A0A024QZW4_HUMAN Loading...

Adenosine 3'-phospho 5'-phosphosulfate transporter 2

AlphaFold DB , UniProt , Accession A0A024QZW4, Species HUMAN (Homo sapiens, Human), Gene SLC35B3, Length 369 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
1M36.5Very low33.7Very low245 Ų245174.5 Ų174.5100%1.20782%0.823SS**  0109.90-86.1175.1167.800107.8
2D32.1Very low33.6Very low151 Ų151172.8 Ų172.881%0.80782%0.82SS**  trans-51.7141.3174.6-60.7-84.6000113.8
3L30.7Very low33.5Very low148 Ų148166.5 Ų166.578%0.77581%0.806SS**  172.2107.5109.3-94.9148.7000110.4F5L3-F5 HydrophobicContact CD2-CD2 4.26Å; L3-F5 HydrophobicContact CD2-CE2 4.05Å
4K32.8Very low33.6Very low208 Ų208165.3 Ų165.390%0.90480%0.803SS**  trans-60.5127.1155.7-81.6173.2172174.30108.4
5F34.6Very low33.6Very low182 Ų182161.8 Ų161.880%0.79880%0.796SS**  trans-125.996.2154.2-105.6-81.7000110.2L3L3-F5 HydrophobicContact CD2-CD2 4.26Å; L3-F5 HydrophobicContact CD2-CE2 4.05Å
6N31.6Very low34Very low135 Ų135159.3 Ų159.372%0.72279%0.793SS**  trans-65.4125.8159.3-172.119.5000107.8
7N33.3Very low34Very low150 Ų150156.5 Ų156.580%0.80279%0.788SS**  trans-144.692.7161.3-140.14000111.4R9N7-R9 PolarHBondContact O-N 3.13Å
8S35.2Very low34.1Very low80 Ų80154.1 Ų154.156%0.55979%0.788SS**  trans-50.6120.4166-58.50000110.6K10S8-K10 VanDerWaalsContact C-N 3.32Å; S8-K10 PolarHBondContact O-N 2.81Å
9R36Very low34Very low226 Ų226155.8 Ų155.885%0.85379%0.79SS**  trans-62.995.3161.2-76.6-176.9-174172.92.5108.3N7 Y11N7-R9 PolarHBondContact O-N 3.13Å; R9-Y11 PolarHBondContact O-N 3.47Å
10K34.8Very low34.1Very low189 Ų189155.2 Ų155.282%0.82279%0.794SS**  trans-73.4104167.7-85.5-178.3175.8176.80108.4S8 I12S8-K10 VanDerWaalsContact C-N 3.32Å; S8-K10 PolarHBondContact O-N 2.81Å; K10-I12 PolarHBondContact O-N 3.46Å
11Y32.7Very low33.9Very low206 Ų206156.1 Ų156.181%0.80880%0.795SS**  trans-58.4115.8159.2-72.9-93.5000108.1R9 S13R9-Y11 PolarHBondContact O-N 3.47Å; Y11-S13 VanDerWaalsContact C-N 3.29Å; Y11-S13 PolarHBondContact O-N 3.15Å
12I33.3Very low33.9Very low153 Ų153150.7 Ų150.779%0.78578%0.776SS**  trans-79.687.1170.4-59.7171.8000106.2K10 I14K10-I12 PolarHBondContact O-N 3.46Å; I12-I14 HydrophobicContact CG2-CG1 4.25Å; I12-I14 PolarHBondContact O-N 3.25Å
13S31.9Very low33.9Very low91 Ų91152 Ų15264%0.63678%0.78SS**  trans-70.4107.216556.90000107.9Y11 T15Y11-S13 VanDerWaalsContact C-N 3.29Å; Y11-S13 PolarHBondContact O-N 3.15Å; S13-T15 PolarHBondContact O-N 3.2Å
14I35.4Very low33.8Very low150 Ų150149.7 Ų149.777%0.76978%0.776SS**  trans-74.585.6168.8-59.2171.8000106.5I12 V16I12-I14 HydrophobicContact CG2-CG1 4.25Å; I12-I14 PolarHBondContact O-N 3.25Å; I14-V16 PolarHBondContact O-N 3.47Å
15T33.1Very low33.8Very low113 Ų113145.8 Ų145.869%0.69377%0.772SS**  trans-74.3107.9172.5-40.90000107.5S13 P17S13-T15 PolarHBondContact O-N 3.2Å; T15-P17 WeakPolarHBondContact O-CD 3.4Å
16V39.9Very low33.6Very low122 Ų122145.8 Ų145.874%0.73977%0.774SS**  trans-63.6119.2172179.40000107.8I14 S18I14-V16 PolarHBondContact O-N 3.47Å; V16-S18 PolarHBondContact O-N 3.31Å; V16-S18 VanDerWaalsContact O-N 3.15Å
17P34.4Very low34.1Very low111 Ų111146.1 Ų146.172%0.72177%0.774SS**  trans-70115179.9-922.6000109.9T15 K19T15-P17 WeakPolarHBondContact O-CD 3.4Å; P17-K19 PolarHBondContact O-N 3.31Å
18S34.9Very low33.9Very low113 Ų113148.1 Ų148.179%0.7978%0.776SS**  trans-76.1101.6166.4520000109.3V16V16-S18 PolarHBondContact O-N 3.31Å; V16-S18 VanDerWaalsContact O-N 3.15Å
19K32.6Very low33.9Very low187 Ų187148.5 Ų148.581%0.81378%0.778SS**SBendtrans129.5114.5162.6-77.6174.5174.4177.60111.6P17 Q21P17-K19 PolarHBondContact O-N 3.31Å; K19-Q21 PolarHBondContact O-N 2.94Å
20T36.8Very low34.2Very low143 Ų143141.8 Ų141.888%0.87776%0.763SS**  trans-1487.7152.8-43.40000113.6T22T20-T22 PolarHBondContact O-N 3.08Å
21Q29.8Very low34.7Very low175 Ų175137.2 Ų137.282%0.81875%0.747SS**  trans-73.5109.4159.9-87.2-179-17.800107.4K19 M23K19-Q21 PolarHBondContact O-N 2.94Å; Q21-M23 PolarHBondContact O-N 3.43Å
22T36.8Very low35.6Very low132 Ų132131.7 Ų131.781%0.8173%0.731SS**  trans-21.898.9161.846.90000113.6T20T20-T22 PolarHBondContact O-N 3.08Å
23M32.4Very low36.7Very low178 Ų178124.7 Ų124.788%0.87770%0.696SS**  trans-64.4136159.9-81.2-171.2171.200109Q21Q21-M23 PolarHBondContact O-N 3.43Å
24S28Very low38Very low99 Ų99121.9 Ų121.969%0.69268%0.675SS**  trans-48146.8179.8-48.40000113.1H26S24-H26 PolarHBondContact O-N 3Å
25P32.5Very low39.2Very low127 Ų127114.9 Ų114.983%0.82564%0.639SS**THydrogen-bonded Turntrans-74.414.8-16830.7-35.4000115.5
26H31.2Very low40.4Very low181 Ų181112.2 Ų112.284%0.83862%0.62SS**THydrogen-bonded Turntrans-104.28.2-174.7-99-66.7000116.2S24S24-H26 PolarHBondContact O-N 3Å
27I40.3Very low41Very low143 Ų143109.4 Ų109.473%0.73362%0.616SS**  trans-120.873171.5-53.8168.8000108.8
28K30.4Very low42.2Very low191 Ų191110.2 Ų110.283%0.8361%0.612SS**  trans-90.987.8147-85.1-177.2176.9176.50106.4V30K28-V30 PolarHBondContact O-N 3.26Å
29S35.9Very low43.6Very low88 Ų88107.2 Ų107.262%0.61559%0.587SS**  trans-70.277.6159.9570000107.5D31S29-D31 PolarHBondContact O-N 2.97Å
30V40.3Very low45.2Very low86 Ų8698.7 Ų98.752%0.52155%0.55SS.*  trans-66.7116153.5179.80000103.7K28 D32K28-V30 PolarHBondContact O-N 3.26Å; V30-D32 PolarHBondContact O-N 3.37Å
31D46.5Very low46.3Very low93 Ų9393.6 Ų93.650%0.49752%0.52SS..  trans-5784168.6-75.3-57.9000107.8S29 V33 S41S29-D31 PolarHBondContact O-N 2.97Å; D31-V33 VanDerWaalsContact C-N 3.26Å; D31-V33 PolarHBondContact O-N 3.19Å; D31-S41 PolarHBondContact O-OG 3.23Å
32D50.4Low47.9Very low89 Ų8994.1 Ų94.148%0.47652%0.52SS..  trans-69.591.3174.4-80.3-31.7000106.7V30 V34 N39V30-D32 PolarHBondContact O-N 3.37Å; D32-V34 HydrophobicContact CB-CG2 4.27Å; D32-V34 PolarHBondContact O-N 3.31Å; D32-N39 VanDerWaalsContact CG-ND2 3.26Å; D32-N39 PolarHBondContact OD1-ND2 3.22Å; D32-N39 PolarHBondContact OD1-OD1 2.89Å
33V56.9Low49.5Very low7 Ų792.8 Ų92.84%0.04250%0.503CS..  trans-8383.1170-173.20000105.8D31 V35 L40 S41 A284 K287 I288D31-V33 VanDerWaalsContact C-N 3.26Å; D31-V33 PolarHBondContact O-N 3.19Å; V33-V35 HydrophobicContact CG1-CG2 3.95Å; V33-L40 PolarHBondContact O-N 3.41Å; V33-L40 VanDerWaalsContact O-N 3.11Å; V33-S41 PolarHBondContact N-OG 2.69Å; V33-A284 HydrophobicContact CG1-CB 4.15Å; V33-K287 HydrophobicContact CG2-CD 4.22Å; V33-I288 HydrophobicContact CB-CD1 4.27Å; V33-I288 HydrophobicContact CB-CG1 4.38Å; V33-I288 HydrophobicContact CG1-CD1 3.91Å; V33-I288 HydrophobicContact CG1-CG1 4.17Å; V33-I288 HydrophobicContact CG2-CD1 4.32Å; V33-I288 HydrophobicContact CG2-CG1 3.89Å
34V59.2Low51.8Low31 Ų3189.6 Ų89.619%0.18849%0.489CS..EExtended strand (participates in β ladder)trans-78.2119.8169.6-174.30000107.2D32 M38 N39 I102D32-V34 HydrophobicContact CB-CG2 4.27Å; D32-V34 PolarHBondContact O-N 3.31Å; V34-M38 WeakPolarHBondContact CA-O 3.5Å; V34-N39 HydrophobicContact CG2-CB 4.47Å; V34-I102 HydrophobicContact CG1-CD1 4.21Å
35V60.6Low54.1Low3 Ų391.3 Ų91.32%0.01848%0.484CS..EExtended strand (participates in β ladder)trans-121.3114.2169.9-176.40000105.2V33 G37 M38 L40 F281 A284V33-V35 HydrophobicContact CG1-CG2 3.95Å; V35-G37 PolarHBondContact O-N 2.83Å; V35-M38 PolarHBondContact N-O 3.15Å; V35-M38 VanDerWaalsContact N-O 3.08Å; V35-M38 PolarHBondContact O-N 2.98Å; V35-L40 HydrophobicContact CB-CD1 3.63Å; V35-L40 HydrophobicContact CG2-CD1 3.79Å; V35-F281 HydrophobicContact CG1-CD1 3.83Å; V35-F281 HydrophobicContact CG1-CE1 3.68Å; V35-F281 HydrophobicContact CG1-CE2 4.49Å; V35-F281 HydrophobicContact CG1-CG 4.32Å; V35-F281 HydrophobicContact CG1-CZ 4.03Å; V35-A284 HydrophobicContact CG2-CB 3.39Å
