248%0.47758%0.578SS.*Hα-helixtrans-64.2-38.8177.3-159.1-165.3146.700112.2T164 I165 H170 D171 R172T164-E168 PolarHBondContact O-N 3.17Å; T164-E168 VanDerWaalsContact O-N 3.13Å; I165-E168 PolarHBondContact O-N 3.24Å; E168-H170 VanDerWaalsContact C-N 3.33Å; E168-H170 PolarHBondContact O-N 2.67Å; E168-D171 PolarHBondContact O-N 3.35Å; E168-R172 WeakPolarHBondContact O-CG 3.49Å; E168-R172 PolarHBondContact O-N 3.44Å; E168-R172 IonicContact OE1-CZ 3.43Å; E168-R172 IonicContact OE1-NE 3.38Å; E168-R172 PolarHBondContact OE1-NE 3.38Å; E168-R172 IonicContact OE1-NH2 2.67Å; E168-R172 PolarHBondContact OE1-NH2 2.92Å
169H50.3Low48.8Very low140 Ų140113 Ų11365%0.64856%0.564SS**Hα-helixtrans-66.9-32.9174.6-108.6-79.5000113.2I165 Q166 A167I165-H169 PolarHBondContact O-N 2.98Å; I165-H169 VanDerWaalsContact O-N 3.16Å; Q166-H169 PolarHBondContact O-N 3.22Å; A167-H169 VanDerWaalsContact C-N 3.35Å; A167-H169 PolarHBondContact O-N 3.47Å
170H52.7Low48.8Very low116 Ų116104.9 Ų104.954%0.53753%0.534SS..Hα-helixtrans-73.1-41.2175.8-134.4-74000111.8Q166 A167 E168 R172 K173 V174Q166-H170 PolarHBondContact O-N 3.23Å; A167-H170 PolarHBondContact O-N 3.13Å; E168-H170 VanDerWaalsContact C-N 3.33Å; E168-H170 PolarHBondContact O-N 2.67Å; H170-R172 PolarHBondContact O-N 2.8Å; H170-K173 WeakPolarHBondContact O-CB 3.25Å; H170-K173 PolarHBondContact O-N 3.35Å; H170-V174 WeakPolarHBondContact O-CG2 3.36Å; H170-V174 PolarHBondContact O-N 3.4Å
171D50.1Low49.3Very low82 Ų82106.5 Ų106.544%0.43954%0.541SS..Hα-helixtrans-59.1-46.1177.4-176.134.1000111.6A167 E168 K173 V174 Q175A167-D171 WeakPolarHBondContact O-CB 3.47Å; A167-D171 PolarHBondContact O-N 3.23Å; E168-D171 PolarHBondContact O-N 3.35Å; D171-K173 PolarHBondContact O-N 3.07Å; D171-K173 VanDerWaalsContact O-N 3.15Å; D171-V174 PolarHBondContact O-N 2.86Å; D171-Q175 WeakPolarHBondContact O-CB 3.31Å; D171-Q175 VanDerWaalsContact O-CG 3.23Å; D171-Q175 WeakPolarHBondContact O-CG 3.23Å; D171-Q175 PolarHBondContact O-N 3.19Å; D171-Q175 PolarHBondContact OD1-NE2 3.42Å; D171-Q175 PolarHBondContact OD2-NE2 2.95Å
172R54.1Low49.7Very low138 Ų138110.4 Ų110.452%0.52153%0.534SS..Hα-helixtrans-64.8-18.4175.2-65.4-175.7-169.2-153.38.6114.7E168 H170 R176E168-R172 WeakPolarHBondContact O-CG 3.49Å; E168-R172 PolarHBondContact O-N 3.44Å; E168-R172 IonicContact OE1-CZ 3.43Å; E168-R172 IonicContact OE1-NE 3.38Å; E168-R172 PolarHBondContact OE1-NE 3.38Å; E168-R172 IonicContact OE1-NH2 2.67Å; E168-R172 PolarHBondContact OE1-NH2 2.92Å; H170-R172 PolarHBondContact O-N 2.8Å; R172-R176 PolarHBondContact O-NE 2.85Å; R172-R176 VanDerWaalsContact O-NE 3.07Å
173K51Low49.9Very low121 Ų121105.1 Ų105.153%0.52652%0.518SS..Hα-helixtrans-87.7-46.2176.5-161.8179179.4-172.50110.3H170 D171 Q175 R176 E177H170-K173 WeakPolarHBondContact O-CB 3.25Å; H170-K173 PolarHBondContact O-N 3.35Å; D171-K173 PolarHBondContact O-N 3.07Å; D171-K173 VanDerWaalsContact O-N 3.15Å; K173-Q175 VanDerWaalsContact C-N 3.33Å; K173-Q175 PolarHBondContact O-N 3.13Å; K173-R176 WeakPolarHBondContact O-CB 3.33Å; K173-R176 PolarHBondContact O-N 3.12Å; K173-E177 PolarHBondContact O-N 3.17Å
174V51.6Low50.1Low32 Ų32103.2 Ų103.219%0.19452%0.515CS..Hα-helixtrans-59.4-41.8172.4172.40000111.1H170 D171 R176 E177 I178H170-V174 WeakPolarHBondContact O-CG2 3.36Å; H170-V174 PolarHBondContact O-N 3.4Å; D171-V174 PolarHBondContact O-N 2.86Å; V174-R176 VanDerWaalsContact C-N 3.28Å; V174-R176 PolarHBondContact O-N 2.84Å; V174-E177 PolarHBondContact O-N 3.29Å; V174-I178 HydrophobicContact CG1-CD1 3.54Å; V174-I178 HydrophobicContact CG1-CG1 4.24Å; V174-I178 WeakPolarHBondContact O-CB 3.45Å; V174-I178 VanDerWaalsContact O-CG1 3.29Å; V174-I178 WeakPolarHBondContact O-CG1 3.5Å; V174-I178 PolarHBondContact O-N 3.32Å
175Q51.4Low50.2Low92 Ų92104.9 Ų104.943%0.4351%0.511SS..Hα-helixtrans-63.9-27.9174.3-73.5172.616.700113.9D171 K173 N179D171-Q175 WeakPolarHBondContact O-CB 3.31Å; D171-Q175 VanDerWaalsContact O-CG 3.23Å; D171-Q175 WeakPolarHBondContact O-CG 3.23Å; D171-Q175 PolarHBondContact O-N 3.19Å; D171-Q175 PolarHBondContact OD1-NE2 3.42Å; D171-Q175 PolarHBondContact OD2-NE2 2.95Å; K173-Q175 VanDerWaalsContact C-N 3.33Å; K173-Q175 PolarHBondContact O-N 3.13Å; Q175-N179 VanDerWaalsContact O-CB 3.26Å; Q175-N179 WeakPolarHBondContact O-CB 3.42Å; Q175-N179 PolarHBondContact O-N 2.93Å; Q175-N179 VanDerWaalsContact O-N 3.14Å; Q175-N179 PolarHBondContact O-ND2 3.2Å
176R53.1Low50.7Low178 Ų17899.3 Ų99.367%0.67248%0.484SS*.Hα-helixtrans-77.7-38.8172.9-85-178.2-99.9176.7-12.7112R172 K173 V174 N179 S180R172-R176 PolarHBondContact O-NE 2.85Å; R172-R176 VanDerWaalsContact O-NE 3.07Å; K173-R176 WeakPolarHBondContact O-CB 3.33Å; K173-R176 PolarHBondContact O-N 3.12Å; V174-R176 VanDerWaalsContact C-N 3.28Å; V174-R176 PolarHBondContact O-N 2.84Å; R176-N179 PolarHBondContact O-N 3.47Å; R176-S180 PolarHBondContact O-N 3.46Å; R176-S180 VanDerWaalsContact O-N 3.08Å
177E51.4Low51.6Low107 Ų10797.4 Ų97.450%0.547%0.473SS..Hα-helixtrans-69.8-40.1177.6-72.2171-165.900111.7K173 V174 S180K173-E177 PolarHBondContact O-N 3.17Å; V174-E177 PolarHBondContact O-N 3.29Å; E177-S180 WeakPolarHBondContact O-CB 3.5Å; E177-S180 PolarHBondContact O-N 2.82Å; E177-S180 VanDerWaalsContact O-N 3.16Å; E177-S180 PolarHBondContact O-OG 3.48Å
178I50.9Low53Low29 Ų29102 Ų10215%0.14948%0.482CS..Hα-helixtrans-69.8-31.7173.1-63.9171.5000111.9V174 S180 I263 Y265 V275V174-I178 HydrophobicContact CG1-CD1 3.54Å; V174-I178 HydrophobicContact CG1-CG1 4.24Å; V174-I178 WeakPolarHBondContact O-CB 3.45Å; V174-I178 VanDerWaalsContact O-CG1 3.29Å; V174-I178 WeakPolarHBondContact O-CG1 3.5Å; V174-I178 PolarHBondContact O-N 3.32Å; I178-S180 VanDerWaalsContact C-N 3.27Å; I178-S180 PolarHBondContact O-N 3.15Å; I178-I263 HydrophobicContact CG2-CD1 4.42Å; I178-Y265 HydrophobicContact CD1-CE1 4.17Å; I178-V275 HydrophobicContact CD1-CG2 4.22Å; I178-V275 HydrophobicContact CG1-CG2 4.45Å
179N47.3Very low54.3Low98 Ų9899.3 Ų99.352%0.52447%0.47SS..Hα-helixtrans-73.2-17.5171-95-54.5000113.8Q175 R176 V181 R260Q175-N179 VanDerWaalsContact O-CB 3.26Å; Q175-N179 WeakPolarHBondContact O-CB 3.42Å; Q175-N179 PolarHBondContact O-N 2.93Å; Q175-N179 VanDerWaalsContact O-N 3.14Å; Q175-N179 PolarHBondContact O-ND2 3.2Å; R176-N179 PolarHBondContact O-N 3.47Å; N179-V181 PolarHBondContact O-N 3.16Å; N179-R260 PolarHBondContact O-NH2 3.38Å; N179-R260 PolarHBondContact OD1-NH1 2.68Å
180S43.5Very low55.7Low46 Ų4697.7 Ų97.732%0.32246%0.459SS..SBendtrans-66.3132.3178.282.20000110.5R176 E177 I178 K182R176-S180 PolarHBondContact O-N 3.46Å; R176-S180 VanDerWaalsContact O-N 3.08Å; E177-S180 WeakPolarHBondContact O-CB 3.5Å; E177-S180 PolarHBondContact O-N 2.82Å; E177-S180 VanDerWaalsContact O-N 3.16Å; E177-S180 PolarHBondContact O-OG 3.48Å; I178-S180 VanDerWaalsContact C-N 3.27Å; I178-S180 PolarHBondContact O-N 3.15Å; S180-K182 PolarHBondContact O-N 3.2Å
181V50.5Low57.1Low113 Ų113100.2 Ų100.269%0.68546%0.464SS*.THydrogen-bonded Turntrans-77.861.4-176.5-1710000109.8N179N179-V181 PolarHBondContact O-N 3.16Å
182K48.8Very low58.7Low166 Ų166100.2 Ų100.272%0.72246%0.463SS*.THydrogen-bonded Turntrans-137.5-3.2-172.8-71.1-170.2176.9179.90115.3S180S180-K182 PolarHBondContact O-N 3.2Å
183F45.1Very low60.2Low124 Ų12493.7 Ų93.754%0.54444%0.439SS..SBendtrans-95.6143.8168.5-77.8-85.4000111.1