36L57.6Low56.1Low57 Ų5790.1 Ų90.130%0.29847%0.47SS..THydrogen-bonded Turntrans61.640.5178-50178.2000114.2M38 E98 F277 F281L36-M38 PolarHBondContact O-N 3.37Å; L36-E98 PolarHBondContact N-OE1 3.25Å; L36-F277 HydrophobicContact CD1-CD1 3.35Å; L36-F277 HydrophobicContact CD1-CE1 3.68Å; L36-F277 HydrophobicContact CD1-CG 4.39Å; L36-F277 HydrophobicContact CD2-CD1 3.42Å; L36-F277 VanDerWaalsContact CD2-CD1 3.42Å; L36-F277 HydrophobicContact CD2-CE1 3.41Å; L36-F277 VanDerWaalsContact CD2-CE1 3.41Å; L36-F277 HydrophobicContact CG-CD1 3.95Å; L36-F277 HydrophobicContact CG-CE1 4.08Å; L36-F281 HydrophobicContact CD1-CE2 3.75Å; L36-F281 HydrophobicContact CD1-CZ 3.89Å
37G54.2Low58.4Low63 Ų6384.4 Ų84.465%0.64945%0.448SS*.THydrogen-bonded Turntrans72-7.5-178.500000114.8V35V35-G37 PolarHBondContact O-N 2.83Å
38M57.9Low60.4Low129 Ų12978.4 Ų78.464%0.63542%0.417SS*.EExtended strand (participates in β ladder)trans-86.4121.3170.5-63.7-174.371.900109.3V34 V35 L36 L40V34-M38 WeakPolarHBondContact CA-O 3.5Å; V35-M38 PolarHBondContact N-O 3.15Å; V35-M38 VanDerWaalsContact N-O 3.08Å; V35-M38 PolarHBondContact O-N 2.98Å; L36-M38 PolarHBondContact O-N 3.37Å; M38-L40 PolarHBondContact O-N 2.95Å
39N65.2Low62.9Low50 Ų5071.5 Ų71.527%0.26739%0.388SS..EExtended strand (participates in β ladder)trans-79.898.5173.9-165-38.8000108.7D32 V34 S41D32-N39 VanDerWaalsContact CG-ND2 3.26Å; D32-N39 PolarHBondContact OD1-ND2 3.22Å; D32-N39 PolarHBondContact OD1-OD1 2.89Å; V34-N39 HydrophobicContact CG2-CB 4.47Å; N39-S41 PolarHBondContact O-N 3.24Å; N39-S41 WeakPolarHBondContact OD1-CB 3.42Å; N39-S41 PolarHBondContact OD1-N 3.06Å; N39-S41 VanDerWaalsContact OD1-N 3.14Å; N39-S41 PolarHBondContact OD1-OG 2.91Å
40L65.6Low65.2Low8 Ų873.7 Ų73.74%0.04239%0.386CS..G310 helixtrans-67.5-13.8-179.2-84.590.6000112.4V33 V35 M38 K42 F43 Q48 I51V33-L40 PolarHBondContact O-N 3.41Å; V33-L40 VanDerWaalsContact O-N 3.11Å; V35-L40 HydrophobicContact CB-CD1 3.63Å; V35-L40 HydrophobicContact CG2-CD1 3.79Å; M38-L40 PolarHBondContact O-N 2.95Å; L40-K42 PolarHBondContact O-N 2.9Å; L40-K42 VanDerWaalsContact O-N 3.1Å; L40-F43 PolarHBondContact O-N 3.25Å; L40-F43 VanDerWaalsContact O-N 3.08Å; L40-Q48 HydrophobicContact CB-CG 4.31Å; L40-Q48 HydrophobicContact CD2-CB 4.45Å; L40-Q48 WeakPolarHBondContact O-CG 3.14Å; L40-Q48 PolarHBondContact O-NE2 3.15Å; L40-I51 HydrophobicContact CD2-CB 4.39Å; L40-I51 HydrophobicContact CD2-CG2 4.01Å
41S60.4Low67.4Low36 Ų3672.6 Ų72.625%0.25238%0.377SS..G310 helixtrans-67.6-11.1-176.4-53.60000113.9D31 V33 N39D31-S41 PolarHBondContact O-OG 3.23Å; V33-S41 PolarHBondContact N-OG 2.69Å; N39-S41 PolarHBondContact O-N 3.24Å; N39-S41 WeakPolarHBondContact OD1-CB 3.42Å; N39-S41 PolarHBondContact OD1-N 3.06Å; N39-S41 VanDerWaalsContact OD1-N 3.14Å; N39-S41 PolarHBondContact OD1-OG 2.91Å
42K62.8Low69.2Low185 Ų18568.2 Ų68.280%0.80435%0.353SS*.G310 helixtrans-76.6-19.3172.5-65.2-172.8-178.7-178.10113.9L40L40-K42 PolarHBondContact O-N 2.9Å; L40-K42 VanDerWaalsContact O-N 3.1Å
43F71.2Confident70.9Confident104 Ų10465.3 Ų65.346%0.45634%0.339SS..SBendtrans-99.3156.5-174.9-66.1-74000113.1L40 T47 Q48 I51L40-F43 PolarHBondContact O-N 3.25Å; L40-F43 VanDerWaalsContact O-N 3.08Å; F43-T47 HydrophobicContact CB-CG2 4.19Å; F43-T47 HydrophobicContact CD1-CG2 4.23Å; F43-T47 HydrophobicContact CG-CG2 4.36Å; F43-Q48 HydrophobicContact CB-CG 4.26Å; F43-Q48 PolarHBondContact O-NE2 3Å; F43-Q48 VanDerWaalsContact O-NE2 3.08Å; F43-I51 HydrophobicContact CD2-CD1 4.44Å
44N79.8Confident72.3Confident111 Ų11167.6 Ų67.659%0.59436%0.358SS*.  trans-60.8149.5174.5-168.810.2000111L46 T47 Q48N44-L46 PolarHBondContact O-N 2.89Å; N44-L46 VanDerWaalsContact O-N 3.13Å; N44-T47 WeakPolarHBondContact O-CA 3.31Å; N44-T47 WeakPolarHBondContact O-CB 3.24Å; N44-T47 PolarHBondContact O-N 2.88Å; N44-Q48 PolarHBondContact O-N 3.49Å
45K76.8Confident73.7Confident135 Ų13566.5 Ų66.559%0.58735%0.353SS*.Hα-helixtrans-55.7-35.2-177.7-68.3-170.3179.2-175.80112.9Q48 F49 F289K45-Q48 PolarHBondContact O-N 3.43Å; K45-F49 PolarHBondContact O-N 3.07Å; K45-F289 WeakPolarHBondContact O-CZ 3.37Å
46L75.9Confident75Confident102 Ų10266.4 Ų66.453%0.53435%0.353SS..Hα-helixtrans-65.5-44.5175.1-73.1171.6000111.9N44 F49 F50N44-L46 PolarHBondContact O-N 2.89Å; N44-L46 VanDerWaalsContact O-N 3.13Å; L46-F49 WeakPolarHBondContact O-CB 3.36Å; L46-F49 PolarHBondContact O-N 2.86Å; L46-F50 WeakPolarHBondContact O-CD2 3.2Å; L46-F50 PolarHBondContact O-N 3.29Å
47T79.4Confident76.4Confident61 Ų6165.6 Ų65.637%0.37435%0.347SS..Hα-helixtrans-64-41.4176.5-47.10000111.2F43 N44 F49 F50 I51F43-T47 HydrophobicContact CB-CG2 4.19Å; F43-T47 HydrophobicContact CD1-CG2 4.23Å; F43-T47 HydrophobicContact CG-CG2 4.36Å; N44-T47 WeakPolarHBondContact O-CA 3.31Å; N44-T47 WeakPolarHBondContact O-CB 3.24Å; N44-T47 PolarHBondContact O-N 2.88Å; T47-F49 VanDerWaalsContact C-N 3.3Å; T47-F49 PolarHBondContact O-N 3.01Å; T47-F50 PolarHBondContact O-N 2.91Å; T47-I51 HydrophobicContact CG2-CD1 3.88Å; T47-I51 HydrophobicContact CG2-CG1 4.41Å; T47-I51 WeakPolarHBondContact O-CB 3.42Å; T47-I51 VanDerWaalsContact O-CG1 3.26Å; T47-I51 WeakPolarHBondContact O-CG1 3.39Å; T47-I51 PolarHBondContact O-N 2.94Å
48Q81Confident78Confident18 Ų1866.5 Ų66.58%0.08434%0.34CS..Hα-helixtrans-58.4-42.6172.8-65.9178.3-2.100111.6L40 F43 N44 K45 C52L40-Q48 HydrophobicContact CB-CG 4.31Å; L40-Q48 HydrophobicContact CD2-CB 4.45Å; L40-Q48 WeakPolarHBondContact O-CG 3.14Å; L40-Q48 PolarHBondContact O-NE2 3.15Å; F43-Q48 HydrophobicContact CB-CG 4.26Å; F43-Q48 PolarHBondContact O-NE2 3Å; F43-Q48 VanDerWaalsContact O-NE2 3.08Å; N44-Q48 PolarHBondContact O-N 3.49Å; K45-Q48 PolarHBondContact O-N 3.43Å; Q48-C52 WeakPolarHBondContact O-CB 3.41Å; Q48-C52 PolarHBondContact O-N 3.26Å; Q48-C52 PolarHBondContact O-SG 2.76Å
49F83Confident79.6Confident46 Ų4662.8 Ų62.820%0.20232%0.32CS..Hα-helixtrans-60.2-51.4175.5179.9-103.8000111.4K45 L46 T47 I51 C52 V53 L285 F289 I293 V297K45-F49 PolarHBondContact O-N 3.07Å; L46-F49 WeakPolarHBondContact O-CB 3.36Å; L46-F49 PolarHBondContact O-N 2.86Å; T47-F49 VanDerWaalsContact C-N 3.3Å; T47-F49 PolarHBondContact O-N 3.01Å; F49-I51 PolarHBondContact O-N 2.8Å; F49-C52 PolarHBondContact O-N 3.33Å; F49-V53 HydrophobicContact CD1-CG2 4.14Å; F49-V53 HydrophobicContact CD2-CG2 4.17Å; F49-V53 HydrophobicContact CE1-CG2 3.79Å; F49-V53 HydrophobicContact CE2-CG2 3.8Å; F49-V53 HydrophobicContact CG-CG2 4.33Å; F49-V53 HydrophobicContact CZ-CG2 3.61Å; F49-V53 WeakPolarHBondContact O-CB 3.17Å; F49-V53 WeakPolarHBondContact O-CG2 3.49Å; F49-V53 PolarHBondContact O-N 3.05Å; F49-L285 HydrophobicContact CD2-CD1 4.03Å; F49-L285 HydrophobicContact CE2-CD1 4.26Å; F49-F289 HydrophobicContact CB-CE1 4.21Å; F49-F289 HydrophobicContact CB-CE2 3.91Å; F49-F289 HydrophobicContact CB-CZ 3.57Å; F49-F289 HydrophobicContact CD2-CD1 4.49Å; F49-F289 HydrophobicContact CD2-CD2 4.22Å; F49-F289 HydrophobicContact CD2-CE1 4.39Å; F49-F289 HydrophobicContact CD2-CE2 4.09Å; F49-F289 HydrophobicContact CD2-CG 4.41Å; F49-F289 HydrophobicContact CD2-CZ 4.2Å; F49-F289 HydrophobicContact CG-CZ 4.37Å; F49-I293 HydrophobicContact CD2-CG2 4.43Å; F49-I293 HydrophobicContact CE2-CG2 3.68Å; F49-V297 HydrophobicContact CE2-CG2 4.16Å; F49-V297 HydrophobicContact CZ-CG2 4.18Å
50F83.9Confident80.6Confident134 Ų13461.5 Ų61.559%0.58831%0.312SS*.Hα-helixtrans-62.4-40.8179.9-77.2-67.7000112.9L46 T47 V53 A54L46-F50 WeakPolarHBondContact O-CD2 3.2Å; L46-F50 PolarHBondContact O-N 3.29Å; T47-F50 PolarHBondContact O-N 2.91Å; F50-V53 PolarHBondContact O-N 3.25Å; F50-A54 VanDerWaalsContact O-CB 3.25Å; F50-A54 WeakPolarHBondContact O-CB 3.35Å; F50-A54 PolarHBondContact O-N 3.19Å
51I86.3Confident81.4Confident63 Ų6363.8 Ų63.832%0.32332%0.323SS..Hα-helixtrans-62.4-48.1175.9-69167.3000110.4L40 F43 T47 F49 V53 A54 G55L40-I51 HydrophobicContact CD2-CB 4.39Å; L40-I51 HydrophobicContact CD2-CG2 4.01Å; F43-I51 HydrophobicContact CD2-CD1 4.44Å; T47-I51 HydrophobicContact CG2-CD1 3.88Å; T47-I51 HydrophobicContact CG2-CG1 4.41Å; T47-I51 WeakPolarHBondContact O-CB 3.42Å; T47-I51 VanDerWaalsContact O-CG1 3.26Å; T47-I51 WeakPolarHBondContact O-CG1 3.39Å; T47-I51 PolarHBondContact O-N 2.94Å; F49-I51 PolarHBondContact O-N 2.8Å; I51-V53 PolarHBondContact O-N 2.87Å; I51-A54 PolarHBondContact O-N 3.26Å; I51-G55 PolarHBondContact O-N 2.92Å
52C85.7Confident82.6Confident0 Ų065.7 Ų65.70%033%0.33CS..Hα-helixtrans-62.4-43.3178-73.10000111.7Q48 F49 G55 V56 L285Q48-C52 WeakPolarHBondContact O-CB 3.41Å; Q48-C52 PolarHBondContact O-N 3.26Å; Q48-C52 PolarHBondContact O-SG 2.76Å; F49-C52 PolarHBondContact O-N 3.33Å; C52-G55 PolarHBondContact O-N 3.34Å; C52-V56 WeakPolarHBondContact O-CB 3.25Å; C52-V56 VanDerWaalsContact O-CG2 3.27Å; C52-V56 WeakPolarHBondContact O-CG2 3.39Å; C52-V56 PolarHBondContact O-N 2.98Å; C52-L285 HydrophobicContact CB-CB 4.5Å; C52-L285 HydrophobicContact CB-CD1 3.82Å
53V85.1Confident83.7Confident29 Ų2958.4 Ų58.418%0.17630%0.298CS..Hα-helixtrans-62.4-49.9176.4171.60000110.4F49 F50 I51 G55 V56 F57 V297F49-V53 HydrophobicContact CD1-CG2 4.14Å; F49-V53 HydrophobicContact CD2-CG2 4.17Å; F49-V53 HydrophobicContact CE1-CG2 3.79Å; F49-V53 HydrophobicContact CE2-CG2 3.8Å; F49-V53 HydrophobicContact CG-CG2 4.33Å; F49-V53 HydrophobicContact CZ-CG2 3.61Å; F49-V53 WeakPolarHBondContact O-CB 3.17Å; F49-V53 WeakPolarHBondContact O-CG2 3.49Å; F49-V53 PolarHBondContact O-N 3.05Å; F50-V53 PolarHBondContact O-N 3.25Å; I51-V53 PolarHBondContact O-N 2.87Å; V53-G55 VanDerWaalsContact C-N 3.33Å; V53-G55 PolarHBondContact O-N 3.35Å; V53-V56 PolarHBondContact O-N 3.17Å; V53-F57 HydrophobicContact CG1-CD2 3.82Å; V53-F57 HydrophobicContact CG1-CE2 3.81Å; V53-F57 WeakPolarHBondContact O-CD2 3.17Å; V53-F57 PolarHBondContact O-N 3.26Å; V53-V297 HydrophobicContact CB-CG1 4.37Å; V53-V297 HydrophobicContact CG1-CG1 4.21Å; V53-V297 HydrophobicContact CG2-CG1 3.89Å; V53-V297 HydrophobicContact CG2-CG2 3.86Å
54A86.3Confident84Confident55 Ų5553.9 Ų53.946%0.45528%0.28SS..Hα-helixtrans-58.5-44.8178.400000111.7F50 I51 F57 V58F50-A54 VanDerWaalsContact O-CB 3.25Å; F50-A54 WeakPolarHBondContact O-CB 3.35Å; F50-A54 PolarHBondContact O-N 3.19Å; I51-A54 PolarHBondContact O-N 3.26Å; A54-F57 PolarHBondContact O-N 3.42Å; A54-V58 WeakPolarHBondContact O-CG2 3.49Å; A54-V58 PolarHBondContact O-N 3.3Å
55G88.7Confident84Confident8 Ų855.8 Ų55.88%0.08228%0.28CS..Hα-helixtrans-59.8-48.3174.800000112.4I51 C52 V53 F57 V58 F59I51-G55 PolarHBondContact O-N 2.92Å; C52-G55 PolarHBondContact O-N 3.34Å; V53-G55 VanDerWaalsContact C-N 3.33Å; V53-G55 PolarHBondContact O-N 3.35Å; G55-F57 VanDerWaalsContact C-N 3.3Å; G55-F57 PolarHBondContact O-N 3.03Å; G55-V58 PolarHBondContact O-N 3.43Å; G55-F59 WeakPolarHBondContact O-CB 3.26Å; G55-F59 VanDerWaalsContact O-CD2 3.25Å; G55-F59 WeakPolarHBondContact O-CD2 3.41Å; G55-F59 PolarHBondContact O-N 3.24Å
56V88.3Confident84.2Confident0 Ų050.1 Ų50.10%026%0.256CS..Hα-helixtrans-56.7-45.3174.6168.70000110.7C52 V53 Y60 F281 V282 V297 T298C52-V56 WeakPolarHBondContact O-CB 3.25Å; C52-V56 VanDerWaalsContact O-CG2 3.27Å; C52-V56 WeakPolarHBondContact O-CG2 3.39Å; C52-V56 PolarHBondContact O-N 2.98Å; V53-V56 PolarHBondContact O-N 3.17Å; V56-Y60 HydrophobicContact CG1-CD2 3.93Å; V56-Y60 HydrophobicContact CG1-CE2 4.49Å; V56-Y60 WeakPolarHBondContact O-CB 3.33Å; V56-Y60 WeakPolarHBondContact O-CD2 3.47Å; V56-Y60 PolarHBondContact O-N 3.28Å; V56-Y60 VanDerWaalsContact O-N 3.15Å; V56-F281 HydrophobicContact CG2-CB 3.75Å; V56-V282 HydrophobicContact CG1-CG2 4.39Å; V56-V282 HydrophobicContact CG2-CG2 3.78Å; V56-V297 HydrophobicContact CB-CG1 4.39Å; V56-V297 HydrophobicContact CG1-CG1 4.09Å; V56-T298 HydrophobicContact CG1-CG2 4.14Å
57F86.9Confident84.3Confident41 Ų4147.1 Ų47.118%0.1824%0.239CC..Hα-helixtrans-65.8-54.1-179-87.9-109.8000111.7V53 A54 G55 L61 V297 R301 M304V53-F57 HydrophobicContact CG1-CD2 3.82Å; V53-F57 HydrophobicContact CG1-CE2 3.81Å; V53-F57 WeakPolarHBondContact O-CD2 3.17Å; V53-F57 PolarHBondContact O-N 3.26Å; A54-F57 PolarHBondContact O-N 3.42Å; G55-F57 VanDerWaalsContact C-N 3.3Å; G55-F57 PolarHBondContact O-N 3.03Å; F57-L61 WeakPolarHBondContact O-CB 3.48Å; F57-L61 WeakPolarHBondContact O-CG 3.33Å; F57-L61 PolarHBondContact O-N 3.01Å; F57-V297 HydrophobicContact CD2-CG1 4.47Å; F57-V297 HydrophobicContact CE2-CG1 4Å; F57-R301 HydrophobicContact CD1-CB 4.37Å; F57-R301 HydrophobicContact CD1-CG 4.49Å; F57-R301 HydrophobicContact CD2-CB 4.29Å; F57-R301 HydrophobicContact CE1-CB 4.1Å; F57-R301 HydrophobicContact CE2-CB 4.05Å; F57-R301 HydrophobicContact CG-CB 4.48Å; F57-R301 HydrophobicContact CZ-CB 3.96Å; F57-M304 HydrophobicContact CD1-SD 4.16Å; F57-M304 HydrophobicContact CE1-CE 4.36Å; F57-M304 HydrophobicContact CE1-CG 4.23Å; F57-M304 HydrophobicContact CE1-SD 3.55Å; F57-M304 VanDerWaalsContact CE1-SD 3.55Å
58V88.8Confident84Confident82 Ų8246.3 Ų46.350%0.49723%0.231SC..Hα-helixtrans-59.8-56.1-176.7173.10000111.2A54 G55 Y60 L61 I62A54-V58 WeakPolarHBondContact O-CG2 3.49Å; A54-V58 PolarHBondContact O-N 3.3Å; G55-V58 PolarHBondContact O-N 3.43Å; V58-Y60 PolarHBondContact O-N 2.96Å; V58-L61 PolarHBondContact O-N 3.36Å; V58-I62 HydrophobicContact CG1-CD1 4.05Å; V58-I62 VanDerWaalsContact O-CG1 3.3Å; V58-I62 WeakPolarHBondContact O-CG1 3.36Å; V58-I62 PolarHBondContact O-N 3.15Å
59F90.4Very high83.7Confident51 Ų5148.4 Ų48.422%0.22424%0.243CC..Hα-helixtrans-67.5-40.3-173.9-73.9-68.1000112.4G55 Y63 F277 F281G55-F59 WeakPolarHBondContact O-CB 3.26Å; G55-F59 VanDerWaalsContact O-CD2 3.25Å; G55-F59 WeakPolarHBondContact O-CD2 3.41Å; G55-F59 PolarHBondContact O-N 3.24Å; F59-Y63 WeakPolarHBondContact O-CB 3.3Å; F59-Y63 PolarHBondContact O-N 2.85Å; F59-F277 HydrophobicContact CB-CB 4.3Å; F59-F277 HydrophobicContact CD1-CB 3.53Å; F59-F277 HydrophobicContact CD1-CD2 4.09Å; F59-F277 HydrophobicContact CD1-CG 4.12Å; F59-F277 HydrophobicContact CD2-CB 3.92Å; F59-F277 HydrophobicContact CE1-CB 3.73Å; F59-F277 AromaticContact CE1-CD2 3.71Å; F59-F277 HydrophobicContact CE1-CD2 3.71Å; F59-F277 AromaticContact CE1-CG 3.85Å; F59-F277 HydrophobicContact CE1-CG 3.85Å; F59-F277 HydrophobicContact CE2-CB 4.13Å; F59-F277 HydrophobicContact CG-CB 3.64Å; F59-F277 HydrophobicContact CZ-CB 4.03Å; F59-F277 HydrophobicContact CZ-CD2 4.34Å; F59-F277 HydrophobicContact CZ-CG 4.14Å; F59-F281 AromaticContact CD2-CD2 3.82Å; F59-F281 HydrophobicContact CD2-CD2 3.82Å; F59-F281 AromaticContact CD2-CE2 3.62Å; F59-F281 HydrophobicContact CD2-CE2 3.62Å; F59-F281 HydrophobicContact CE2-CD2 4.15Å; F59-F281 AromaticContact CE2-CE2 3.45Å; F59-F281 HydrophobicContact CE2-CE2 3.45Å; F59-F281 VanDerWaalsContact CE2-CE2 3.45Å; F59-F281 HydrophobicContact CE2-CZ 4.32Å
60Y85.6Confident83.4Confident23 Ų2346.5 Ų46.59%0.0924%0.235CC..Hα-helixtrans-82-19.6-178.6-84.9-64.7000114.8V56 V58 Y63 G64 G278 I279 V282 R301V56-Y60 HydrophobicContact CG1-CD2 3.93Å; V56-Y60 HydrophobicContact CG1-CE2 4.49Å; V56-Y60 WeakPolarHBondContact O-CB 3.33Å; V56-Y60 WeakPolarHBondContact O-CD2 3.47Å; V56-Y60 PolarHBondContact O-N 3.28Å; V56-Y60 VanDerWaalsContact O-N 3.15Å; V58-Y60 PolarHBondContact O-N 2.96Å; Y60-Y63 AromaticContact CD1-CD1 3.88Å; Y60-Y63 HydrophobicContact CD1-CD1 3.88Å; Y60-Y63 HydrophobicContact CD1-CG 4.11Å; Y60-Y63 HydrophobicContact CE1-CD1 4.4Å; Y60-G64 PolarHBondContact O-N 3.32Å; Y60-G278 WeakPolarHBondContact CE2-O 3.33Å; Y60-G278 VanDerWaalsContact CZ-C 3.48Å; Y60-I279 VanDerWaalsContact OH-CA 3.29Å; Y60-I279 WeakPolarHBondContact OH-CA 3.45Å; Y60-I279 PolarHBondContact OH-N 3.26Å; Y60-V282 HydrophobicContact CD2-CG2 4.44Å; Y60-V282 HydrophobicContact CE2-CG2 3.52Å; Y60-R301 PolarHBondContact O-NH1 3.33Å