184G58.1Low62Low46 Ų4689.9 Ų89.947%0.47443%0.426SS..SBendtrans93-178.9163.500000117.6A186 K187G184-A186 VanDerWaalsContact C-N 3.27Å; G184-A186 PolarHBondContact O-N 3.05Å; G184-K187 PolarHBondContact O-N 3.49Å
185R55Low63.9Low131 Ų13189.8 Ų89.849%0.49443%0.432SS..THydrogen-bonded Turntrans-74.2-24-173-155.1169.5179.8137-3110.7K187 K188 E259R185-K187 PolarHBondContact O-N 3.49Å; R185-K187 VanDerWaalsContact O-N 3.17Å; R185-K188 PolarHBondContact O-N 3.45Å; R185-E259 WeakPolarHBondContact CB-OE1 3.28Å; R185-E259 PolarHBondContact N-OE1 3.48Å; R185-E259 VanDerWaalsContact N-OE1 3.08Å
186A58.2Low65.7Low10 Ų1088.1 Ų88.18%0.08342%0.423CS..Hα-helixtrans-53.6-29.3173.900000114.3G184 K188 L189 Y190 L255G184-A186 VanDerWaalsContact C-N 3.27Å; G184-A186 PolarHBondContact O-N 3.05Å; A186-K188 PolarHBondContact O-N 3.45Å; A186-L189 PolarHBondContact O-N 2.92Å; A186-Y190 PolarHBondContact O-N 2.91Å; A186-L255 HydrophobicContact CB-CD2 4.49Å
187K67.1Low67.5Low114 Ų11482.5 Ų82.550%0.49640%0.402SS..Hα-helixtrans-57.9-35.6175.5-176.1179.4176-170.30112.3G184 R185 W191G184-K187 PolarHBondContact O-N 3.49Å; R185-K187 PolarHBondContact O-N 3.49Å; R185-K187 VanDerWaalsContact O-N 3.17Å; K187-W191 PolarHBondContact O-N 3.1Å; K187-W191 VanDerWaalsContact O-N 3.1Å
188K75.5Confident69.5Low158 Ų15881.9 Ų81.969%0.68740%0.401SS*.Hα-helixtrans-67.6-44.1177.8-66.3-170.8177.1-172.90111.5R185 A186 W191 I192R185-K188 PolarHBondContact O-N 3.45Å; A186-K188 PolarHBondContact O-N 3.45Å; K188-W191 PolarHBondContact O-N 3Å; K188-I192 VanDerWaalsContact O-CG1 3.32Å; K188-I192 WeakPolarHBondContact O-CG1 3.32Å; K188-I192 PolarHBondContact O-N 3.41Å
189L73.9Confident71.4Confident44 Ų4484.9 Ų84.923%0.2342%0.416CS..Hα-helixtrans-63.3-40176.5-76.6149.9000112A186 I192 A193 F248 A252 L255A186-L189 PolarHBondContact O-N 2.92Å; L189-I192 PolarHBondContact O-N 3.44Å; L189-A193 PolarHBondContact O-N 3.07Å; L189-F248 HydrophobicContact CD2-CD1 4.37Å; L189-A252 HydrophobicContact CB-CB 3.87Å; L189-L255 HydrophobicContact CD1-CD2 3.37Å
190Y79.6Confident73.5Confident107 Ų10781.5 Ų81.542%0.4240%0.397SS..Hα-helixtrans-61.5-44.5173.6-174-90.3000112.2A186 I192 A193 V194 Y249A186-Y190 PolarHBondContact O-N 2.91Å; Y190-I192 VanDerWaalsContact C-N 3.33Å; Y190-I192 PolarHBondContact O-N 3.23Å; Y190-A193 PolarHBondContact O-N 2.79Å; Y190-V194 HydrophobicContact CD1-CG2 3.94Å; Y190-V194 HydrophobicContact CE1-CG2 3.52Å; Y190-V194 WeakPolarHBondContact O-CG2 3.4Å; Y190-V194 PolarHBondContact O-N 3.01Å; Y190-Y249 HydrophobicContact CE2-CD2 4.43Å; Y190-Y249 AromaticContact CE2-CE2 3.95Å; Y190-Y249 HydrophobicContact CE2-CE2 3.95Å
191W83Confident75.8Confident168 Ų16884.4 Ų84.464%0.63641%0.408SS*.Hα-helixtrans-63.6-36175.4-90.895.4000113.1K187 K188 V194 G195K187-W191 PolarHBondContact O-N 3.1Å; K187-W191 VanDerWaalsContact O-N 3.1Å; K188-W191 PolarHBondContact O-N 3Å; W191-V194 PolarHBondContact O-N 3.09Å; W191-G195 PolarHBondContact O-N 3.31Å
192I84Confident77.9Confident82 Ų8283 Ų8342%0.42140%0.396SS..Hα-helixtrans-63.7-47.2172.8-68.9161.3000110.3K188 L189 Y190 V194 G195 F196 F248K188-I192 VanDerWaalsContact O-CG1 3.32Å; K188-I192 WeakPolarHBondContact O-CG1 3.32Å; K188-I192 PolarHBondContact O-N 3.41Å; L189-I192 PolarHBondContact O-N 3.44Å; Y190-I192 VanDerWaalsContact C-N 3.33Å; Y190-I192 PolarHBondContact O-N 3.23Å; I192-V194 PolarHBondContact O-N 3.39Å; I192-G195 WeakPolarHBondContact O-CA 3.31Å; I192-G195 PolarHBondContact O-N 3.05Å; I192-G195 VanDerWaalsContact O-N 3.1Å; I192-F196 HydrophobicContact CG2-CD2 3.84Å; I192-F196 HydrophobicContact CG2-CE2 3.72Å; I192-F196 VanDerWaalsContact O-CD2 3.32Å; I192-F196 WeakPolarHBondContact O-CD2 3.11Å; I192-F196 PolarHBondContact O-N 3.41Å; I192-F248 HydrophobicContact CG2-CG 4.45Å
193A85.6Confident79.9Confident1 Ų176.1 Ų76.11%0.00837%0.368CS..Hα-helixtrans-60-42.5176.200000112.2L189 Y190 G195 F196 Y197 F248L189-A193 PolarHBondContact O-N 3.07Å; Y190-A193 PolarHBondContact O-N 2.79Å; A193-G195 VanDerWaalsContact C-N 3.33Å; A193-G195 PolarHBondContact O-N 2.78Å; A193-F196 WeakPolarHBondContact O-CB 3.46Å; A193-F196 PolarHBondContact O-N 3.39Å; A193-Y197 WeakPolarHBondContact O-CD2 3.47Å; A193-Y197 PolarHBondContact O-N 3.4Å; A193-F248 HydrophobicContact CB-CB 3.97Å
194V88.7Confident82.2Confident41 Ų4172.2 Ų72.225%0.24835%0.353CS..Hα-helixtrans-59.3-43.4172.5170.20000111.2Y190 W191 I192 F196 Y197 I198Y190-V194 HydrophobicContact CD1-CG2 3.94Å; Y190-V194 HydrophobicContact CE1-CG2 3.52Å; Y190-V194 WeakPolarHBondContact O-CG2 3.4Å; Y190-V194 PolarHBondContact O-N 3.01Å; W191-V194 PolarHBondContact O-N 3.09Å; I192-V194 PolarHBondContact O-N 3.39Å; V194-F196 VanDerWaalsContact C-N 3.34Å; V194-F196 PolarHBondContact O-N 2.91Å; V194-Y197 PolarHBondContact O-N 2.85Å; V194-I198 HydrophobicContact CG1-CD1 3.86Å; V194-I198 HydrophobicContact CG1-CG1 4.45Å; V194-I198 WeakPolarHBondContact O-CG1 3.43Å; V194-I198 PolarHBondContact O-N 3.11Å
195G90.5Very high83.8Confident31 Ų3176.6 Ų76.632%0.3236%0.359SS..Hα-helixtrans-57.3-43.9173.100000112.8W191 I192 A193 Y197 I198 M199W191-G195 PolarHBondContact O-N 3.31Å; I192-G195 WeakPolarHBondContact O-CA 3.31Å; I192-G195 PolarHBondContact O-N 3.05Å; I192-G195 VanDerWaalsContact O-N 3.1Å; A193-G195 VanDerWaalsContact C-N 3.33Å; A193-G195 PolarHBondContact O-N 2.78Å; G195-Y197 PolarHBondContact O-N 2.87Å; G195-I198 PolarHBondContact O-N 3.04Å; G195-M199 WeakPolarHBondContact O-CG 3.26Å; G195-M199 PolarHBondContact O-N 2.87Å
196F90.3Very high85.5Confident57 Ų5773.7 Ų73.725%0.2535%0.352CS..Hα-helixtrans-61.5-40.4174.3-86.1-74000113.1I192 A193 V194 M199 F200 F241 A244 F248I192-F196 HydrophobicContact CG2-CD2 3.84Å; I192-F196 HydrophobicContact CG2-CE2 3.72Å; I192-F196 VanDerWaalsContact O-CD2 3.32Å; I192-F196 WeakPolarHBondContact O-CD2 3.11Å; I192-F196 PolarHBondContact O-N 3.41Å; A193-F196 WeakPolarHBondContact O-CB 3.46Å; A193-F196 PolarHBondContact O-N 3.39Å; V194-F196 VanDerWaalsContact C-N 3.34Å; V194-F196 PolarHBondContact O-N 2.91Å; F196-M199 PolarHBondContact O-N 2.82Å; F196-F200 WeakPolarHBondContact O-CB 3.47Å; F196-F200 PolarHBondContact O-N 3.14Å; F196-F241 AromaticContact CD1-CD1 3.86Å; F196-F241 HydrophobicContact CD1-CD1 3.86Å; F196-F241 AromaticContact CE1-CD1 3.95Å; F196-F241 HydrophobicContact CE1-CD1 3.95Å; F196-F241 HydrophobicContact CE1-CE1 4.38Å; F196-A244 HydrophobicContact CD1-CB 4.12Å; F196-A244 HydrophobicContact CE1-CB 4.12Å; F196-F248 AromaticContact CD2-CD2 3.61Å; F196-F248 HydrophobicContact CD2-CD2 3.61Å; F196-F248 AromaticContact CD2-CE2 3.93Å; F196-F248 HydrophobicContact CD2-CE2 3.93Å; F196-F248 AromaticContact CE2-CD2 3.5Å; F196-F248 HydrophobicContact CE2-CD2 3.5Å; F196-F248 VanDerWaalsContact CE2-CD2 3.5Å; F196-F248 AromaticContact CE2-CE2 3.29Å; F196-F248 HydrophobicContact CE2-CE2 3.29Å; F196-F248 HydrophobicContact CE2-CZ 4.18Å; F196-F248 HydrophobicContact CG-CD2 4.43Å; F196-F248 HydrophobicContact CZ-CD2 4.23Å; F196-F248 AromaticContact CZ-CE2 3.7Å; F196-F248 HydrophobicContact CZ-CE2 3.7Å
197Y90.9Very high86.9Confident59 Ų5973.2 Ų73.223%0.23135%0.349CS..Hα-helixtrans-68.9-35.2175.2-72.9-65.6000113.2A193 V194 G195 F200 L201 F242 M246A193-Y197 WeakPolarHBondContact O-CD2 3.47Å; A193-Y197 PolarHBondContact O-N 3.4Å; V194-Y197 PolarHBondContact O-N 2.85Å; G195-Y197 PolarHBondContact O-N 2.87Å; Y197-F200 PolarHBondContact O-N 3.48Å; Y197-L201 WeakPolarHBondContact O-CG 3.34Å; Y197-L201 PolarHBondContact O-N 3.32Å; Y197-F242 HydrophobicContact CD1-CD2 4.41Å; Y197-F242 AromaticContact CE1-CD2 3.97Å; Y197-F242 HydrophobicContact CE1-CD2 3.97Å; Y197-F242 AromaticContact CE1-CE2 3.97Å; Y197-F242 HydrophobicContact CE1-CE2 3.97Å; Y197-M246 PolarHBondContact OH-N 3.46Å; Y197-M246 PolarHBondContact OH-SD 3.2Å