61L82.5Confident82.7Confident55 Ų5542.3 Ų42.329%0.28822%0.216SC..Hα-helixtrans-67.6-46.7167.7-78.1177.3000109.9F57 V58 Y63 G64 Y65 R301 T305F57-L61 WeakPolarHBondContact O-CB 3.48Å; F57-L61 WeakPolarHBondContact O-CG 3.33Å; F57-L61 PolarHBondContact O-N 3.01Å; V58-L61 PolarHBondContact O-N 3.36Å; L61-Y63 VanDerWaalsContact C-N 3.34Å; L61-Y63 PolarHBondContact O-N 3.02Å; L61-G64 PolarHBondContact O-N 3.18Å; L61-Y65 PolarHBondContact O-N 3.04Å; L61-R301 HydrophobicContact CD2-CG 4.48Å; L61-T305 VanDerWaalsContact CD2-OG1 3.24Å; L61-T305 WeakPolarHBondContact CD2-OG1 3.35Å
62I86.2Confident81.8Confident76 Ų7643.4 Ų43.439%0.3923%0.229SC..Hα-helixtrans-60.8-45.6174.5-60.3165.2000110.2V58 G64 Y65 L66 T274V58-I62 HydrophobicContact CG1-CD1 4.05Å; V58-I62 VanDerWaalsContact O-CG1 3.3Å; V58-I62 WeakPolarHBondContact O-CG1 3.36Å; V58-I62 PolarHBondContact O-N 3.15Å; I62-G64 VanDerWaalsContact C-N 3.33Å; I62-G64 PolarHBondContact O-N 3.01Å; I62-Y65 PolarHBondContact O-N 2.61Å; I62-L66 HydrophobicContact CG2-CD1 3.98Å; I62-L66 HydrophobicContact CG2-CG 4.3Å; I62-L66 WeakPolarHBondContact O-CB 3.43Å; I62-L66 WeakPolarHBondContact O-CG 3.3Å; I62-L66 PolarHBondContact O-N 3.15Å; I62-T274 HydrophobicContact CB-CG2 4.27Å; I62-T274 HydrophobicContact CG2-CG2 3.71Å
63Y85.8Confident81.1Confident33 Ų3346.9 Ų46.913%0.12925%0.25CS..Hα-helixtrans-55.2-47174.3175.2-94.5000112.1F59 Y60 L61 L66 Q67 Q87 F271 G275F59-Y63 WeakPolarHBondContact O-CB 3.3Å; F59-Y63 PolarHBondContact O-N 2.85Å; Y60-Y63 AromaticContact CD1-CD1 3.88Å; Y60-Y63 HydrophobicContact CD1-CD1 3.88Å; Y60-Y63 HydrophobicContact CD1-CG 4.11Å; Y60-Y63 HydrophobicContact CE1-CD1 4.4Å; L61-Y63 VanDerWaalsContact C-N 3.34Å; L61-Y63 PolarHBondContact O-N 3.02Å; Y63-L66 PolarHBondContact O-N 3.47Å; Y63-Q67 VanDerWaalsContact O-CB 3.3Å; Y63-Q67 WeakPolarHBondContact O-CB 3.37Å; Y63-Q67 PolarHBondContact O-N 2.95Å; Y63-Q87 PolarHBondContact OH-NE2 3.42Å; Y63-F271 HydrophobicContact CD1-CE2 4.46Å; Y63-F271 AromaticContact CD2-CD2 3.71Å; Y63-F271 HydrophobicContact CD2-CD2 3.71Å; Y63-F271 AromaticContact CD2-CE2 3.6Å; Y63-F271 HydrophobicContact CD2-CE2 3.6Å; Y63-F271 HydrophobicContact CD2-CG 4.46Å; Y63-F271 HydrophobicContact CD2-CZ 4.29Å; Y63-F271 WeakPolarHBondContact CD2-O 3.14Å; Y63-F271 HydrophobicContact CE1-CE2 4.03Å; Y63-F271 HydrophobicContact CE1-CZ 4.46Å; Y63-F271 HydrophobicContact CE2-CD1 4.4Å; Y63-F271 AromaticContact CE2-CD2 3.56Å; Y63-F271 HydrophobicContact CE2-CD2 3.56Å; Y63-F271 AromaticContact CE2-CE1 4Å; Y63-F271 HydrophobicContact CE2-CE1 4Å; Y63-F271 AromaticContact CE2-CE2 3.04Å; Y63-F271 HydrophobicContact CE2-CE2 3.04Å; Y63-F271 HydrophobicContact CE2-CG 4.22Å; Y63-F271 AromaticContact CE2-CZ 3.32Å; Y63-F271 HydrophobicContact CE2-CZ 3.32Å; Y63-F271 HydrophobicContact CG-CD2 4.48Å; Y63-F271 HydrophobicContact CG-CE2 4.28Å; Y63-F271 AromaticContact CZ-CE2 3.29Å; Y63-F271 AromaticContact CZ-CZ 3.42Å; Y63-F271 VanDerWaalsContact CZ-CZ 3.42Å; Y63-F271 WeakPolarHBondContact OH-CZ 3.33Å; Y63-G275 VanDerWaalsContact CD2-CA 3.47Å
64G77.9Confident79.6Confident8 Ų854.3 Ų54.38%0.08228%0.283CS..Hα-helixtrans-63.4-43.1179.700000112.4Y60 L61 I62 Q67 E68Y60-G64 PolarHBondContact O-N 3.32Å; L61-G64 PolarHBondContact O-N 3.18Å; I62-G64 VanDerWaalsContact C-N 3.33Å; I62-G64 PolarHBondContact O-N 3.01Å; G64-Q67 WeakPolarHBondContact O-CB 3.2Å; G64-Q67 PolarHBondContact O-N 3.15Å; G64-E68 PolarHBondContact O-N 3.14Å
65Y79.6Confident78.4Confident151 Ų15153.7 Ų53.759%0.59228%0.283SS*.Hα-helixtrans-62.1-47.9174.9175-99.6000112L61 I62 Q67 E68 L69L61-Y65 PolarHBondContact O-N 3.04Å; I62-Y65 PolarHBondContact O-N 2.61Å; Y65-Q67 VanDerWaalsContact C-N 3.29Å; Y65-Q67 PolarHBondContact O-N 3.42Å; Y65-E68 PolarHBondContact O-N 2.81Å; Y65-L69 WeakPolarHBondContact O-CB 3.24Å; Y65-L69 PolarHBondContact O-N 3.24Å
66L81.4Confident77.1Confident16 Ų1654.2 Ų54.28%0.08428%0.282CS..Hα-helixtrans-62.4-38176.5-70.1176.1000111.7I62 Y63 L69 I70 L270 F271 T274I62-L66 HydrophobicContact CG2-CD1 3.98Å; I62-L66 HydrophobicContact CG2-CG 4.3Å; I62-L66 WeakPolarHBondContact O-CB 3.43Å; I62-L66 WeakPolarHBondContact O-CG 3.3Å; I62-L66 PolarHBondContact O-N 3.15Å; Y63-L66 PolarHBondContact O-N 3.47Å; L66-L69 PolarHBondContact O-N 3.31Å; L66-I70 WeakPolarHBondContact O-CB 3.24Å; L66-I70 WeakPolarHBondContact O-CD1 3.4Å; L66-I70 WeakPolarHBondContact O-CG1 3.44Å; L66-I70 PolarHBondContact O-N 3.12Å; L66-L270 HydrophobicContact CD1-CB 3.86Å; L66-F271 HydrophobicContact CB-CB 4.42Å; L66-F271 HydrophobicContact CB-CD2 4.31Å; L66-T274 HydrophobicContact CD1-CG2 4.45Å
67Q77.9Confident75.8Confident39 Ų3961.9 Ų61.918%0.18232%0.316CS..Hα-helixtrans-59.5-50.3174.8-165.2179.7-45.900110.9Y63 G64 Y65 L69 I70 F71 F271Y63-Q67 VanDerWaalsContact O-CB 3.3Å; Y63-Q67 WeakPolarHBondContact O-CB 3.37Å; Y63-Q67 PolarHBondContact O-N 2.95Å; G64-Q67 WeakPolarHBondContact O-CB 3.2Å; G64-Q67 PolarHBondContact O-N 3.15Å; Y65-Q67 VanDerWaalsContact C-N 3.29Å; Y65-Q67 PolarHBondContact O-N 3.42Å; Q67-L69 PolarHBondContact O-N 2.85Å; Q67-I70 PolarHBondContact O-N 3.07Å; Q67-F71 HydrophobicContact CG-CD2 3.71Å; Q67-F71 HydrophobicContact CG-CE2 3.68Å; Q67-F71 WeakPolarHBondContact O-CD2 3.17Å; Q67-F71 PolarHBondContact O-N 3.29Å; Q67-F271 HydrophobicContact CB-CD2 4.35Å; Q67-F271 HydrophobicContact CB-CE2 3.73Å; Q67-F271 HydrophobicContact CG-CE2 3.91Å; Q67-F271 HydrophobicContact CG-CZ 4.39Å
68E72.4Confident74.6Confident45 Ų4565.5 Ų65.521%0.2135%0.346CS..Hα-helixtrans-63.3-40.9179.4-172.4165.7-163.500111.8G64 Y65 I70 F71 S72 F313G64-E68 PolarHBondContact O-N 3.14Å; Y65-E68 PolarHBondContact O-N 2.81Å; E68-I70 PolarHBondContact O-N 2.91Å; E68-F71 PolarHBondContact O-N 2.9Å; E68-S72 VanDerWaalsContact O-CB 3.28Å; E68-S72 WeakPolarHBondContact O-CB 3.13Å; E68-S72 PolarHBondContact O-N 3.41Å; E68-S72 PolarHBondContact O-OG 3.47Å; E68-F313 WeakPolarHBondContact OE1-CE2 3.42Å
69L75.1Confident73.8Confident61 Ų6162.1 Ų62.132%0.31933%0.326SS..Hα-helixtrans-59.4-46.4174.5-168.178.3000111.6Y65 L66 Q67 S72 Y267Y65-L69 WeakPolarHBondContact O-CB 3.24Å; Y65-L69 PolarHBondContact O-N 3.24Å; L66-L69 PolarHBondContact O-N 3.31Å; Q67-L69 PolarHBondContact O-N 2.85Å; L69-S72 PolarHBondContact O-N 3.2Å; L69-Y267 HydrophobicContact CD2-CD1 4.42Å; L69-Y267 HydrophobicContact CD2-CE1 4.08Å
70I76.5Confident73.2Confident7 Ų760 Ų604%0.03632%0.319CS..Hα-helixtrans-64.9-43.9179.7-69164.3000111L66 Q67 E68 S72 V73 F76 L83 F271L66-I70 WeakPolarHBondContact O-CB 3.24Å; L66-I70 WeakPolarHBondContact O-CD1 3.4Å; L66-I70 WeakPolarHBondContact O-CG1 3.44Å; L66-I70 PolarHBondContact O-N 3.12Å; Q67-I70 PolarHBondContact O-N 3.07Å; E68-I70 PolarHBondContact O-N 2.91Å; I70-S72 VanDerWaalsContact C-N 3.3Å; I70-S72 PolarHBondContact O-N 2.82Å; I70-V73 PolarHBondContact O-N 3.44Å; I70-F76 HydrophobicContact CG2-CD1 3.84Å; I70-F76 HydrophobicContact CG2-CE1 4.28Å; I70-F76 HydrophobicContact CG2-CG 4.32Å; I70-F76 VanDerWaalsContact O-CB 3.3Å; I70-F76 WeakPolarHBondContact O-CB 3.38Å; I70-L83 HydrophobicContact CD1-CD1 4.4Å; I70-L83 HydrophobicContact CG2-CD1 3.89Å; I70-L83 HydrophobicContact CG2-CD2 4.2Å; I70-F271 HydrophobicContact CD1-CB 3.88Å; I70-F271 HydrophobicContact CD1-CD2 4.29Å; I70-F271 HydrophobicContact CD1-CG 4.03Å
71F69.8Low73Confident45 Ų4563.3 Ų63.320%0.19733%0.331CS..Hα-helixtrans-77.2-13.8-179.9-78.3-68000114.4Q67 E68 V73 K77Q67-F71 HydrophobicContact CG-CD2 3.71Å; Q67-F71 HydrophobicContact CG-CE2 3.68Å; Q67-F71 WeakPolarHBondContact O-CD2 3.17Å; Q67-F71 PolarHBondContact O-N 3.29Å; E68-F71 PolarHBondContact O-N 2.9Å; F71-V73 VanDerWaalsContact C-N 3.34Å; F71-K77 HydrophobicContact CD1-CG 4.15Å
72S68.1Low73.1Confident86 Ų8662 Ų6260%0.60132%0.323SS*.Hα-helixtrans-78.9-17.2173.2-62.90000112.9E68 L69 I70 E74E68-S72 VanDerWaalsContact O-CB 3.28Å; E68-S72 WeakPolarHBondContact O-CB 3.13Å; E68-S72 PolarHBondContact O-N 3.41Å; E68-S72 PolarHBondContact O-OG 3.47Å; L69-S72 PolarHBondContact O-N 3.2Å; I70-S72 VanDerWaalsContact C-N 3.3Å; I70-S72 PolarHBondContact O-N 2.82Å; S72-E74 PolarHBondContact O-N 3.44Å
73V69.2Low72.9Confident73 Ų7358.9 Ų58.944%0.44231%0.307SS..SBendtrans-73.5124.3174.7-177.10000109.6I70 F71 G75 F76I70-V73 PolarHBondContact O-N 3.44Å; F71-V73 VanDerWaalsContact C-N 3.34Å; V73-G75 PolarHBondContact O-N 3Å; V73-F76 HydrophobicContact CB-CB 4.44Å; V73-F76 HydrophobicContact CB-CD2 3.83Å; V73-F76 HydrophobicContact CG1-CD2 3.77Å; V73-F76 HydrophobicContact CG1-CE2 4.36Å; V73-F76 WeakPolarHBondContact O-CB 3.15Å; V73-F76 PolarHBondContact O-N 2.83Å; V73-F76 VanDerWaalsContact O-N 3.14Å
74E54.6Low72.9Confident185 Ų18557.9 Ų57.986%0.86430%0.304SS*.THydrogen-bonded Turntrans-56.1130.1178.9-67.7-176.2159.800111.3S72S72-E74 PolarHBondContact O-N 3.44Å
75G59.8Low73.4Confident43 Ų4358.2 Ų58.244%0.44330%0.304SS..THydrogen-bonded Turntrans90-15.8-177.700000116V73 K77V73-G75 PolarHBondContact O-N 3Å; G75-K77 PolarHBondContact O-N 3.36Å
76F62.4Low73.9Confident18 Ų1851.7 Ų51.78%0.07928%0.28CS..G310 helixtrans-73.2-23.7179.9-107.7-82.7000114.4I70 V73 S78 C79 L83 F256 T264I70-F76 HydrophobicContact CG2-CD1 3.84Å; I70-F76 HydrophobicContact CG2-CE1 4.28Å; I70-F76 HydrophobicContact CG2-CG 4.32Å; I70-F76 VanDerWaalsContact O-CB 3.3Å; I70-F76 WeakPolarHBondContact O-CB 3.38Å; V73-F76 HydrophobicContact CB-CB 4.44Å; V73-F76 HydrophobicContact CB-CD2 3.83Å; V73-F76 HydrophobicContact CG1-CD2 3.77Å; V73-F76 HydrophobicContact CG1-CE2 4.36Å; V73-F76 WeakPolarHBondContact O-CB 3.15Å; V73-F76 PolarHBondContact O-N 2.83Å; V73-F76 VanDerWaalsContact O-N 3.14Å; F76-S78 VanDerWaalsContact C-N 3.28Å; F76-S78 PolarHBondContact O-N 2.97Å; F76-C79 HydrophobicContact CD1-CB 4.48Å; F76-C79 PolarHBondContact O-N 3.11Å; F76-L83 HydrophobicContact CE1-CD1 4.48Å; F76-F256 AromaticContact CD2-CE1 3.51Å; F76-F256 HydrophobicContact CD2-CE1 3.51Å; F76-F256 HydrophobicContact CD2-CZ 4.21Å; F76-F256 HydrophobicContact CE2-CD1 4.29Å; F76-F256 AromaticContact CE2-CE1 3.54Å; F76-F256 HydrophobicContact CE2-CE1 3.54Å; F76-F256 HydrophobicContact CE2-CZ 4.42Å; F76-F256 HydrophobicContact CG-CE1 4.07Å; F76-F256 HydrophobicContact CZ-CD1 4.47Å; F76-F256 HydrophobicContact CZ-CE1 4.13Å; F76-T264 HydrophobicContact CE1-CG2 4.11Å; F76-T264 HydrophobicContact CZ-CG2 3.5Å
77K61.3Low74.3Confident162 Ų16251.2 Ų51.270%0.70428%0.277SS*.G310 helixtrans-57.4-40.2179.3-73.6-178178.3176.90112.4F71 G75 C79 G80F71-K77 HydrophobicContact CD1-CG 4.15Å; G75-K77 PolarHBondContact O-N 3.36Å; K77-C79 PolarHBondContact O-N 2.88Å; K77-G80 PolarHBondContact O-N 2.89Å
78S61.7Low74.9Confident116 Ų11649.4 Ų49.481%0.81127%0.269SS*.G310 helixtrans-69.8-20.3177.6-54.50000113.1F76F76-S78 VanDerWaalsContact C-N 3.28Å; F76-S78 PolarHBondContact O-N 2.97Å
79C71.6Confident75.8Confident12 Ų1248.6 Ų48.68%0.08127%0.27CS..G310 helixtrans-93.610.7178.7-61.90000113.5F76 K77 W81 Y82 L83 A253F76-C79 HydrophobicContact CD1-CB 4.48Å; F76-C79 PolarHBondContact O-N 3.11Å; K77-C79 PolarHBondContact O-N 2.88Å; C79-W81 VanDerWaalsContact C-N 3.31Å; C79-W81 PolarHBondContact O-N 3.25Å; C79-Y82 WeakPolarHBondContact O-CB 3.43Å; C79-Y82 PolarHBondContact O-N 3.44Å; C79-L83 PolarHBondContact O-N 3.38Å; C79-A253 HydrophobicContact CB-CB 4.43Å
80G77.2Confident76.7Confident7 Ų747.9 Ų47.97%0.07226%0.264CS..Hα-helixtrans-56.7-40.2-175.100000114.1K77 Y82 L83 T84K77-G80 PolarHBondContact O-N 2.89Å; G80-Y82 PolarHBondContact O-N 3Å; G80-L83 WeakPolarHBondContact O-CB 3.37Å; G80-L83 PolarHBondContact O-N 2.71Å; G80-T84 PolarHBondContact O-N 2.61Å; G80-T84 PolarHBondContact O-OG1 2.88Å
81W82.1Confident77.4Confident92 Ų9247.9 Ų47.935%0.34826%0.264SS..Hα-helixtrans-65.7-36.1176.3-76.5106.8000113.3C79 T84 L85 V122 I240 L244C79-W81 VanDerWaalsContact C-N 3.31Å; C79-W81 PolarHBondContact O-N 3.25Å; W81-T84 VanDerWaalsContact C-OG1 3.31Å; W81-T84 VanDerWaalsContact CA-OG1 3.32Å; W81-T84 WeakPolarHBondContact CA-OG1 3.41Å; W81-T84 PolarHBondContact O-N 2.84Å; W81-T84 PolarHBondContact O-OG1 3.1Å; W81-L85 PolarHBondContact O-N 3.45Å; W81-V122 HydrophobicContact CZ3-CG1 4.34Å; W81-I240 HydrophobicContact CE3-CG2 4.26Å; W81-I240 HydrophobicContact CZ3-CG1 4.5Å; W81-L244 HydrophobicContact CB-CD1 4.42Å; W81-L244 HydrophobicContact CB-CD2 3.82Å; W81-L244 HydrophobicContact CB-CG 4.43Å
82Y83.8Confident78.4Confident26 Ų2646.4 Ų46.410%0.10226%0.259CS..Hα-helixtrans-68.5-42174.2178.6-103.4000111.3C79 G80 T84 L85 V86 A253 V254 C257 Y265C79-Y82 WeakPolarHBondContact O-CB 3.43Å; C79-Y82 PolarHBondContact O-N 3.44Å; G80-Y82 PolarHBondContact O-N 3Å; Y82-T84 VanDerWaalsContact C-N 3.3Å; Y82-T84 PolarHBondContact O-N 2.74Å; Y82-L85 WeakPolarHBondContact O-CB 3.47Å; Y82-L85 PolarHBondContact O-N 3.38Å; Y82-L85 VanDerWaalsContact O-N 3.11Å; Y82-V86 HydrophobicContact CD1-CG2 4.2Å; Y82-V86 HydrophobicContact CE1-CG2 3.74Å; Y82-V86 HydrophobicContact CE2-CG2 4.16Å; Y82-V86 WeakPolarHBondContact O-CG2 3.16Å; Y82-V86 PolarHBondContact O-N 2.89Å; Y82-A253 HydrophobicContact CD1-CB 4.23Å; Y82-A253 HydrophobicContact CD2-CB 4.16Å; Y82-A253 HydrophobicContact CG-CB 3.72Å; Y82-V254 HydrophobicContact CD2-CG2 4.29Å; Y82-V254 HydrophobicContact CE2-CG2 3.53Å; Y82-C257 VanDerWaalsContact CD1-SG 3.6Å; Y82-C257 HydrophobicContact CE1-CB 3.9Å; Y82-C257 WeakPolarHBondContact CE1-SG 3.49Å; Y82-Y265 PolarHBondContact OH-OH 2.68Å
83L82.8Confident79.5Confident12 Ų1246.3 Ų46.36%0.06325%0.251CS..Hα-helixtrans-57.7-44.1174-167.193.6000111.3I70 F76 C79 G80 L85 V86 Q87 A268 F271I70-L83 HydrophobicContact CD1-CD1 4.4Å; I70-L83 HydrophobicContact CG2-CD1 3.89Å; I70-L83 HydrophobicContact CG2-CD2 4.2Å; F76-L83 HydrophobicContact CE1-CD1 4.48Å; C79-L83 PolarHBondContact O-N 3.38Å; G80-L83 WeakPolarHBondContact O-CB 3.37Å; G80-L83 PolarHBondContact O-N 2.71Å; L83-L85 VanDerWaalsContact C-N 3.33Å; L83-L85 PolarHBondContact O-N 3.05Å; L83-V86 PolarHBondContact O-N 2.95Å; L83-Q87 WeakPolarHBondContact O-CB 3.31Å; L83-Q87 PolarHBondContact O-N 3.33Å; L83-A268 HydrophobicContact CD1-CB 4.37Å; L83-F271 HydrophobicContact CD2-CD1 4.23Å; L83-F271 HydrophobicContact CD2-CE1 3.71Å; L83-F271 HydrophobicContact CD2-CZ 4.09Å; L83-F271 HydrophobicContact CG-CE1 4.33Å
84T85.5Confident80.5Confident12 Ų1244.2 Ų44.27%0.07424%0.236CC..Hα-helixtrans-65.7-34.9176.251.80000112.7G80 W81 Y82 Q87 F88 M125G80-T84 PolarHBondContact O-N 2.61Å; G80-T84 PolarHBondContact O-OG1 2.88Å; W81-T84 VanDerWaalsContact C-OG1 3.31Å; W81-T84 VanDerWaalsContact CA-OG1 3.32Å; W81-T84 WeakPolarHBondContact CA-OG1 3.41Å; W81-T84 PolarHBondContact O-N 2.84Å; W81-T84 PolarHBondContact O-OG1 3.1Å; Y82-T84 VanDerWaalsContact C-N 3.3Å; Y82-T84 PolarHBondContact O-N 2.74Å; T84-Q87 PolarHBondContact O-N 2.89Å; T84-F88 WeakPolarHBondContact O-CD1 3.48Å; T84-F88 PolarHBondContact O-N 3.43Å; T84-M125 HydrophobicContact CG2-SD 4.47Å
85L89.3Confident82Confident14 Ų1435.4 Ų35.47%0.07320%0.195CC..Hα-helixtrans-62.9-48.8173.9179.2146.6000110.9W81 Y82 L83 Q87 F88 A89 F237 I240 L241 L244W81-L85 PolarHBondContact O-N 3.45Å; Y82-L85 WeakPolarHBondContact O-CB 3.47Å; Y82-L85 PolarHBondContact O-N 3.38Å; Y82-L85 VanDerWaalsContact O-N 3.11Å; L83-L85 VanDerWaalsContact C-N 3.33Å; L83-L85 PolarHBondContact O-N 3.05Å; L85-Q87 VanDerWaalsContact C-N 3.3Å; L85-Q87 PolarHBondContact O-N 3.22Å; L85-F88 PolarHBondContact O-N 2.94Å; L85-A89 PolarHBondContact O-N 3.48Å; L85-F237 HydrophobicContact CD1-CE2 4.28Å; L85-F237 HydrophobicContact CD2-CD2 4.33Å; L85-F237 HydrophobicContact CD2-CE2 3.56Å; L85-F237 HydrophobicContact CD2-CZ 4.35Å; L85-F237 HydrophobicContact CG-CD2 3.92Å; L85-F237 HydrophobicContact CG-CE2 3.6Å; L85-F237 WeakPolarHBondContact O-CD2 3.47Å; L85-I240 HydrophobicContact CB-CG2 3.87Å; L85-I240 HydrophobicContact CD1-CG2 4.16Å; L85-I240 HydrophobicContact CG-CG2 4.48Å; L85-L241 HydrophobicContact CD1-CB 3.93Å; L85-L241 HydrophobicContact CD1-CD1 3.82Å; L85-L244 HydrophobicContact CB-CD1 4.18Å; L85-L244 HydrophobicContact CD1-CD1 3.69Å