198I92.4Very high87.9Confident95 Ų9572.3 Ų72.349%0.48735%0.348SS..Hα-helixtrans-65-44.9173.5-66.1166000110.1V194 G195 L201 L202V194-I198 HydrophobicContact CG1-CD1 3.86Å; V194-I198 HydrophobicContact CG1-CG1 4.45Å; V194-I198 WeakPolarHBondContact O-CG1 3.43Å; V194-I198 PolarHBondContact O-N 3.11Å; G195-I198 PolarHBondContact O-N 3.04Å; I198-L201 PolarHBondContact O-N 3.05Å; I198-L202 WeakPolarHBondContact O-CB 3.28Å; I198-L202 PolarHBondContact O-N 3.39Å
199M91Very high88.5Confident91 Ų9168.5 Ų68.545%0.44834%0.335SS..Hα-helixtrans-63.8-40.6175.4-70-63.912000112.1G195 F196 L202 V203G195-M199 WeakPolarHBondContact O-CG 3.26Å; G195-M199 PolarHBondContact O-N 2.87Å; F196-M199 PolarHBondContact O-N 2.82Å; M199-L202 PolarHBondContact O-N 2.82Å; M199-V203 WeakPolarHBondContact O-CB 3.29Å; M199-V203 VanDerWaalsContact O-CG2 3.29Å; M199-V203 WeakPolarHBondContact O-CG2 3.38Å; M199-V203 PolarHBondContact O-N 3.41Å
200F91.4Very high89Confident28 Ų2868.9 Ų68.912%0.12334%0.337CS..Hα-helixtrans-55.5-52.4172.5165.2-115.5000111.6F196 Y197 L202 V203 L204 S238 F241 F242F196-F200 WeakPolarHBondContact O-CB 3.47Å; F196-F200 PolarHBondContact O-N 3.14Å; Y197-F200 PolarHBondContact O-N 3.48Å; F200-L202 VanDerWaalsContact C-N 3.33Å; F200-L202 PolarHBondContact O-N 2.86Å; F200-V203 PolarHBondContact O-N 3.05Å; F200-L204 HydrophobicContact CE2-CB 4.46Å; F200-L204 HydrophobicContact CE2-CD1 4.39Å; F200-L204 HydrophobicContact CZ-CD2 4.12Å; F200-L204 WeakPolarHBondContact O-CB 3.39Å; F200-L204 PolarHBondContact O-N 2.91Å; F200-S238 WeakPolarHBondContact CD2-O 3.13Å; F200-S238 WeakPolarHBondContact CE2-OG 3.47Å; F200-F241 HydrophobicContact CB-CB 4.21Å; F200-F242 HydrophobicContact CD1-CD2 4.04Å; F200-F242 HydrophobicContact CD2-CB 3.93Å; F200-F242 AromaticContact CE1-CD2 3.83Å; F200-F242 HydrophobicContact CE1-CD2 3.83Å; F200-F242 HydrophobicContact CE2-CB 3.99Å; F200-F242 HydrophobicContact CG-CB 4.23Å; F200-F242 HydrophobicContact CG-CD2 4.47Å; F200-F242 HydrophobicContact CZ-CB 4.36Å; F200-F242 HydrophobicContact CZ-CD2 4.08Å; F200-F242 HydrophobicContact CZ-CG 4.48Å
201L93Very high89.2Confident107 Ų10766.7 Ų66.756%0.5634%0.335SS*.Hα-helixtrans-63-38.6179.6-70.8174.4000112.4Y197 I198 F205Y197-L201 WeakPolarHBondContact O-CG 3.34Å; Y197-L201 PolarHBondContact O-N 3.32Å; I198-L201 PolarHBondContact O-N 3.05Å; L201-F205 WeakPolarHBondContact O-CB 3.47Å; L201-F205 PolarHBondContact O-N 3Å
202L93.7Very high89.3Confident82 Ų8262.3 Ų62.343%0.42933%0.329SS..Hα-helixtrans-68-46.3178.6-175.1149.7000111.8I198 M199 F200 F205 I206I198-L202 WeakPolarHBondContact O-CB 3.28Å; I198-L202 PolarHBondContact O-N 3.39Å; M199-L202 PolarHBondContact O-N 2.82Å; F200-L202 VanDerWaalsContact C-N 3.33Å; F200-L202 PolarHBondContact O-N 2.86Å; L202-F205 PolarHBondContact O-N 3.43Å; L202-I206 HydrophobicContact CD2-CD1 3.57Å; L202-I206 HydrophobicContact CG-CD1 4.33Å; L202-I206 VanDerWaalsContact O-CG1 3.32Å; L202-I206 WeakPolarHBondContact O-CG1 3.23Å; L202-I206 PolarHBondContact O-N 3.47Å
203V92Very high89.1Confident23 Ų2362.1 Ų62.114%0.13933%0.328CS..Hα-helixtrans-67-41.1177.2173.60000111.1M199 F200 I206 G207 L234 F241M199-V203 WeakPolarHBondContact O-CB 3.29Å; M199-V203 VanDerWaalsContact O-CG2 3.29Å; M199-V203 WeakPolarHBondContact O-CG2 3.38Å; M199-V203 PolarHBondContact O-N 3.41Å; F200-V203 PolarHBondContact O-N 3.05Å; V203-I206 PolarHBondContact O-N 3.23Å; V203-G207 PolarHBondContact O-N 3.08Å; V203-L234 HydrophobicContact CG1-CB 4.44Å; V203-L234 HydrophobicContact CG1-CD2 4.21Å; V203-L234 WeakPolarHBondContact CG1-O 3.35Å; V203-F241 HydrophobicContact CG2-CD2 4.5Å; V203-F241 HydrophobicContact CG2-CE2 4.29Å
204L92.5Very high88.6Confident42 Ų4266.8 Ų66.822%0.2235%0.346CS..Hα-helixtrans-60.3-45.8173.6-174.879000111F200 G207 L208F200-L204 HydrophobicContact CE2-CB 4.46Å; F200-L204 HydrophobicContact CE2-CD1 4.39Å; F200-L204 HydrophobicContact CZ-CD2 4.12Å; F200-L204 WeakPolarHBondContact O-CB 3.39Å; F200-L204 PolarHBondContact O-N 2.91Å; L204-G207 PolarHBondContact O-N 3.46Å; L204-L208 HydrophobicContact CG-CD1 4.11Å; L204-L208 WeakPolarHBondContact O-CB 3.25Å; L204-L208 WeakPolarHBondContact O-CG 3.34Å; L204-L208 PolarHBondContact O-N 2.93Å
205F92.5Very high87.9Confident137 Ų13772 Ų7260%0.60137%0.367SS*.Hα-helixtrans-63.6-42.7178-177.5-99.6000111.9L201 L202 L208 L209L201-F205 WeakPolarHBondContact O-CB 3.47Å; L201-F205 PolarHBondContact O-N 3Å; L202-F205 PolarHBondContact O-N 3.43Å; F205-L208 PolarHBondContact O-N 3.36Å; F205-L209 HydrophobicContact CE1-CD2 4.41Å; F205-L209 WeakPolarHBondContact O-CB 3.49Å; F205-L209 PolarHBondContact O-N 3.05Å
206I90.3Very high87.2Confident71 Ų7175.5 Ų75.536%0.36438%0.382SS..Hα-helixtrans-65.7-43.2175.8-67.6171.7000111.1L202 V203 L209 I210 L234L202-I206 HydrophobicContact CD2-CD1 3.57Å; L202-I206 HydrophobicContact CG-CD1 4.33Å; L202-I206 VanDerWaalsContact O-CG1 3.32Å; L202-I206 WeakPolarHBondContact O-CG1 3.23Å; L202-I206 PolarHBondContact O-N 3.47Å; V203-I206 PolarHBondContact O-N 3.23Å; I206-L209 PolarHBondContact O-N 3.07Å; I206-I210 HydrophobicContact CG2-CD1 3.73Å; I206-I210 HydrophobicContact CG2-CG1 4.39Å; I206-I210 WeakPolarHBondContact O-CG1 3.38Å; I206-I210 PolarHBondContact O-N 3.28Å; I206-L234 HydrophobicContact CG2-CD1 4.15Å
207G87.6Confident86.1Confident0 Ų079 Ų790%039%0.394CS..Hα-helixtrans-61.8-43.5176.400000112.7V203 L204 T211V203-G207 PolarHBondContact O-N 3.08Å; L204-G207 PolarHBondContact O-N 3.46Å; G207-T211 WeakPolarHBondContact O-CB 3.32Å; G207-T211 PolarHBondContact O-N 3.19Å; G207-T211 PolarHBondContact O-OG1 2.91Å
208L88.4Confident84.5Confident94 Ų9483.1 Ų83.149%0.49242%0.417SS..Hα-helixtrans-65.7-40.2172.6-74.5172000112.2L204 F205 T211 C212L204-L208 HydrophobicContact CG-CD1 4.11Å; L204-L208 WeakPolarHBondContact O-CB 3.25Å; L204-L208 WeakPolarHBondContact O-CG 3.34Å; L204-L208 PolarHBondContact O-N 2.93Å; F205-L208 PolarHBondContact O-N 3.36Å; L208-T211 PolarHBondContact O-N 2.86Å; L208-C212 WeakPolarHBondContact O-CB 3.45Å; L208-C212 PolarHBondContact O-N 3.46Å
209L87.8Confident82.8Confident79 Ų7985.7 Ų85.741%0.41443%0.432SS..Hα-helixtrans-63.3-48178-178.266.6000110.7F205 I206 T211 C212 L213F205-L209 HydrophobicContact CE1-CD2 4.41Å; F205-L209 WeakPolarHBondContact O-CB 3.49Å; F205-L209 PolarHBondContact O-N 3.05Å; I206-L209 PolarHBondContact O-N 3.07Å; L209-T211 VanDerWaalsContact C-N 3.33Å; L209-T211 PolarHBondContact O-N 3.45Å; L209-C212 PolarHBondContact O-N 3.38Å; L209-L213 HydrophobicContact CD1-CD1 4.21Å; L209-L213 HydrophobicContact CD1-CG 4.24Å; L209-L213 HydrophobicContact CG-CD1 3.86Å; L209-L213 HydrophobicContact CG-CG 4.32Å; L209-L213 VanDerWaalsContact O-CB 3.28Å; L209-L213 WeakPolarHBondContact O-CB 3.16Å; L209-L213 WeakPolarHBondContact O-CG 3.25Å; L209-L213 PolarHBondContact O-N 3.44Å