86V88.7Confident83.3Confident15 Ų1537.3 Ų37.39%0.09120%0.195CC..Hα-helixtrans-60.6-42.1176.5172.80000110.6Y82 L83 F88 A89 F90 A268Y82-V86 HydrophobicContact CD1-CG2 4.2Å; Y82-V86 HydrophobicContact CE1-CG2 3.74Å; Y82-V86 HydrophobicContact CE2-CG2 4.16Å; Y82-V86 WeakPolarHBondContact O-CG2 3.16Å; Y82-V86 PolarHBondContact O-N 2.89Å; L83-V86 PolarHBondContact O-N 2.95Å; V86-F88 PolarHBondContact O-N 3.31Å; V86-A89 WeakPolarHBondContact O-CB 3.4Å; V86-A89 PolarHBondContact O-N 3.41Å; V86-F90 HydrophobicContact CG1-CD2 3.67Å; V86-F90 HydrophobicContact CG1-CE2 3.43Å; V86-F90 VanDerWaalsContact CG1-CE2 3.43Å; V86-F90 VanDerWaalsContact O-CD2 3.23Å; V86-F90 WeakPolarHBondContact O-CD2 3.24Å; V86-F90 PolarHBondContact O-N 3.48Å; V86-A268 HydrophobicContact CG1-CB 4.23Å
87Q90.1Very high84.6Confident5 Ų540.4 Ų40.42%0.02321%0.211CC..Hα-helixtrans-59.9-44.8176.1-174-174.9400112.2Y63 L83 T84 L85 A89 F90 Y91 F271 S272Y63-Q87 PolarHBondContact OH-NE2 3.42Å; L83-Q87 WeakPolarHBondContact O-CB 3.31Å; L83-Q87 PolarHBondContact O-N 3.33Å; T84-Q87 PolarHBondContact O-N 2.89Å; L85-Q87 VanDerWaalsContact C-N 3.3Å; L85-Q87 PolarHBondContact O-N 3.22Å; Q87-A89 VanDerWaalsContact C-N 3.33Å; Q87-A89 PolarHBondContact O-N 2.8Å; Q87-F90 PolarHBondContact O-N 2.99Å; Q87-Y91 HydrophobicContact CG-CD1 4.04Å; Q87-Y91 HydrophobicContact CG-CE1 3.57Å; Q87-Y91 PolarHBondContact NE2-OH 3.5Å; Q87-Y91 WeakPolarHBondContact O-CD1 3.24Å; Q87-Y91 PolarHBondContact O-N 3.26Å; Q87-F271 HydrophobicContact CB-CE1 4.33Å; Q87-F271 VanDerWaalsContact CD-CE1 3.49Å; Q87-F271 HydrophobicContact CG-CD1 4.46Å; Q87-F271 HydrophobicContact CG-CE1 4.09Å; Q87-F271 VanDerWaalsContact OE1-CE1 3.3Å; Q87-S272 WeakPolarHBondContact CA-OG 3.2Å
88F91.3Very high85.6Confident1 Ų133.4 Ų33.40%0.00418%0.181CC..Hα-helixtrans-68.9-33.8179.9-81.538.2000111.8T84 L85 V86 Y91 S92 T121 V122 M125 Y233 F237 I240T84-F88 WeakPolarHBondContact O-CD1 3.48Å; T84-F88 PolarHBondContact O-N 3.43Å; L85-F88 PolarHBondContact O-N 2.94Å; V86-F88 PolarHBondContact O-N 3.31Å; F88-Y91 PolarHBondContact O-N 3.31Å; F88-S92 WeakPolarHBondContact O-CB 3.44Å; F88-S92 PolarHBondContact O-N 3.04Å; F88-S92 PolarHBondContact O-OG 3.07Å; F88-T121 HydrophobicContact CE2-CG2 4.48Å; F88-T121 HydrophobicContact CZ-CG2 3.99Å; F88-V122 HydrophobicContact CE2-CG2 4.11Å; F88-M125 HydrophobicContact CE1-CE 3.73Å; F88-M125 HydrophobicContact CE1-SD 3.49Å; F88-M125 WeakPolarHBondContact CE1-SD 3.26Å; F88-M125 HydrophobicContact CZ-CE 3.84Å; F88-M125 HydrophobicContact CZ-SD 3.51Å; F88-M125 VanDerWaalsContact CZ-SD 3.51Å; F88-Y233 AromaticContact CD1-CD1 3.76Å; F88-Y233 HydrophobicContact CD1-CD1 3.76Å; F88-Y233 HydrophobicContact CD1-CE1 4.25Å; F88-Y233 AromaticContact CD2-CD1 3.84Å; F88-Y233 HydrophobicContact CD2-CD1 3.84Å; F88-Y233 AromaticContact CE1-CD1 3.68Å; F88-Y233 HydrophobicContact CE1-CD1 3.68Å; F88-Y233 AromaticContact CE1-CE1 3.77Å; F88-Y233 HydrophobicContact CE1-CE1 3.77Å; F88-Y233 AromaticContact CE2-CD1 3.78Å; F88-Y233 HydrophobicContact CE2-CD1 3.78Å; F88-Y233 HydrophobicContact CE2-CE1 4.33Å; F88-Y233 AromaticContact CG-CD1 3.85Å; F88-Y233 HydrophobicContact CG-CD1 3.85Å; F88-Y233 AromaticContact CZ-CD1 3.69Å; F88-Y233 HydrophobicContact CZ-CD1 3.69Å; F88-Y233 AromaticContact CZ-CE1 3.82Å; F88-Y233 HydrophobicContact CZ-CE1 3.82Å; F88-F237 HydrophobicContact CB-CB 4.03Å; F88-F237 HydrophobicContact CB-CD2 4.46Å; F88-I240 HydrophobicContact CD2-CD1 3.92Å; F88-I240 HydrophobicContact CE2-CD1 3.9Å; F88-I240 HydrophobicContact CG-CD1 4.26Å; F88-I240 HydrophobicContact CZ-CD1 4.23Å
89A92.1Very high86.5Confident29 Ų2929.1 Ų29.124%0.2415%0.149CC..Hα-helixtrans-61.6-50171.700000111.1L85 V86 Q87 Y91 S92 I93 F237L85-A89 PolarHBondContact O-N 3.48Å; V86-A89 WeakPolarHBondContact O-CB 3.4Å; V86-A89 PolarHBondContact O-N 3.41Å; Q87-A89 VanDerWaalsContact C-N 3.33Å; Q87-A89 PolarHBondContact O-N 2.8Å; A89-Y91 PolarHBondContact O-N 3.5Å; A89-S92 WeakPolarHBondContact O-CB 3.4Å; A89-S92 PolarHBondContact O-N 3.26Å; A89-I93 WeakPolarHBondContact O-CG1 3.38Å; A89-I93 PolarHBondContact O-N 2.86Å; A89-F237 HydrophobicContact CB-CD2 3.93Å; A89-F237 HydrophobicContact CB-CE2 3.76Å
90F92.3Very high86.9Confident46 Ų4635.4 Ų35.420%0.20218%0.177CC..Hα-helixtrans-63.3-40.2177.2-78.6-59.4000112.8V86 Q87 S92 I93 F94 F269V86-F90 HydrophobicContact CG1-CD2 3.67Å; V86-F90 HydrophobicContact CG1-CE2 3.43Å; V86-F90 VanDerWaalsContact CG1-CE2 3.43Å; V86-F90 VanDerWaalsContact O-CD2 3.23Å; V86-F90 WeakPolarHBondContact O-CD2 3.24Å; V86-F90 PolarHBondContact O-N 3.48Å; Q87-F90 PolarHBondContact O-N 2.99Å; F90-S92 PolarHBondContact O-N 3.41Å; F90-I93 HydrophobicContact CD1-CD1 4.43Å; F90-I93 PolarHBondContact O-N 3.26Å; F90-F94 HydrophobicContact CB-CD2 4.37Å; F90-F94 HydrophobicContact CB-CE2 3.98Å; F90-F94 HydrophobicContact CD1-CZ 4.44Å; F90-F94 WeakPolarHBondContact O-CD2 3.49Å; F90-F94 VanDerWaalsContact O-CG 3.31Å; F90-F94 WeakPolarHBondContact O-CG 3.44Å; F90-F94 PolarHBondContact O-N 2.82Å; F90-F269 HydrophobicContact CD1-CD2 4.2Å; F90-F269 AromaticContact CE1-CD2 3.83Å; F90-F269 HydrophobicContact CE1-CD2 3.83Å; F90-F269 HydrophobicContact CE1-CE2 4.43Å; F90-F269 HydrophobicContact CZ-CD2 4.11Å
91Y91.5Very high86.9Confident6 Ų641.7 Ų41.72%0.02421%0.208CC..Hα-helixtrans-61-36.6175.6-81.729.3000112Q87 F88 A89 G95 V229 Y233 S272 G275 Y276 I279Q87-Y91 HydrophobicContact CG-CD1 4.04Å; Q87-Y91 HydrophobicContact CG-CE1 3.57Å; Q87-Y91 PolarHBondContact NE2-OH 3.5Å; Q87-Y91 WeakPolarHBondContact O-CD1 3.24Å; Q87-Y91 PolarHBondContact O-N 3.26Å; F88-Y91 PolarHBondContact O-N 3.31Å; A89-Y91 PolarHBondContact O-N 3.5Å; Y91-G95 PolarHBondContact O-N 3.49Å; Y91-V229 HydrophobicContact CD2-CG1 4.23Å; Y91-Y233 AromaticContact CD2-CD1 3.57Å; Y91-Y233 HydrophobicContact CD2-CD1 3.57Å; Y91-Y233 HydrophobicContact CD2-CD2 4.2Å; Y91-Y233 AromaticContact CD2-CE1 3.57Å; Y91-Y233 HydrophobicContact CD2-CE1 3.57Å; Y91-Y233 HydrophobicContact CD2-CE2 4.17Å; Y91-Y233 AromaticContact CD2-CG 3.89Å; Y91-Y233 HydrophobicContact CD2-CG 3.89Å; Y91-Y233 AromaticContact CD2-CZ 3.86Å; Y91-Y233 HydrophobicContact CE2-CD1 4.24Å; Y91-Y233 AromaticContact CE2-CE1 3.77Å; Y91-Y233 HydrophobicContact CE2-CE1 3.77Å; Y91-Y233 AromaticContact CE2-CZ 3.96Å; Y91-Y233 HydrophobicContact CG-CD1 4.4Å; Y91-S272 WeakPolarHBondContact CE1-O 3.44Å; Y91-G275 VanDerWaalsContact CZ-C 3.44Å; Y91-G275 WeakPolarHBondContact OH-CA 3.5Å; Y91-G275 PolarHBondContact OH-O 3.24Å; Y91-G275 VanDerWaalsContact OH-O 3.1Å; Y91-Y276 HydrophobicContact CD1-CD2 4.34Å; Y91-Y276 HydrophobicContact CG-CD2 4.15Å; Y91-Y276 WeakPolarHBondContact O-CE2 3.46Å; Y91-Y276 PolarHBondContact OH-N 3.36Å; Y91-I279 HydrophobicContact CD2-CG2 4.37Å; Y91-I279 HydrophobicContact CE2-CG2 3.89Å
92S90.8Very high86.3Confident14 Ų1439.8 Ų39.810%0.09820%0.204CC..Hα-helixtrans-68.2-43.1175.9-550000110.9F88 A89 F90 G95 L96 L230 S234F88-S92 WeakPolarHBondContact O-CB 3.44Å; F88-S92 PolarHBondContact O-N 3.04Å; F88-S92 PolarHBondContact O-OG 3.07Å; A89-S92 WeakPolarHBondContact O-CB 3.4Å; A89-S92 PolarHBondContact O-N 3.26Å; F90-S92 PolarHBondContact O-N 3.41Å; S92-G95 PolarHBondContact O-N 3.24Å; S92-L96 WeakPolarHBondContact O-CG 3.4Å; S92-L96 PolarHBondContact O-N 3.48Å; S92-L230 VanDerWaalsContact O-CD1 3.23Å; S92-L230 WeakPolarHBondContact O-CD1 3.42Å; S92-S234 WeakPolarHBondContact CB-OG 3.4Å; S92-S234 WeakPolarHBondContact OG-CA 3.16Å; S92-S234 PolarHBondContact OG-N 3.32Å; S92-S234 PolarHBondContact OG-OG 3.19Å; S92-S234 VanDerWaalsContact OG-OG 3.13Å
93I91.4Very high85.3Confident84 Ų8446.9 Ų46.943%0.43124%0.238SC..Hα-helixtrans-62.5-49.7176-66166.2000111A89 F90 G95 L96 I97A89-I93 WeakPolarHBondContact O-CG1 3.38Å; A89-I93 PolarHBondContact O-N 2.86Å; F90-I93 HydrophobicContact CD1-CD1 4.43Å; F90-I93 PolarHBondContact O-N 3.26Å; I93-G95 VanDerWaalsContact C-N 3.31Å; I93-G95 PolarHBondContact O-N 2.85Å; I93-L96 WeakPolarHBondContact O-CB 3.24Å; I93-L96 PolarHBondContact O-N 2.85Å; I93-I97 HydrophobicContact CG2-CD1 3.82Å; I93-I97 HydrophobicContact CG2-CG1 4.49Å; I93-I97 WeakPolarHBondContact O-CG1 3.31Å; I93-I97 PolarHBondContact O-N 3.28Å
94F90Very high84.3Confident30 Ų3048.4 Ų48.413%0.13225%0.247CC..Hα-helixtrans-62.9-38.9177.9-62.8-39.4000112F90 L96 I97 E98 F269 L273 Y276F90-F94 HydrophobicContact CB-CD2 4.37Å; F90-F94 HydrophobicContact CB-CE2 3.98Å; F90-F94 HydrophobicContact CD1-CZ 4.44Å; F90-F94 WeakPolarHBondContact O-CD2 3.49Å; F90-F94 VanDerWaalsContact O-CG 3.31Å; F90-F94 WeakPolarHBondContact O-CG 3.44Å; F90-F94 PolarHBondContact O-N 2.82Å; F94-L96 PolarHBondContact O-N 3.34Å; F94-I97 PolarHBondContact O-N 3.41Å; F94-E98 WeakPolarHBondContact O-CB 3.23Å; F94-E98 PolarHBondContact O-N 3.04Å; F94-F269 HydrophobicContact CE1-CE2 4.12Å; F94-F269 HydrophobicContact CZ-CD2 4.27Å; F94-F269 AromaticContact CZ-CE2 3.63Å; F94-F269 HydrophobicContact CZ-CE2 3.63Å; F94-F269 HydrophobicContact CZ-CZ 4.14Å; F94-L273 HydrophobicContact CE1-CD1 4.1Å; F94-L273 HydrophobicContact CE2-CB 4.22Å; F94-L273 HydrophobicContact CE2-CD1 3.97Å; F94-L273 HydrophobicContact CZ-CB 4.29Å; F94-L273 HydrophobicContact CZ-CD1 3.7Å; F94-Y276 HydrophobicContact CB-CD1 3.82Å; F94-Y276 HydrophobicContact CB-CD2 3.69Å; F94-Y276 HydrophobicContact CB-CE1 3.87Å; F94-Y276 HydrophobicContact CB-CE2 3.69Å; F94-Y276 HydrophobicContact CB-CG 3.75Å; F94-Y276 HydrophobicContact CD2-CD1 4.43Å; F94-Y276 HydrophobicContact CD2-CD2 4.29Å; F94-Y276 AromaticContact CD2-CG 3.93Å; F94-Y276 HydrophobicContact CD2-CG 3.93Å; F94-Y276 HydrophobicContact CG-CD1 4.43Å; F94-Y276 HydrophobicContact CG-CG 4.26Å
95G87Confident82.8Confident0 Ų057.6 Ų57.60%029%0.285CS..Hα-helixtrans-60.7-41.2172.700000113.1Y91 S92 I93 L99 Y276Y91-G95 PolarHBondContact O-N 3.49Å; S92-G95 PolarHBondContact O-N 3.24Å; I93-G95 VanDerWaalsContact C-N 3.31Å; I93-G95 PolarHBondContact O-N 2.85Å; G95-L99 VanDerWaalsContact O-CB 3.27Å; G95-L99 WeakPolarHBondContact O-CB 3.45Å; G95-L99 PolarHBondContact O-N 3.47Å; G95-Y276 WeakPolarHBondContact CA-OH 3.28Å
96L87.6Confident81.3Confident83 Ų8366.6 Ų66.644%0.43532%0.318SS..Hα-helixtrans-64.6-46.9174.8-74.4172.3000111.5S92 I93 F94 L99 Q100 L230S92-L96 WeakPolarHBondContact O-CG 3.4Å; S92-L96 PolarHBondContact O-N 3.48Å; I93-L96 WeakPolarHBondContact O-CB 3.24Å; I93-L96 PolarHBondContact O-N 2.85Å; F94-L96 PolarHBondContact O-N 3.34Å; L96-L99 PolarHBondContact O-N 3.03Å; L96-Q100 WeakPolarHBondContact O-CB 3.4Å; L96-Q100 VanDerWaalsContact O-CG 3.26Å; L96-Q100 WeakPolarHBondContact O-CG 3.47Å; L96-Q100 PolarHBondContact O-N 3.04Å; L96-L230 HydrophobicContact CB-CD1 4.44Å; L96-L230 HydrophobicContact CD1-CD1 4.48Å; L96-L230 HydrophobicContact CD2-CD1 3.7Å; L96-L230 HydrophobicContact CD2-CD2 3.59Å; L96-L230 HydrophobicContact CD2-CG 4.26Å; L96-L230 HydrophobicContact CG-CD1 3.52Å; L96-L230 HydrophobicContact CG-CD2 4.25Å
97I87.7Confident80.1Confident82 Ų8272.1 Ų72.142%0.42134%0.337SS..Hα-helixtrans-60.7-47.8179.8-67.6166.7000110.1I93 F94 L99 Q100 L101I93-I97 HydrophobicContact CG2-CD1 3.82Å; I93-I97 HydrophobicContact CG2-CG1 4.49Å; I93-I97 WeakPolarHBondContact O-CG1 3.31Å; I93-I97 PolarHBondContact O-N 3.28Å; F94-I97 PolarHBondContact O-N 3.41Å; I97-L99 PolarHBondContact O-N 3.43Å; I97-Q100 PolarHBondContact O-N 3.43Å; I97-L101 HydrophobicContact CG2-CD1 3.9Å; I97-L101 HydrophobicContact CG2-CG 4.46Å; I97-L101 WeakPolarHBondContact O-CB 3.41Å; I97-L101 VanDerWaalsContact O-CG 3.29Å; I97-L101 WeakPolarHBondContact O-CG 3.41Å; I97-L101 PolarHBondContact O-N 2.94Å
98E83.3Confident79.2Confident15 Ų1576.7 Ų76.77%0.0736%0.355CS..Hα-helixtrans-65.1-38.7179.8-163.8178.3-166.900111.7L36 F94 L101 I102 S226 Y276L36-E98 PolarHBondContact N-OE1 3.25Å; F94-E98 WeakPolarHBondContact O-CB 3.23Å; F94-E98 PolarHBondContact O-N 3.04Å; E98-L101 PolarHBondContact O-N 3.19Å; E98-I102 HydrophobicContact CG-CD1 3.89Å; E98-I102 WeakPolarHBondContact O-CB 3.43Å; E98-I102 VanDerWaalsContact O-CG1 3.26Å; E98-I102 WeakPolarHBondContact O-CG1 3.16Å; E98-I102 PolarHBondContact O-N 2.97Å; E98-S226 WeakPolarHBondContact CG-OG 3.45Å; E98-S226 PolarHBondContact OE1-OG 3.01Å; E98-S226 WeakPolarHBondContact OE2-CB 3.38Å; E98-S226 PolarHBondContact OE2-OG 3.28Å; E98-Y276 PolarHBondContact OE2-OH 2.66Å
99L80.3Confident78.5Confident27 Ų2776.8 Ų76.814%0.14136%0.355CS..Hα-helixtrans-66.8-38.4176.1-165.970.4000112.4G95 L96 I97 I102 Q103 D104 E227 L230G95-L99 VanDerWaalsContact O-CB 3.27Å; G95-L99 WeakPolarHBondContact O-CB 3.45Å; G95-L99 PolarHBondContact O-N 3.47Å; L96-L99 PolarHBondContact O-N 3.03Å; I97-L99 PolarHBondContact O-N 3.43Å; L99-I102 PolarHBondContact O-N 3.33Å; L99-Q103 PolarHBondContact O-N 3.28Å; L99-D104 VanDerWaalsContact CD1-O 3.26Å; L99-D104 WeakPolarHBondContact CD1-O 3.31Å; L99-E227 HydrophobicContact CD1-CB 4.45Å; L99-L230 HydrophobicContact CD2-CD2 3.81Å
100Q80.4Confident77.9Confident144 Ų14478.3 Ų78.367%0.67336%0.363SS*.Hα-helixtrans-65.8-40.9174.9-75177.73.300111.7L96 I97 I102 Q103L96-Q100 WeakPolarHBondContact O-CB 3.4Å; L96-Q100 VanDerWaalsContact O-CG 3.26Å; L96-Q100 WeakPolarHBondContact O-CG 3.47Å; L96-Q100 PolarHBondContact O-N 3.04Å; I97-Q100 PolarHBondContact O-N 3.43Å; Q100-I102 VanDerWaalsContact C-N 3.35Å; Q100-Q103 PolarHBondContact O-N 3.34Å
101L76.2Confident77.4Confident138 Ų13877.2 Ų77.272%0.72336%0.364SS*.Hα-helixtrans-64.3-37.9176.6-74.5168.1000112.5I97 E98 Q103I97-L101 HydrophobicContact CG2-CD1 3.9Å; I97-L101 HydrophobicContact CG2-CG 4.46Å; I97-L101 WeakPolarHBondContact O-CB 3.41Å; I97-L101 VanDerWaalsContact O-CG 3.29Å; I97-L101 WeakPolarHBondContact O-CG 3.41Å; I97-L101 PolarHBondContact O-N 2.94Å; E98-L101 PolarHBondContact O-N 3.19Å; L101-Q103 VanDerWaalsContact C-N 3.29Å; L101-Q103 PolarHBondContact O-N 3.05Å
102I70.9Confident77.2Confident53 Ų5384.8 Ų84.827%0.27240%0.397SS..Hα-helixtrans-79.8-11.8-179.7-64.6168.8000111.9V34 E98 L99 Q100 D104V34-I102 HydrophobicContact CG1-CD1 4.21Å; E98-I102 HydrophobicContact CG-CD1 3.89Å; E98-I102 WeakPolarHBondContact O-CB 3.43Å; E98-I102 VanDerWaalsContact O-CG1 3.26Å; E98-I102 WeakPolarHBondContact O-CG1 3.16Å; E98-I102 PolarHBondContact O-N 2.97Å; L99-I102 PolarHBondContact O-N 3.33Å; Q100-I102 VanDerWaalsContact C-N 3.35Å; I102-D104 HydrophobicContact CG2-CB 4.07Å; I102-D104 PolarHBondContact O-N 2.99Å; I102-D104 VanDerWaalsContact O-N 3.1Å
103Q62.7Low77.1Confident175 Ų17585.6 Ų85.682%0.81840%0.402SS*.THydrogen-bonded Turntrans54.819.6-176.7-66.1-171.2-20.100115.1L99 Q100 L101 K105L99-Q103 PolarHBondContact O-N 3.28Å; Q100-Q103 PolarHBondContact O-N 3.34Å; L101-Q103 VanDerWaalsContact C-N 3.29Å; L101-Q103 PolarHBondContact O-N 3.05Å; Q103-K105 PolarHBondContact O-N 3.44Å
104D61Low77Confident44 Ų4481.6 Ų81.624%0.23538%0.381CS..  trans-92.287.5177.6-158.4-10.2000110.1L99 I102 R106 R108L99-D104 VanDerWaalsContact CD1-O 3.26Å; L99-D104 WeakPolarHBondContact CD1-O 3.31Å; I102-D104 HydrophobicContact CG2-CB 4.07Å; I102-D104 PolarHBondContact O-N 2.99Å; I102-D104 VanDerWaalsContact O-N 3.1Å; D104-R106 VanDerWaalsContact C-N 3.33Å; D104-R106 PolarHBondContact O-N 3.48Å; D104-R108 IonicContact OD1-NH2 3.61Å; D104-R108 PolarHBondContact OD1-NH2 2.92Å; D104-R108 IonicContact OD2-CZ 2.88Å; D104-R108 IonicContact OD2-NE 2.78Å; D104-R108 IonicContact OD2-NH2 3.5Å; D104-R108 PolarHBondContact OD2-NH2 3.49Å
105K54.7Low77Confident204 Ų20484.2 Ų84.289%0.88740%0.395SS*.  trans-80.9-3.2-176.3-94-177.5178.4179.10114.7Q103 R107Q103-K105 PolarHBondContact O-N 3.44Å; K105-R107 PolarHBondContact O-N 2.91Å