210I84.4Confident81Confident52 Ų5286.2 Ų86.227%0.26744%0.436SS..Hα-helixtrans-60.6-43.7176-68.3164000110.7I206 R214 I230 L234I206-I210 HydrophobicContact CG2-CD1 3.73Å; I206-I210 HydrophobicContact CG2-CG1 4.39Å; I206-I210 WeakPolarHBondContact O-CG1 3.38Å; I206-I210 PolarHBondContact O-N 3.28Å; I210-R214 WeakPolarHBondContact O-CB 3.32Å; I210-R214 PolarHBondContact O-N 3.08Å; I210-I230 HydrophobicContact CG2-CG2 4.16Å; I210-L234 HydrophobicContact CD1-CD1 3.61Å
211T83.6Confident79.2Confident60 Ų6092.2 Ų92.237%0.36847%0.468SS..Hα-helixtrans-65.2-40.8178.7-540000111.8G207 L208 L209 R214 H215G207-T211 WeakPolarHBondContact O-CB 3.32Å; G207-T211 PolarHBondContact O-N 3.19Å; G207-T211 PolarHBondContact O-OG1 2.91Å; L208-T211 PolarHBondContact O-N 2.86Å; L209-T211 VanDerWaalsContact C-N 3.33Å; L209-T211 PolarHBondContact O-N 3.45Å; T211-R214 PolarHBondContact O-N 3.18Å; T211-H215 WeakPolarHBondContact O-CB 3.33Å; T211-H215 PolarHBondContact O-N 3.2Å
212C84.1Confident77.2Confident76 Ų7693.8 Ų93.851%0.51448%0.476SS..Hα-helixtrans-69.7-44.9177.7-1740000111.8L208 L209 R214 H215 V216L208-C212 WeakPolarHBondContact O-CB 3.45Å; L208-C212 PolarHBondContact O-N 3.46Å; L209-C212 PolarHBondContact O-N 3.38Å; C212-R214 VanDerWaalsContact C-N 3.32Å; C212-R214 PolarHBondContact O-N 3.07Å; C212-H215 PolarHBondContact O-N 3.25Å; C212-H215 VanDerWaalsContact O-N 3.16Å; C212-V216 WeakPolarHBondContact O-CG2 3.39Å; C212-V216 PolarHBondContact O-N 2.89Å
213L80.8Confident75Confident79 Ų7994.7 Ų94.741%0.41449%0.489SS..Hα-helixtrans-56.4-47.1172.2-71.8168.9000110L209 H215 V216 Y217L209-L213 HydrophobicContact CD1-CD1 4.21Å; L209-L213 HydrophobicContact CD1-CG 4.24Å; L209-L213 HydrophobicContact CG-CD1 3.86Å; L209-L213 HydrophobicContact CG-CG 4.32Å; L209-L213 VanDerWaalsContact O-CB 3.28Å; L209-L213 WeakPolarHBondContact O-CB 3.16Å; L209-L213 WeakPolarHBondContact O-CG 3.25Å; L209-L213 PolarHBondContact O-N 3.44Å; L213-H215 VanDerWaalsContact C-N 3.34Å; L213-H215 PolarHBondContact O-N 2.69Å; L213-V216 PolarHBondContact O-N 2.8Å; L213-Y217 HydrophobicContact CB-CD2 4.27Å; L213-Y217 HydrophobicContact CD2-CD2 4.03Å; L213-Y217 HydrophobicContact CD2-CE2 3.64Å; L213-Y217 WeakPolarHBondContact O-CA 3.48Å; L213-Y217 VanDerWaalsContact O-CB 3.25Å; L213-Y217 WeakPolarHBondContact O-CB 3.45Å; L213-Y217 VanDerWaalsContact O-CD2 3.24Å; L213-Y217 WeakPolarHBondContact O-CD2 3.11Å; L213-Y217 PolarHBondContact O-N 3.16Å
214R74.1Confident73.2Confident98 Ų9899.8 Ų99.837%0.3752%0.515SS..Hα-helixtrans-59.8-41.6175.8-171.7-179.5-176.9-147.1-0.8112.7I210 T211 C212 Y217 E228I210-R214 WeakPolarHBondContact O-CB 3.32Å; I210-R214 PolarHBondContact O-N 3.08Å; T211-R214 PolarHBondContact O-N 3.18Å; C212-R214 VanDerWaalsContact C-N 3.32Å; C212-R214 PolarHBondContact O-N 3.07Å; R214-Y217 CarbonylContact O-C 3.59Å; R214-E228 IonicContact CZ-OE1 3.29Å; R214-E228 VanDerWaalsContact CZ-OE1 3.29Å; R214-E228 IonicContact CZ-OE2 3.68Å; R214-E228 VanDerWaalsContact NH1-CD 3.27Å; R214-E228 IonicContact NH1-OE1 2.68Å; R214-E228 PolarHBondContact NH1-OE1 3.45Å; R214-E228 IonicContact NH1-OE2 3.81Å; R214-E228 IonicContact NH2-OE1 3.02Å; R214-E228 PolarHBondContact NH2-OE1 3.37Å; R214-E228 IonicContact NH2-OE2 2.75Å; R214-E228 PolarHBondContact NH2-OE2 2.91Å
215H75.3Confident71.7Confident152 Ų152104.2 Ų104.270%0.70454%0.539SS*.Hα-helixtrans-66.3-39.4178.6-174.8-71.9000112.7T211 C212 L213T211-H215 WeakPolarHBondContact O-CB 3.33Å; T211-H215 PolarHBondContact O-N 3.2Å; C212-H215 PolarHBondContact O-N 3.25Å; C212-H215 VanDerWaalsContact O-N 3.16Å; L213-H215 VanDerWaalsContact C-N 3.34Å; L213-H215 PolarHBondContact O-N 2.69Å
216V75.3Confident70.3Confident103 Ų103104.1 Ų104.162%0.62454%0.543SS*.Hα-helixtrans-75.7-42.7177.4174.80000111.2C212 L213 M218C212-V216 WeakPolarHBondContact O-CG2 3.39Å; C212-V216 PolarHBondContact O-N 2.89Å; L213-V216 PolarHBondContact O-N 2.8Å; V216-M218 VanDerWaalsContact C-N 3.31Å; V216-M218 PolarHBondContact O-N 3.49Å
217Y68Low69Low131 Ų131102.4 Ų102.451%0.51454%0.542SS..  trans-92.254-179.1-65.4-69.5000112.4L213 R214 N219 I220L213-Y217 HydrophobicContact CB-CD2 4.27Å; L213-Y217 HydrophobicContact CD2-CD2 4.03Å; L213-Y217 HydrophobicContact CD2-CE2 3.64Å; L213-Y217 WeakPolarHBondContact O-CA 3.48Å; L213-Y217 VanDerWaalsContact O-CB 3.25Å; L213-Y217 WeakPolarHBondContact O-CB 3.45Å; L213-Y217 VanDerWaalsContact O-CD2 3.24Å; L213-Y217 WeakPolarHBondContact O-CD2 3.11Å; L213-Y217 PolarHBondContact O-N 3.16Å; R214-Y217 CarbonylContact O-C 3.59Å; Y217-N219 PolarHBondContact O-N 3.17Å; Y217-I220 HydrophobicContact CD1-CD1 3.63Å; Y217-I220 HydrophobicContact CD1-CG1 4.22Å; Y217-I220 HydrophobicContact CD2-CD1 4.34Å; Y217-I220 HydrophobicContact CE1-CD1 4.31Å; Y217-I220 HydrophobicContact CG-CD1 3.65Å; Y217-I220 HydrophobicContact CG-CG1 4.33Å; Y217-I220 PolarHBondContact O-N 3.5Å
218M57.4Low68.3Low145 Ų145106.9 Ų106.971%0.71456%0.564SS**THydrogen-bonded Turntrans-64.937.5170.9-100.3-77.2164.600113.7V216V216-M218 VanDerWaalsContact C-N 3.31Å; V216-M218 PolarHBondContact O-N 3.49Å
219N56.5Low67.8Low149 Ų149108.1 Ų108.180%0.79757%0.57SS**THydrogen-bonded Turntrans-161.4-0.1-176.7-97.9-43.9000115.2Y217 I221Y217-N219 PolarHBondContact O-N 3.17Å; N219-I221 PolarHBondContact O-N 2.89Å
220I52.7Low67.6Low102 Ų102107.4 Ų107.452%0.52357%0.566SS.*  trans-84.6102.7178.1-63.5178.4000110.2Y217 L222Y217-I220 HydrophobicContact CD1-CD1 3.63Å; Y217-I220 HydrophobicContact CD1-CG1 4.22Å; Y217-I220 HydrophobicContact CD2-CD1 4.34Å; Y217-I220 HydrophobicContact CE1-CD1 4.31Å; Y217-I220 HydrophobicContact CG-CD1 3.65Å; Y217-I220 HydrophobicContact CG-CG1 4.33Å; Y217-I220 PolarHBondContact O-N 3.5Å; I220-L222 HydrophobicContact CG2-CB 4.07Å; I220-L222 HydrophobicContact CG2-CD1 3.89Å; I220-L222 HydrophobicContact CG2-CG 4.46Å; I220-L222 PolarHBondContact O-N 3.5Å
221I53.8Low67.6Low155 Ų155105 Ų10580%0.79555%0.554SS**  trans-7753.9179.6-53.2163.8000110.4N219N219-I221 PolarHBondContact O-N 2.89Å
222L49.7Very low67.7Low140 Ų140105.9 Ų105.973%0.73356%0.561SS**SBendtrans-110101.2170.4-96.573000110I220I220-L222 HydrophobicContact CG2-CB 4.07Å; I220-L222 HydrophobicContact CG2-CD1 3.89Å; I220-L222 HydrophobicContact CG2-CG 4.46Å; I220-L222 PolarHBondContact O-N 3.5Å
223S49.2Very low67.9Low100 Ų100106.7 Ų106.770%0.69956%0.56SS**  trans48.684.2164.6-59.50000116D225S223-D225 PolarHBondContact O-N 3.01Å
224L52.9Low68.4Low130 Ų130104.9 Ų104.968%0.68155%0.55SS*.Hα-helixtrans-61.5-31.2-160.9-128.1137000116.6
225D61Low69.1Low136 Ų136102.3 Ų102.373%0.72754%0.543SS*.Hα-helixtrans-84-37-169.7-66.7-45000115.1S223S223-D225 PolarHBondContact O-N 3.01Å
226I63.3Low69.9Low135 Ų13597.8 Ų97.869%0.69253%0.532SS*.Hα-helixtrans-75.6-37.1-170.7-56.5173.6000110.6I230I226-I230 WeakPolarHBondContact O-CB 3.45Å; I226-I230 WeakPolarHBondContact O-CG2 3.37Å; I226-I230 PolarHBondContact O-N 2.9Å
227G63.8Low70.6Confident34 Ų3495 Ų9535%0.35152%0.517SS..Hα-helixtrans-70.3-29.8178.900000114.3
228E71.6Confident71.7Confident95 Ų9588.8 Ų88.844%0.44449%0.492SS..Hα-helixtrans-62.6-50.9175.4176.2100.7-112.900111R214 P232R214-E228 IonicContact CZ-OE1 3.29Å; R214-E228 VanDerWaalsContact CZ-OE1 3.29Å; R214-E228 IonicContact CZ-OE2 3.68Å; R214-E228 VanDerWaalsContact NH1-CD 3.27Å; R214-E228 IonicContact NH1-OE1 2.68Å; R214-E228 PolarHBondContact NH1-OE1 3.45Å; R214-E228 IonicContact NH1-OE2 3.81Å; R214-E228 IonicContact NH2-OE1 3.02Å; R214-E228 PolarHBondContact NH2-OE1 3.37Å; R214-E228 IonicContact NH2-OE2 2.75Å; R214-E228 PolarHBondContact NH2-OE2 2.91Å; E228-P232 VanDerWaalsContact O-CD 3.22Å; E228-P232 WeakPolarHBondContact O-CD 3.43Å
229L79.1Confident73.3Confident119 Ų11987.7 Ų87.762%0.62348%0.484SS*.Hα-helixtrans-76.4-37.5-174.6-170.964.9000112.5G231 L233L229-G231 PolarHBondContact O-N 2.85Å; L229-L233 WeakPolarHBondContact O-CB 3.25Å; L229-L233 PolarHBondContact O-N 3.4Å
230I84.1Confident75Confident64 Ų6486.6 Ų86.633%0.32848%0.477SS..Hα-helixtrans-66.6-34.6-168.8-163.461.2000113.8I210 I226 L233 L234I210-I230 HydrophobicContact CG2-CG2 4.16Å; I226-I230 WeakPolarHBondContact O-CB 3.45Å; I226-I230 WeakPolarHBondContact O-CG2 3.37Å; I226-I230 PolarHBondContact O-N 2.9Å; I230-L233 HydrophobicContact CD1-CD2 4.33Å; I230-L233 PolarHBondContact O-N 3.45Å; I230-L234 HydrophobicContact CD1-CG 4.29Å; I230-L234 HydrophobicContact CG1-CD1 4Å; I230-L234 HydrophobicContact CG1-CG 4.25Å; I230-L234 WeakPolarHBondContact O-CB 3.14Å; I230-L234 VanDerWaalsContact O-CG 3.24Å; I230-L234 WeakPolarHBondContact O-CG 3.5Å; I230-L234 PolarHBondContact O-N 2.9Å
231G82.6Confident76.7Confident2 Ų285 Ų852%0.02147%0.467CS..Hα-helixtrans-62-61.3179.500000112.4L229 L233 L234 I235L229-G231 PolarHBondContact O-N 2.85Å; G231-L233 VanDerWaalsContact C-N 3.3Å; G231-L233 PolarHBondContact O-N 3.18Å; G231-L234 PolarHBondContact O-N 2.84Å; G231-I235 WeakPolarHBondContact O-CG1 3.37Å; G231-I235 PolarHBondContact O-N 3.26Å; G231-I235 VanDerWaalsContact O-N 3.12Å
232P86.3Confident78.5Confident79 Ų7981.5 Ų81.551%0.51345%0.446SS..Hα-helixtrans-58.8-37173.6-25.235.5000113.3E228 I235 A236E228-P232 VanDerWaalsContact O-CD 3.22Å; E228-P232 WeakPolarHBondContact O-CD 3.43Å; P232-I235 PolarHBondContact O-N 2.91Å; P232-A236 WeakPolarHBondContact O-CB 3.42Å; P232-A236 PolarHBondContact O-N 3.28Å
233L88.9Confident80.4Confident93 Ų9376.8 Ų76.849%0.48743%0.431SS..Hα-helixtrans-63.8-41.1177.9-176.465.1000112.3L229 I230 G231 A236 C237L229-L233 WeakPolarHBondContact O-CB 3.25Å; L229-L233 PolarHBondContact O-N 3.4Å; I230-L233 HydrophobicContact CD1-CD2 4.33Å; I230-L233 PolarHBondContact O-N 3.45Å; G231-L233 VanDerWaalsContact C-N 3.3Å; G231-L233 PolarHBondContact O-N 3.18Å; L233-A236 PolarHBondContact O-N 3.48Å; L233-C237 WeakPolarHBondContact O-CB 3.21Å; L233-C237 PolarHBondContact O-N 3.44Å
234L90.2Very high82.3Confident40 Ų4073.3 Ų73.321%0.20941%0.408CS..Hα-helixtrans-66.4-39.7174.2-74.3169.5000111.7V203 I206 I210 I230 G231 C237 S238V203-L234 HydrophobicContact CG1-CB 4.44Å; V203-L234 HydrophobicContact CG1-CD2 4.21Å; V203-L234 WeakPolarHBondContact CG1-O 3.35Å; I206-L234 HydrophobicContact CG2-CD1 4.15Å; I210-L234 HydrophobicContact CD1-CD1 3.61Å; I230-L234 HydrophobicContact CD1-CG 4.29Å; I230-L234 HydrophobicContact CG1-CD1 4Å; I230-L234 HydrophobicContact CG1-CG 4.25Å; I230-L234 WeakPolarHBondContact O-CB 3.14Å; I230-L234 VanDerWaalsContact O-CG 3.24Å; I230-L234 WeakPolarHBondContact O-CG 3.5Å; I230-L234 PolarHBondContact O-N 2.9Å; G231-L234 PolarHBondContact O-N 2.84Å; L234-C237 PolarHBondContact O-N 3.13Å; L234-S238 PolarHBondContact O-N 3.27Å
235I89.5Confident84Confident44 Ų4467.1 Ų67.123%0.22638%0.376CS..Hα-helixtrans-62.8-46.3175-65.1166.3000110.3G231 P232 S238 F239G231-I235 WeakPolarHBondContact O-CG1 3.37Å; G231-I235 PolarHBondContact O-N 3.26Å; G231-I235 VanDerWaalsContact O-N 3.12Å; P232-I235 PolarHBondContact O-N 2.91Å; I235-S238 WeakPolarHBondContact O-CB 3.45Å; I235-S238 PolarHBondContact O-N 2.98Å; I235-S238 PolarHBondContact O-OG 3.3Å; I235-F239 HydrophobicContact CG2-CE2 4.09Å; I235-F239 VanDerWaalsContact O-CD2 3.25Å; I235-F239 WeakPolarHBondContact O-CD2 3.4Å; I235-F239 PolarHBondContact O-N 3.41Å
236A91.2Very high85.2Confident57 Ų5765.1 Ų65.147%0.47136%0.363SS..Hα-helixtrans-61.4-43.6174.800000112.4P232 L233 S238 F239P232-A236 WeakPolarHBondContact O-CB 3.42Å; P232-A236 PolarHBondContact O-N 3.28Å; L233-A236 PolarHBondContact O-N 3.48Å; A236-S238 VanDerWaalsContact C-N 3.28Å; A236-S238 PolarHBondContact O-N 2.96Å; A236-F239 PolarHBondContact O-N 3.1Å; A236-F239 VanDerWaalsContact O-N 3.17Å
237C90.8Very high86.4Confident45 Ų4565.2 Ų65.230%0.30436%0.359SS..Hα-helixtrans-62.1-34.8176-169.60000112L233 L234 F239 L240 F241L233-C237 WeakPolarHBondContact O-CB 3.21Å; L233-C237 PolarHBondContact O-N 3.44Å; L234-C237 PolarHBondContact O-N 3.13Å; C237-F239 VanDerWaalsContact C-N 3.29Å; C237-F239 PolarHBondContact O-N 3.25Å; C237-L240 WeakPolarHBondContact O-CB 3.4Å; C237-L240 PolarHBondContact O-N 3.17Å; C237-F241 WeakPolarHBondContact O-CD2 3.37Å; C237-F241 PolarHBondContact O-N 3.08Å
238S91.2Very high87.5Confident0 Ų066.7 Ų66.70%036%0.356CS..Hα-helixtrans-58.1-39.8174.8860000112F200 L234 I235 A236 L240 F241 F242F200-S238 WeakPolarHBondContact CD2-O 3.13Å; F200-S238 WeakPolarHBondContact CE2-OG 3.47Å; L234-S238 PolarHBondContact O-N 3.27Å; I235-S238 WeakPolarHBondContact O-CB 3.45Å; I235-S238 PolarHBondContact O-N 2.98Å; I235-S238 PolarHBondContact O-OG 3.3Å; A236-S238 VanDerWaalsContact C-N 3.28Å; A236-S238 PolarHBondContact O-N 2.96Å; S238-L240 VanDerWaalsContact C-N 3.27Å; S238-L240 PolarHBondContact O-N 3.3Å; S238-F241 WeakPolarHBondContact O-CB 3.37Å; S238-F241 PolarHBondContact O-N 3.44Å; S238-F241 VanDerWaalsContact O-N 3.08Å; S238-F242 PolarHBondContact O-N 3.05Å
239F91.5Very high88.1Confident123 Ų12367.4 Ų67.454%0.53936%0.355SS..Hα-helixtrans-65.2-27.5176.5-72.8-75.9000113.4I235 A236 C237 F242 G243I235-F239 HydrophobicContact CG2-CE2 4.09Å; I235-F239 VanDerWaalsContact O-CD2 3.25Å; I235-F239 WeakPolarHBondContact O-CD2 3.4Å; I235-F239 PolarHBondContact O-N 3.41Å; A236-F239 PolarHBondContact O-N 3.1Å; A236-F239 VanDerWaalsContact O-N 3.17Å; C237-F239 VanDerWaalsContact C-N 3.29Å; C237-F239 PolarHBondContact O-N 3.25Å; F239-F242 PolarHBondContact O-N 3.38Å; F239-G243 PolarHBondContact O-N 3.18Å
240L91Very high88.4Confident126 Ų12668.7 Ų68.766%0.6635%0.353SS*.Hα-helixtrans-66.3-43.1171.3-57.6177.3000111C237 S238 F242 G243 A244C237-L240 WeakPolarHBondContact O-CB 3.4Å; C237-L240 PolarHBondContact O-N 3.17Å; S238-L240 VanDerWaalsContact C-N 3.27Å; S238-L240 PolarHBondContact O-N 3.3Å; L240-F242 VanDerWaalsContact C-N 3.35Å; L240-G243 PolarHBondContact O-N 2.94Å; L240-A244 WeakPolarHBondContact O-CB 3.42Å; L240-A244 PolarHBondContact O-N 2.95Å
241F89.6Confident88.2Confident67 Ų6768.5 Ų68.529%0.29435%0.352SS..Hα-helixtrans-65.3-36.5173.9-68.8-67.1000112.5F196 F200 V203 C237 S238 A244 G245F196-F241 AromaticContact CD1-CD1 3.86Å; F196-F241 HydrophobicContact CD1-CD1 3.86Å; F196-F241 AromaticContact CE1-CD1 3.95Å; F196-F241 HydrophobicContact CE1-CD1 3.95Å; F196-F241 HydrophobicContact CE1-CE1 4.38Å; F200-F241 HydrophobicContact CB-CB 4.21Å; V203-F241 HydrophobicContact CG2-CD2 4.5Å; V203-F241 HydrophobicContact CG2-CE2 4.29Å; C237-F241 WeakPolarHBondContact O-CD2 3.37Å; C237-F241 PolarHBondContact O-N 3.08Å; S238-F241 WeakPolarHBondContact O-CB 3.37Å; S238-F241 PolarHBondContact O-N 3.44Å; S238-F241 VanDerWaalsContact O-N 3.08Å; F241-A244 PolarHBondContact O-N 3Å; F241-G245 PolarHBondContact O-N 3.43Å
242F90.1Very high88.1Confident83 Ų8368.9 Ų68.936%0.36436%0.355SS..Hα-helixtrans-63.7-46.7173.3-175.9-98.1000111.9Y197 F200 S238 F239 L240 A244 G245 M246Y197-F242 HydrophobicContact CD1-CD2 4.41Å; Y197-F242 AromaticContact CE1-CD2 3.97Å; Y197-F242 HydrophobicContact CE1-CD2 3.97Å; Y197-F242 AromaticContact CE1-CE2 3.97Å; Y197-F242 HydrophobicContact CE1-CE2 3.97Å; F200-F242 HydrophobicContact CD1-CD2 4.04Å; F200-F242 HydrophobicContact CD2-CB 3.93Å; F200-F242 AromaticContact CE1-CD2 3.83Å; F200-F242 HydrophobicContact CE1-CD2 3.83Å; F200-F242 HydrophobicContact CE2-CB 3.99Å; F200-F242 HydrophobicContact CG-CB 4.23Å; F200-F242 HydrophobicContact CG-CD2 4.47Å; F200-F242 HydrophobicContact CZ-CB 4.36Å; F200-F242 HydrophobicContact CZ-CD2 4.08Å; F200-F242 HydrophobicContact CZ-CG 4.48Å; S238-F242 PolarHBondContact O-N 3.05Å; F239-F242 PolarHBondContact O-N 3.38Å; L240-F242 VanDerWaalsContact C-N 3.35Å; F242-A244 PolarHBondContact O-N 3.26Å; F242-G245 PolarHBondContact O-N 3.45Å; F242-M246 HydrophobicContact CD1-CG 4.25Å; F242-M246 HydrophobicContact CE1-CG 3.9Å; F242-M246 HydrophobicContact CE1-SD 4.5Å; F242-M246 HydrophobicContact CZ-CG 4.13Å; F242-M246 HydrophobicContact CZ-SD 4.21Å; F242-M246 WeakPolarHBondContact O-CG 3.11Å; F242-M246 PolarHBondContact O-N 2.9Å
243G90.3Very high87.7Confident40 Ų4072.9 Ų72.941%0.41236%0.361SS..Hα-helixtrans-61.9-41.8175.400000113F239 L240 M246 K247F239-G243 PolarHBondContact O-N 3.18Å; L240-G243 PolarHBondContact O-N 2.94Å; G243-M246 PolarHBondContact O-N 3.46Å; G243-K247 PolarHBondContact O-N 3.1Å
244A88.2Confident87.2Confident28 Ų2874.9 Ų74.923%0.23136%0.362CS..Hα-helixtrans-62.7-44.9172.800000111.9F196 L240 F241 F242 M246 K247 F248F196-A244 HydrophobicContact CD1-CB 4.12Å; F196-A244 HydrophobicContact CE1-CB 4.12Å; L240-A244 WeakPolarHBondContact O-CB 3.42Å; L240-A244 PolarHBondContact O-N 2.95Å; F241-A244 PolarHBondContact O-N 3Å; F242-A244 PolarHBondContact O-N 3.26Å; A244-M246 PolarHBondContact O-N 3.48Å; A244-K247 WeakPolarHBondContact O-CB 3.39Å; A244-K247 PolarHBondContact O-N 3.48Å; A244-F248 WeakPolarHBondContact O-CD2 3.24Å; A244-F248 PolarHBondContact O-N 3.22Å
245G88.9Confident86.4Confident0 Ų075.3 Ų75.30%036%0.364CS..Hα-helixtrans-57.8-46.5175.400000112.4F241 F242 K247 F248 Y249F241-G245 PolarHBondContact O-N 3.43Å; F242-G245 PolarHBondContact O-N 3.45Å; G245-K247 VanDerWaalsContact C-N 3.35Å; G245-K247 PolarHBondContact O-N 3.14Å; G245-F248 PolarHBondContact O-N 2.88Å; G245-Y249 VanDerWaalsContact O-CB 3.25Å; G245-Y249 WeakPolarHBondContact O-CB 3.32Å; G245-Y249 PolarHBondContact O-N 3.33Å
246M87.2Confident85.3Confident93 Ų9374 Ų7446%0.45836%0.362SS..Hα-helixtrans-60-41.8174.3-72.2-63.7-62.400112.3Y197 F242 G243 A244 Y249 Y250Y197-M246 PolarHBondContact OH-N 3.46Å; Y197-M246 PolarHBondContact OH-SD 3.2Å; F242-M246 HydrophobicContact CD1-CG 4.25Å; F242-M246 HydrophobicContact CE1-CG 3.9Å; F242-M246 HydrophobicContact CE1-SD 4.5Å; F242-M246 HydrophobicContact CZ-CG 4.13Å; F242-M246 HydrophobicContact CZ-SD 4.21Å; F242-M246 WeakPolarHBondContact O-CG 3.11Å; F242-M246 PolarHBondContact O-N 2.9Å; G243-M246 PolarHBondContact O-N 3.46Å; A244-M246 PolarHBondContact O-N 3.48Å; M246-Y249 PolarHBondContact O-N 2.91Å; M246-Y250 WeakPolarHBondContact O-CB 3.22Å; M246-Y250 PolarHBondContact O-N 3.36Å
247K88.8Confident84.1Confident138 Ų13873.4 Ų73.460%0.636%0.355SS*.Hα-helixtrans-63.6-51.1176.2-176.7177.7178.1178.60111.8G243 A244 G245 Y249 Y250 D251G243-K247 PolarHBondContact O-N 3.1Å; A244-K247 WeakPolarHBondContact O-CB 3.39Å; A244-K247 PolarHBondContact O-N 3.48Å; G245-K247 VanDerWaalsContact C-N 3.35Å; G245-K247 PolarHBondContact O-N 3.14Å; K247-Y249 VanDerWaalsContact C-N 3.28Å; K247-Y249 PolarHBondContact O-N 3.44Å; K247-Y250 PolarHBondContact O-N 2.93Å; K247-D251 PolarHBondContact O-N 2.85Å
248F85.7Confident82.9Confident64 Ų6474.7 Ų74.728%0.28136%0.356SS..Hα-helixtrans-64.1-32.3177.6-74.7-64000112.8L189 I192 A193 F196 A244 G245 A252L189-F248 HydrophobicContact CD2-CD1 4.37Å; I192-F248 HydrophobicContact CG2-CG 4.45Å; A193-F248 HydrophobicContact CB-CB 3.97Å; F196-F248 AromaticContact CD2-CD2 3.61Å; F196-F248 HydrophobicContact CD2-CD2 3.61Å; F196-F248 AromaticContact CD2-CE2 3.93Å; F196-F248 HydrophobicContact CD2-CE2 3.93Å; F196-F248 AromaticContact CE2-CD2 3.5Å; F196-F248 HydrophobicContact CE2-CD2 3.5Å; F196-F248 VanDerWaalsContact CE2-CD2 3.5Å; F196-F248 AromaticContact CE2-CE2 3.29Å; F196-F248 HydrophobicContact CE2-CE2 3.29Å; F196-F248 HydrophobicContact CE2-CZ 4.18Å; F196-F248 HydrophobicContact CG-CD2 4.43Å; F196-F248 HydrophobicContact CZ-CD2 4.23Å; F196-F248 AromaticContact CZ-CE2 3.7Å; F196-F248 HydrophobicContact CZ-CE2 3.7Å; A244-F248 WeakPolarHBondContact O-CD2 3.24Å; A244-F248 PolarHBondContact O-N 3.22Å; G245-F248 PolarHBondContact O-N 2.88Å; F248-A252 VanDerWaalsContact O-CB 3.25Å; F248-A252 WeakPolarHBondContact O-CB 3.32Å; F248-A252 PolarHBondContact O-N 3.29Å
249Y84.8Confident81.5Confident110 Ų11077.2 Ų77.243%0.43137%0.368SS..Hα-helixtrans-66.4-44.7173-172.6-86.9000111.6Y190 G245 M246 K247 A252 Y253Y190-Y249 HydrophobicContact CE2-CD2 4.43Å; Y190-Y249 AromaticContact CE2-CE2 3.95Å; Y190-Y249 HydrophobicContact CE2-CE2 3.95Å; G245-Y249 VanDerWaalsContact O-CB 3.25Å; G245-Y249 WeakPolarHBondContact O-CB 3.32Å; G245-Y249 PolarHBondContact O-N 3.33Å; M246-Y249 PolarHBondContact O-N 2.91Å; K247-Y249 VanDerWaalsContact C-N 3.28Å; K247-Y249 PolarHBondContact O-N 3.44Å; Y249-A252 PolarHBondContact O-N 3.49Å; Y249-Y253 WeakPolarHBondContact O-CB 3.29Å; Y249-Y253 PolarHBondContact O-N 3.28Å
250Y84.7Confident79.8Confident147 Ų14776.4 Ų76.458%0.57636%0.361SS*.Hα-helixtrans-63.4-44.2174.6-175.2-91.9000111.8M246 K247 A252 Y253 R254M246-Y250 WeakPolarHBondContact O-CB 3.22Å; M246-Y250 PolarHBondContact O-N 3.36Å; K247-Y250 PolarHBondContact O-N 2.93Å; Y250-A252 VanDerWaalsContact C-N 3.34Å; Y250-A252 PolarHBondContact O-N 2.85Å; Y250-Y253 PolarHBondContact O-N 3.12Å; Y250-R254 HydrophobicContact CE1-CB 4.42Å; Y250-R254 VanDerWaalsContact O-CB 3.31Å; Y250-R254 WeakPolarHBondContact O-CB 3.36Å; Y250-R254 PolarHBondContact O-N 2.63Å
251D81.5Confident78.1Confident59 Ų5978.1 Ų78.132%0.31636%0.363SS..Hα-helixtrans-63.9-38.2176.7-71.4-24.7000111.6K247 L255K247-D251 PolarHBondContact O-N 2.85Å; D251-L255 VanDerWaalsContact O-CB 3.23Å; D251-L255 WeakPolarHBondContact O-CB 3.33Å; D251-L255 PolarHBondContact O-N 2.85Å
252A79.7Confident76.3Confident10 Ų1080 Ų808%0.08338%0.376CS..Hα-helixtrans-65.1-40.7172.600000112.3L189 F248 Y249 Y250 G256L189-A252 HydrophobicContact CB-CB 3.87Å; F248-A252 VanDerWaalsContact O-CB 3.25Å; F248-A252 WeakPolarHBondContact O-CB 3.32Å; F248-A252 PolarHBondContact O-N 3.29Å; Y249-A252 PolarHBondContact O-N 3.49Å; Y250-A252 VanDerWaalsContact C-N 3.34Å; Y250-A252 PolarHBondContact O-N 2.85Å; A252-G256 PolarHBondContact O-N 3.43Å
253Y77.9Confident74.5Confident164 Ų16478.5 Ų78.564%0.64337%0.371SS*.Hα-helixtrans-67.4-44176.5-174.2-89.7000111.7Y249 Y250 G256 S257Y249-Y253 WeakPolarHBondContact O-CB 3.29Å; Y249-Y253 PolarHBondContact O-N 3.28Å; Y250-Y253 PolarHBondContact O-N 3.12Å; Y253-G256 PolarHBondContact O-N 3.44Å; Y253-S257 WeakPolarHBondContact O-CB 3.37Å; Y253-S257 PolarHBondContact O-N 2.87Å
254R79.4Confident72.6Confident134 Ų13485.6 Ų85.651%0.50639%0.39SS..Hα-helixtrans-63.1-50.2176.5179.8179.4170.7175.2-1.1111.1Y250 G256 S257 E258Y250-R254 HydrophobicContact CE1-CB 4.42Å; Y250-R254 VanDerWaalsContact O-CB 3.31Å; Y250-R254 WeakPolarHBondContact O-CB 3.36Å; Y250-R254 PolarHBondContact O-N 2.63Å; R254-G256 VanDerWaalsContact C-N 3.3Å; R254-G256 PolarHBondContact O-N 2.85Å; R254-S257 CarbonylContact O-C 3.49Å; R254-S257 WeakPolarHBondContact O-CA 3.41Å; R254-S257 VanDerWaalsContact O-CB 3.32Å; R254-S257 WeakPolarHBondContact O-CB 3.33Å; R254-S257 PolarHBondContact O-N 3.33Å; R254-E258 IonicContact CZ-OE1 3.47Å; R254-E258 IonicContact NE-OE1 2.8Å; R254-E258 PolarHBondContact NE-OE1 3.38Å; R254-E258 IonicContact NH2-OE1 3.22Å; R254-E258 PolarHBondContact NH2-OE1 2.9Å; R254-E258 WeakPolarHBondContact O-CG 3.15Å; R254-E258 PolarHBondContact O-N 2.95Å
255L72Confident70.5Confident49 Ų4992.3 Ų92.326%0.25741%0.411SS..Hα-helixtrans-61.9-40.2176.9-171.970.4000111A186 L189 D251 S257 E258 E259A186-L255 HydrophobicContact CB-CD2 4.49Å; L189-L255 HydrophobicContact CD1-CD2 3.37Å; D251-L255 VanDerWaalsContact O-CB 3.23Å; D251-L255 WeakPolarHBondContact O-CB 3.33Å; D251-L255 PolarHBondContact O-N 2.85Å; L255-S257 VanDerWaalsContact C-N 3.29Å; L255-S257 PolarHBondContact O-N 3.35Å; L255-E258 PolarHBondContact O-N 3.02Å; L255-E259 HydrophobicContact CG-CG 4.43Å; L255-E259 WeakPolarHBondContact O-CB 3.36Å; L255-E259 WeakPolarHBondContact O-CG 3.16Å; L255-E259 PolarHBondContact O-N 3.45Å
256G67.7Low68.1Low17 Ų1799.4 Ų99.418%0.17544%0.442CS..Hα-helixtrans-62.9-32.4172.800000113.5A252 Y253 R254 R260A252-G256 PolarHBondContact O-N 3.43Å; Y253-G256 PolarHBondContact O-N 3.44Å; R254-G256 VanDerWaalsContact C-N 3.3Å; R254-G256 PolarHBondContact O-N 2.85Å; G256-R260 WeakPolarHBondContact O-CB 3.15Å; G256-R260 VanDerWaalsContact O-CD 3.28Å; G256-R260 WeakPolarHBondContact O-CD 3.19Å; G256-R260 WeakPolarHBondContact O-CG 3.43Å; G256-R260 PolarHBondContact O-N 3.02Å; G256-R260 VanDerWaalsContact O-N 3.11Å
257S65.4Low65.7Low45 Ų4599.5 Ų99.532%0.31546%0.457SS..Hα-helixtrans-71.7-39.8172.7-168.60000112.1Y253 R254 L255 R260 K261Y253-S257 WeakPolarHBondContact O-CB 3.37Å; Y253-S257 PolarHBondContact O-N 2.87Å; R254-S257 CarbonylContact O-C 3.49Å; R254-S257 WeakPolarHBondContact O-CA 3.41Å; R254-S257 VanDerWaalsContact O-CB 3.32Å; R254-S257 WeakPolarHBondContact O-CB 3.33Å; R254-S257 PolarHBondContact O-N 3.33Å; L255-S257 VanDerWaalsContact C-N 3.29Å; L255-S257 PolarHBondContact O-N 3.35Å; S257-R260 PolarHBondContact O-N 3.43Å; S257-K261 WeakPolarHBondContact O-CG 3.38Å; S257-K261 PolarHBondContact O-N 2.96Å; S257-K261 VanDerWaalsContact O-N 3.17Å
258E66.2Low63.6Low71 Ų7195.9 Ų95.933%0.33245%0.453SS..Hα-helixtrans-69.1-45.9176.7-70.6172.5-175.300111.4R254 L255 R260 K261 L262R254-E258 IonicContact CZ-OE1 3.47Å; R254-E258 IonicContact NE-OE1 2.8Å; R254-E258 PolarHBondContact NE-OE1 3.38Å; R254-E258 IonicContact NH2-OE1 3.22Å; R254-E258 PolarHBondContact NH2-OE1 2.9Å; R254-E258 WeakPolarHBondContact O-CG 3.15Å; R254-E258 PolarHBondContact O-N 2.95Å; L255-E258 PolarHBondContact O-N 3.02Å; E258-R260 VanDerWaalsContact C-N 3.29Å; E258-R260 PolarHBondContact O-N 3.17Å; E258-K261 WeakPolarHBondContact O-CB 3.49Å; E258-K261 PolarHBondContact O-N 3.02Å; E258-L262 PolarHBondContact O-N 2.87Å
259E60.3Low61Low54 Ų5495.7 Ų95.725%0.25246%0.46SS..Hα-helixtrans-56.9-40.6171.6-74.5-177.8166.600111R185 L255 K261 L262R185-E259 WeakPolarHBondContact CB-OE1 3.28Å; R185-E259 PolarHBondContact N-OE1 3.48Å; R185-E259 VanDerWaalsContact N-OE1 3.08Å; L255-E259 HydrophobicContact CG-CG 4.43Å; L255-E259 WeakPolarHBondContact O-CB 3.36Å; L255-E259 WeakPolarHBondContact O-CG 3.16Å; L255-E259 PolarHBondContact O-N 3.45Å; E259-K261 VanDerWaalsContact C-N 3.34Å; E259-K261 PolarHBondContact O-N 3.29Å; E259-L262 PolarHBondContact O-N 3.38Å
260R55.5Low59.2Low106 Ų10697.2 Ų97.240%0.448%0.483SS..Hα-helixtrans-65.6-28.3175.4-78167.7-176.1-123.2-3.3114.3N179 G256 S257 E258 L262N179-R260 PolarHBondContact O-NH2 3.38Å; N179-R260 PolarHBondContact OD1-NH1 2.68Å; G256-R260 WeakPolarHBondContact O-CB 3.15Å; G256-R260 VanDerWaalsContact O-CD 3.28Å; G256-R260 WeakPolarHBondContact O-CD 3.19Å; G256-R260 WeakPolarHBondContact O-CG 3.43Å; G256-R260 PolarHBondContact O-N 3.02Å; G256-R260 VanDerWaalsContact O-N 3.11Å; S257-R260 PolarHBondContact O-N 3.43Å; E258-R260 VanDerWaalsContact C-N 3.29Å; E258-R260 PolarHBondContact O-N 3.17Å; R260-L262 VanDerWaalsContact C-N 3.33Å
261K56.9Low56.8Low162 Ų16295.1 Ų95.170%0.70449%0.49SS*.Hα-helixtrans-75-22.8175.7-70.6166.8-172174.60112.7S257 E258 E259S257-K261 WeakPolarHBondContact O-CG 3.38Å; S257-K261 PolarHBondContact O-N 2.96Å; S257-K261 VanDerWaalsContact O-N 3.17Å; E258-K261 WeakPolarHBondContact O-CB 3.49Å; E258-K261 PolarHBondContact O-N 3.02Å; E259-K261 VanDerWaalsContact C-N 3.34Å; E259-K261 PolarHBondContact O-N 3.29Å
262L51Low54.8Low107 Ų10796.2 Ų96.256%0.5650%0.499SS*.Hα-helixtrans-83.7-11.9179.4-83.6151.5000113.9E258 E259 R260 K264E258-L262 PolarHBondContact O-N 2.87Å; E259-L262 PolarHBondContact O-N 3.38Å; R260-L262 VanDerWaalsContact C-N 3.33Å; L262-K264 VanDerWaalsContact C-N 3.33Å; L262-K264 PolarHBondContact O-N 2.93Å
263I53.5Low52.8Low50 Ų5099.5 Ų99.526%0.25652%0.518SS..  trans-72.585.8177.1-53.9176.1000110.1I178 Y265I178-I263 HydrophobicContact CG2-CD1 4.42Å; I263-Y265 PolarHBondContact O-N 3.39Å
264K49Very low50.9Low189 Ų18994.1 Ų94.182%0.82251%0.508SS*.  trans-79.9107.2167.3-71.9-179.9-179.8172.60109.4L262 K266L262-K264 VanDerWaalsContact C-N 3.33Å; L262-K264 PolarHBondContact O-N 2.93Å; K264-K266 PolarHBondContact O-N 3.36Å
265Y44.4Very low49Very low169 Ų16990.4 Ų90.466%0.66350%0.499SS*.  trans-57.8118.2174.4-57.8-89.9000111.2I178 I263I178-Y265 HydrophobicContact CD1-CE1 4.17Å; I263-Y265 PolarHBondContact O-N 3.39Å
266K39.5Very low47.8Very low150 Ų15093.1 Ų93.165%0.65252%0.518SS*.  trans-109.4125.2157-81.2-166.7172.2-170.80108.4K264 A268K264-K266 PolarHBondContact O-N 3.36Å; K266-A268 PolarHBondContact O-N 2.7Å
267A35.9Very low46.6Very low94 Ų9496.8 Ų96.878%0.77754%0.537SS*.  trans-65.9119.8166.300000108.2
268A44.6Very low45.7Very low63 Ų63100.1 Ų100.152%0.52156%0.556SS.*  trans-85.6-34.5177.500000111.2K266 T272 A274K266-A268 PolarHBondContact O-N 2.7Å; A268-T272 PolarHBondContact N-O 2.88Å; A268-A274 HydrophobicContact CB-CB 3.76Å
269S32.2Very low44.4Very low59 Ų59101.3 Ų101.341%0.41356%0.564SS.*BIsolated β-bridgetrans-161.3162.1172.3-158.80000110S271 T272S269-S271 PolarHBondContact O-N 3.49Å; S269-T272 VanDerWaalsContact CB-OG1 3.31Å; S269-T272 WeakPolarHBondContact CB-OG1 3.25Å; S269-T272 PolarHBondContact N-O 2.79Å; S269-T272 VanDerWaalsContact N-O 3.13Å; S269-T272 PolarHBondContact O-N 3.03Å; S269-T272 VanDerWaalsContact O-N 3.12Å; S269-T272 VanDerWaalsContact O-O 3.12Å
270P46.1Very low43.7Very low143 Ų143102.8 Ų102.893%0.92957%0.571SS**THydrogen-bonded Turntrans-59-10.1177.9-26.536.8000115.9
271S35Very low43.1Very low103 Ų103106.3 Ų106.372%0.7259%0.585SS**THydrogen-bonded Turntrans-120.1-4.1177.856.80000114.6S269S269-S271 PolarHBondContact O-N 3.49Å
272T37.8Very low42.4Very low81 Ų81104.2 Ų104.250%0.49759%0.585SS.*BIsolated β-bridgetrans-142.4127.2-175.748.30000113A268 S269A268-T272 PolarHBondContact N-O 2.88Å; S269-T272 VanDerWaalsContact CB-OG1 3.31Å; S269-T272 WeakPolarHBondContact CB-OG1 3.25Å; S269-T272 PolarHBondContact N-O 2.79Å; S269-T272 VanDerWaalsContact N-O 3.13Å; S269-T272 PolarHBondContact O-N 3.03Å; S269-T272 VanDerWaalsContact O-N 3.12Å; S269-T272 VanDerWaalsContact O-O 3.12Å
273V37.9Very low42Very low79 Ų79102.8 Ų102.848%0.47958%0.581SS.*  trans-103.5101171.7-178.10000108V275V273-V275 PolarHBondContact O-N 2.88Å
274A38.2Very low41.3Very low52 Ų52105.2 Ų105.243%0.4359%0.594SS.*  trans-80.1110.2171.400000109.2A268 T276A268-A274 HydrophobicContact CB-CB 3.76Å; A274-T276 VanDerWaalsContact C-N 3.34Å; A274-T276 PolarHBondContact O-N 2.75Å
275V40.3Very low40.7Very low55 Ų5599.6 Ų99.633%0.33359%0.59SS.*  trans-78.487.7171.6-177.30000108.3I178 V273 T277I178-V275 HydrophobicContact CD1-CG2 4.22Å; I178-V275 HydrophobicContact CG1-CG2 4.45Å; V273-V275 PolarHBondContact O-N 2.88Å; V275-T277 PolarHBondContact O-N 2.87Å
276T45.6Very low40.4Very low106 Ų106100.6 Ų100.665%0.6560%0.601SS**  trans-80.3101.716845.10000109.1A274 V278A274-T276 VanDerWaalsContact C-N 3.34Å; A274-T276 PolarHBondContact O-N 2.75Å; T276-V278 PolarHBondContact O-N 3.25Å; T276-V278 VanDerWaalsContact O-N 3.09Å
277T44Very low40.1Very low94 Ų94101 Ų10158%0.57761%0.605SS**  trans-64.5108.5163.349.40000107.8V275 D279V275-T277 PolarHBondContact O-N 2.87Å; T277-D279 PolarHBondContact O-N 3.46Å
278V45.6Very low39.9Very low116 Ų116105.1 Ų105.170%0.70361%0.605SS**  trans-66.2103.5167.7178.80000106.5T276 Q280T276-V278 PolarHBondContact O-N 3.25Å; T276-V278 VanDerWaalsContact O-N 3.09Å; V278-Q280 PolarHBondContact O-N 3.43Å
279D39.4Very low39.3Very low96 Ų96110.4 Ų110.451%0.51362%0.624SS.*  trans-73.487.6173.6-167.5-0.2000108.3T277 R281 V282T277-D279 PolarHBondContact O-N 3.46Å; D279-R281 PolarHBondContact O-N 3.31Å; D279-R281 PolarHBondContact OD1-N 2.79Å; D279-V282 PolarHBondContact O-N 2.9Å
280Q45.7Very low39.4Very low85 Ų85113.3 Ų113.340%0.39764%0.639SS.*THydrogen-bonded Turntrans-59.7-10.1-176.8-174.6165-1.300112.7V278 V282 D284V278-Q280 PolarHBondContact O-N 3.43Å; Q280-V282 VanDerWaalsContact C-N 3.31Å; Q280-V282 PolarHBondContact O-N 2.79Å; Q280-D284 VanDerWaalsContact CG-OD2 3.25Å; Q280-D284 WeakPolarHBondContact CG-OD2 3.24Å; Q280-D284 PolarHBondContact NE2-OD2 2.99Å
281R41.8Very low38.8Very low180 Ų180112.1 Ų112.168%0.67963%0.634SS**THydrogen-bonded Turntrans-82.42.9174.7-58.1-143.3-170.8-169.8-1.5115.4D279D279-R281 PolarHBondContact O-N 3.31Å; D279-R281 PolarHBondContact OD1-N 2.79Å
282V43.6Very low39Very low117 Ų117110.8 Ų110.871%0.70964%0.637SS**THydrogen-bonded Turntrans-109.5-18173.9-173.50000112.6D279 Q280D279-V282 PolarHBondContact O-N 2.9Å; Q280-V282 VanDerWaalsContact C-N 3.31Å; Q280-V282 PolarHBondContact O-N 2.79Å
283T41.4Very low39Very low77 Ų77115.7 Ų115.747%0.47265%0.654SS.*THydrogen-bonded Turntrans-101.9-28.3-178.937.60000115G285 E286T283-G285 PolarHBondContact O-N 3.44Å; T283-E286 PolarHBondContact O-N 3.36Å
284D38.3Very low39.2Very low102 Ų102118.4 Ų118.455%0.54567%0.671SS.*THydrogen-bonded Turntrans-74.78.8-178.6-66.63.1000113.3Q280Q280-D284 VanDerWaalsContact CG-OD2 3.25Å; Q280-D284 WeakPolarHBondContact CG-OD2 3.24Å; Q280-D284 PolarHBondContact NE2-OD2 2.99Å
285G36.8Very low39.4Very low71 Ų71119.8 Ų119.873%0.73268%0.677SS**THydrogen-bonded Turntrans-90.8-21.8175.700000115.2T283T283-G285 PolarHBondContact O-N 3.44Å
286E38.4Very low39.9Very low189 Ų189126.9 Ų126.988%0.88370%0.704SS**THydrogen-bonded Turntrans-119.4-24.4-179.5-67.8-166.4156.800113.6T283 K288T283-E286 PolarHBondContact O-N 3.36Å; E286-K288 PolarHBondContact O-N 3.16Å
287E34Very low40.1Very low160 Ų160128.6 Ų128.675%0.74871%0.709SS**  trans-80.651.4170.6-67.7-165.6163.400112.3L289E287-L289 PolarHBondContact O-N 2.92Å; E287-L289 VanDerWaalsContact O-N 3.17Å
288K31.2Very low40.2Very low179 Ų179127.4 Ų127.478%0.77871%0.708SS**  trans-62.4117.9159-172.4176.9-175.4179.80106.6E286 V290E286-K288 PolarHBondContact O-N 3.16Å; K288-V290 PolarHBondContact O-N 3.25Å
289L32.2Very low40.3Very low175 Ų175129.5 Ų129.592%0.91672%0.715SS**  trans-60.776.7-177.3-68.8163.8000112.3E287 S291E287-L289 PolarHBondContact O-N 2.92Å; E287-L289 VanDerWaalsContact O-N 3.17Å; L289-S291 PolarHBondContact O-N 3.33Å
290V33.8Very low40.7Very low119 Ų119130 Ų13072%0.72173%0.726SS**  trans-80.297167.3-179.60000107.1K288 G292K288-V290 PolarHBondContact O-N 3.25Å; V290-G292 PolarHBondContact O-N 2.74Å
291S34.7Very low40.8Very low118 Ų118136.2 Ų136.283%0.82575%0.746SS**THydrogen-bonded Turntrans-31.9125.1166.3-173.90000113L289L289-S291 PolarHBondContact O-N 3.33Å
292G37.7Very low41Very low76 Ų76131.4 Ų131.478%0.78474%0.744SS**THydrogen-bonded Turntrans99.73.4153.100000119.5V290V290-G292 PolarHBondContact O-N 2.74Å
293Q39.2Very low41.2Very low183 Ų183131.7 Ų131.786%0.85575%0.749SS**  trans-121107.9174.3-75.3-169.3-11.100114.2S295Q293-S295 PolarHBondContact O-N 2.78Å
294T41.1Very low41.3Very low137 Ų137136.6 Ų136.684%0.8477%0.77SS**  trans-75.4110.1171.754.90000110.3
295S41.9Very low41.3Very low80 Ų80135.3 Ų135.356%0.55978%0.781SS**  trans-67.8144.2173.992.40000110.8Q293 N297 A298Q293-S295 PolarHBondContact O-N 2.78Å; S295-N297 PolarHBondContact O-N 3.31Å; S295-A298 WeakPolarHBondContact O-CB 3.5Å; S295-A298 PolarHBondContact O-N 3.4Å
296K51.3Low41.6Very low204 Ų204137.2 Ų137.289%0.88778%0.783SS**G310 helixtrans-63-12.1-173.7-63.9177.7-179.5177.10113.9
297N49.1Very low41.6Very low143 Ų143139.9 Ų139.977%0.76579%0.785SS**G310 helixtrans-83.7-8.1176-70.3-30.1000114S295 L299S295-N297 PolarHBondContact O-N 3.31Å; N297-L299 VanDerWaalsContact C-N 3.32Å
298A47.2Very low42Very low68 Ų68138.8 Ų138.856%0.56279%0.79SS**G310 helixtrans-72.4-22.817600000113.5S295 S300S295-A298 WeakPolarHBondContact O-CB 3.5Å; S295-A298 PolarHBondContact O-N 3.4Å; A298-S300 PolarHBondContact O-N 3.22Å
299L46.6Very low42.5Very low160 Ų160136.2 Ų136.284%0.83879%0.789SS**G310 helixtrans-79-14.6-169-143.875.4000114.7N297N297-L299 VanDerWaalsContact C-N 3.32Å
300S49.5Very low43Very low107 Ų107135.7 Ų135.775%0.74879%0.786SS**G310 helixtrans-84.7-4.8-177.766.50000114.6A298A298-S300 PolarHBondContact O-N 3.22Å
301R47.1Very low43.5Very low215 Ų215137.7 Ų137.781%0.81179%0.791SS**  trans-101.958.1173.4-74.8-173.4173.4166.94.3111.9
302A46.4Very low44.2Very low79 Ų79139.7 Ų139.765%0.65379%0.789SS**PPolyproline II helixtrans-62.5144.1167.200000110.8
303P46.5Very low44.5Very low123 Ų123144.3 Ų144.380%0.79981%0.806SS**PPolyproline II helixtrans-72.3137.4-177.9-12.127.4000111.8G305P303-G305 PolarHBondContact O-N 3.24Å
304I44.9Very low44.8Very low180 Ų180142.4 Ų142.492%0.92380%0.803SS**SBendtrans-69.3117.5168.3-62.2168.1000108.5
305G37.9Very low45Very low75 Ų75142.6 Ų142.677%0.77380%0.801SS**  trans114.969.2159.900000117.1P303P303-G305 PolarHBondContact O-N 3.24Å
306S43.9Very low45.2Very low111 Ų111146.1 Ų146.178%0.77681%0.814SS**  trans-133.2127.915149.80000109.7T308S306-T308 PolarHBondContact O-N 2.9Å
307R38.1Very low44.8Very low246 Ų246142.7 Ų142.793%0.92881%0.81SS**  trans-55129.7-177.2-73.5161146.6171.1-11.3112.1
308T41Very low44.5Very low137 Ų137142.7 Ų142.784%0.8481%0.813SS**  trans-111.7108.6151.9180000109S306S306-T308 PolarHBondContact O-N 2.9Å
309T42.6Very low44.4Very low124 Ų124147.7 Ų147.776%0.76183%0.83SS**  trans-88.2102.8163.543.20000108.1
310L41.6Very low44.2Very low165 Ų165146.8 Ų146.886%0.86483%0.829SS**  trans-73.3125.6164.1-82.8160.4000108.7
311I45.4Very low43.8Very low160 Ų160149.8 Ų149.882%0.82184%0.835SS**  trans-124.7125.9160.5-63176.2000105.5
312M48.4Very low43.5Very low160 Ų160144.4 Ų144.479%0.78884%0.837SS**  trans-137.8131.4-177.9169.3-177.8167.800107.1
313P45.7Very low43.3Very low173 Ų173150.4 Ų150.4100%1.12385%0.854SS**  -89.80129.833.5-29000110.6

Retrieved 313 of 313 residues in 665.1 ms (Link to these results)