106R57.8Low77.2Confident204 Ų20488.6 Ų88.677%0.7742%0.418SS*.  trans-89115.5-173.6-71.4-168.6-178.8-162.61.8111.1D104 R108D104-R106 VanDerWaalsContact C-N 3.33Å; D104-R106 PolarHBondContact O-N 3.48Å; R106-R108 WeakPolarHBondContact O-CG 3.25Å; R106-R108 PolarHBondContact O-N 2.81Å
107R63.7Low77.4Confident130 Ų13084.7 Ų84.749%0.49140%0.397SS..  trans-66120.4166.5-174-176.7-175.7170.714.4109.5K105 I109 E227 Y231K105-R107 PolarHBondContact O-N 2.91Å; R107-I109 PolarHBondContact NE-O 3.39Å; R107-E227 VanDerWaalsContact CA-OE1 3.32Å; R107-E227 WeakPolarHBondContact CA-OE1 3.31Å; R107-Y231 HydrophobicContact CG-CE2 4.14Å
108R69.7Low77.7Confident102 Ų10280.8 Ų80.839%0.38538%0.377SS..  trans-104.9-31.3-175.4-53.7-170.9-173.7-171.3-2.1113.1D104 R106 H221 N222 E227D104-R108 IonicContact OD1-NH2 3.61Å; D104-R108 PolarHBondContact OD1-NH2 2.92Å; D104-R108 IonicContact OD2-CZ 2.88Å; D104-R108 IonicContact OD2-NE 2.78Å; D104-R108 IonicContact OD2-NH2 3.5Å; D104-R108 PolarHBondContact OD2-NH2 3.49Å; R106-R108 WeakPolarHBondContact O-CG 3.25Å; R106-R108 PolarHBondContact O-N 2.81Å; R108-H221 HydrophobicContact CB-CB 4.09Å; R108-H221 WeakPolarHBondContact CB-O 3.32Å; R108-H221 VanDerWaalsContact CD-O 3.28Å; R108-H221 WeakPolarHBondContact CD-O 3.44Å; R108-H221 PolarHBondContact O-ND1 3.47Å; R108-N222 WeakPolarHBondContact CD-O 3.45Å; R108-N222 PolarHBondContact NH1-O 3.29Å; R108-E227 PolarHBondContact N-OE1 2.88Å
109I76.8Confident78.2Confident3 Ų386.4 Ų86.42%0.01540%0.401CS..SBendtrans-93.8138.6-177.4-64.6168.6000111.2R107 T113 Y114 A217 H221 A223 M228R107-I109 PolarHBondContact NE-O 3.39Å; I109-T113 HydrophobicContact CG2-CG2 4.41Å; I109-Y114 HydrophobicContact CB-CD2 4.35Å; I109-Y114 HydrophobicContact CB-CE1 4.48Å; I109-Y114 HydrophobicContact CB-CE2 3.49Å; I109-Y114 VanDerWaalsContact CB-CE2 3.49Å; I109-Y114 WeakPolarHBondContact CB-OH 3.28Å; I109-Y114 HydrophobicContact CD1-CE1 4.35Å; I109-Y114 WeakPolarHBondContact CD1-OH 3.03Å; I109-Y114 HydrophobicContact CG2-CD2 4.01Å; I109-Y114 HydrophobicContact CG2-CE1 4.36Å; I109-Y114 HydrophobicContact CG2-CE2 3.63Å; I109-Y114 WeakPolarHBondContact O-CE2 3.24Å; I109-A217 HydrophobicContact CD1-CB 3.99Å; I109-A217 HydrophobicContact CG1-CB 4.4Å; I109-A217 HydrophobicContact CG2-CB 4.32Å; I109-H221 HydrophobicContact CG1-CB 3.74Å; I109-A223 HydrophobicContact CD1-CB 3.3Å; I109-A223 HydrophobicContact CG1-CB 3.71Å; I109-M228 HydrophobicContact CD1-SD 3.58Å; I109-M228 VanDerWaalsContact CD1-SD 3.58Å
110P80.9Confident78.8Confident61 Ų6186.8 Ų86.840%0.39640%0.403SS..  trans-62.8139.817624.1-33.5000112.5K112 T113 H221P110-K112 PolarHBondContact O-N 3.27Å; P110-K112 VanDerWaalsContact O-N 3.14Å; P110-T113 PolarHBondContact O-N 3.09Å; P110-T113 VanDerWaalsContact O-N 3.12Å; P110-H221 WeakPolarHBondContact CD-NE2 3.38Å
111G81.8Confident79.3Confident23 Ų2380.6 Ų80.624%0.23738%0.375CS..Hα-helixtrans-58.2-30.1-175.600000115.8T113 Y114 M115G111-T113 VanDerWaalsContact C-N 3.31Å; G111-T113 PolarHBondContact O-N 3.05Å; G111-Y114 PolarHBondContact O-N 3.15Å; G111-M115 WeakPolarHBondContact O-CG 3.28Å; G111-M115 PolarHBondContact O-N 2.91Å; G111-M115 VanDerWaalsContact O-N 3.08Å
112K86.3Confident80.1Confident164 Ų16474.9 Ų74.971%0.71335%0.346SS*.Hα-helixtrans-61.2-39.4177.8-63.5-174.2-179.8-177.40112.3P110 Y114 M115 I116P110-K112 PolarHBondContact O-N 3.27Å; P110-K112 VanDerWaalsContact O-N 3.14Å; K112-Y114 VanDerWaalsContact C-N 3.35Å; K112-Y114 PolarHBondContact O-N 2.97Å; K112-M115 HydrophobicContact CB-CE 4.37Å; K112-M115 HydrophobicContact CG-CE 4.08Å; K112-M115 PolarHBondContact O-N 2.87Å; K112-I116 WeakPolarHBondContact O-CG1 3.43Å; K112-I116 PolarHBondContact O-N 3.25Å; K112-I116 VanDerWaalsContact O-N 3.09Å
113T88.4Confident81Confident32 Ų3273.8 Ų73.820%0.19635%0.348CS..Hα-helixtrans-66.2-40179.2-46.90000111.1I109 P110 G111 I116 I117 V213 A217I109-T113 HydrophobicContact CG2-CG2 4.41Å; P110-T113 PolarHBondContact O-N 3.09Å; P110-T113 VanDerWaalsContact O-N 3.12Å; G111-T113 VanDerWaalsContact C-N 3.31Å; G111-T113 PolarHBondContact O-N 3.05Å; T113-I116 PolarHBondContact O-N 2.93Å; T113-I117 HydrophobicContact CG2-CD1 3.99Å; T113-I117 VanDerWaalsContact O-CG1 3.31Å; T113-I117 WeakPolarHBondContact O-CG1 3.24Å; T113-I117 PolarHBondContact O-N 3.44Å; T113-V213 HydrophobicContact CG2-CG1 3.62Å; T113-A217 HydrophobicContact CG2-CB 4.02Å
114Y89.1Confident82.3Confident0 Ų065.8 Ų65.80%031%0.311CS..Hα-helixtrans-63.2-42.4174.8-71.2-62000112.8I109 G111 K112 I116 I117 A118 E227 M228 Y231 S232I109-Y114 HydrophobicContact CB-CD2 4.35Å; I109-Y114 HydrophobicContact CB-CE1 4.48Å; I109-Y114 HydrophobicContact CB-CE2 3.49Å; I109-Y114 VanDerWaalsContact CB-CE2 3.49Å; I109-Y114 WeakPolarHBondContact CB-OH 3.28Å; I109-Y114 HydrophobicContact CD1-CE1 4.35Å; I109-Y114 WeakPolarHBondContact CD1-OH 3.03Å; I109-Y114 HydrophobicContact CG2-CD2 4.01Å; I109-Y114 HydrophobicContact CG2-CE1 4.36Å; I109-Y114 HydrophobicContact CG2-CE2 3.63Å; I109-Y114 WeakPolarHBondContact O-CE2 3.24Å; G111-Y114 PolarHBondContact O-N 3.15Å; K112-Y114 VanDerWaalsContact C-N 3.35Å; K112-Y114 PolarHBondContact O-N 2.97Å; Y114-I116 VanDerWaalsContact C-N 3.35Å; Y114-I116 PolarHBondContact O-N 2.83Å; Y114-I117 PolarHBondContact O-N 3.15Å; Y114-A118 WeakPolarHBondContact O-CB 3.06Å; Y114-A118 PolarHBondContact O-N 3.37Å; Y114-E227 WeakPolarHBondContact OH-CG 3.37Å; Y114-E227 PolarHBondContact OH-OE1 3.36Å; Y114-M228 HydrophobicContact CD1-SD 4.24Å; Y114-M228 HydrophobicContact CE1-CE 4.49Å; Y114-M228 HydrophobicContact CE1-SD 3.49Å; Y114-M228 WeakPolarHBondContact CE1-SD 3.49Å; Y114-Y231 HydrophobicContact CD2-CG 4.42Å; Y114-Y231 HydrophobicContact CE1-CD2 4.45Å; Y114-Y231 HydrophobicContact CE2-CD2 4.01Å; Y114-Y231 HydrophobicContact CE2-CG 4.17Å; Y114-Y231 AromaticContact CZ-CD2 3.87Å; Y114-S232 WeakPolarHBondContact CD1-OG 3.29Å
115M90.5Very high83.5Confident84 Ų8465.9 Ų65.941%0.41431%0.311SS..Hα-helixtrans-61.6-43177-69.2-173.5-67.100111.8G111 K112 A118 F119 I235G111-M115 WeakPolarHBondContact O-CG 3.28Å; G111-M115 PolarHBondContact O-N 2.91Å; G111-M115 VanDerWaalsContact O-N 3.08Å; K112-M115 HydrophobicContact CB-CE 4.37Å; K112-M115 HydrophobicContact CG-CE 4.08Å; K112-M115 PolarHBondContact O-N 2.87Å; M115-A118 PolarHBondContact O-N 2.84Å; M115-F119 VanDerWaalsContact O-CB 3.27Å; M115-F119 WeakPolarHBondContact O-CB 3.47Å; M115-F119 PolarHBondContact O-N 3.28Å; M115-I235 HydrophobicContact CG-CD1 4.12Å; M115-I235 HydrophobicContact CG-CG2 4.37Å
116I92.3Very high85Confident93 Ų9356.5 Ų56.548%0.47727%0.271SS..Hα-helixtrans-63.1-46.8176.9-67.2165.6000110.7K112 T113 Y114 F119 L120K112-I116 WeakPolarHBondContact O-CG1 3.43Å; K112-I116 PolarHBondContact O-N 3.25Å; K112-I116 VanDerWaalsContact O-N 3.09Å; T113-I116 PolarHBondContact O-N 2.93Å; Y114-I116 VanDerWaalsContact C-N 3.35Å; Y114-I116 PolarHBondContact O-N 2.83Å; I116-F119 PolarHBondContact O-N 3.13Å; I116-L120 HydrophobicContact CG2-CD1 3.78Å; I116-L120 HydrophobicContact CG2-CG 4.35Å; I116-L120 WeakPolarHBondContact O-CB 3.39Å; I116-L120 VanDerWaalsContact O-CG 3.27Å; I116-L120 WeakPolarHBondContact O-CG 3.37Å; I116-L120 PolarHBondContact O-N 3.31Å
117I92.3Very high86.4Confident0 Ų049.2 Ų49.20%025%0.248CC..Hα-helixtrans-63.8-43.9179.2-69.1165.5000110.9T113 Y114 L120 T121 I210 V213 Q214 M228T113-I117 HydrophobicContact CG2-CD1 3.99Å; T113-I117 VanDerWaalsContact O-CG1 3.31Å; T113-I117 WeakPolarHBondContact O-CG1 3.24Å; T113-I117 PolarHBondContact O-N 3.44Å; Y114-I117 PolarHBondContact O-N 3.15Å; I117-L120 PolarHBondContact O-N 3.1Å; I117-T121 VanDerWaalsContact O-CB 3.27Å; I117-T121 WeakPolarHBondContact O-CB 3.45Å; I117-T121 PolarHBondContact O-N 2.93Å; I117-T121 PolarHBondContact O-OG1 3.05Å; I117-I210 HydrophobicContact CG2-CG2 4.27Å; I117-V213 HydrophobicContact CD1-CG1 3.85Å; I117-V213 HydrophobicContact CG1-CG1 3.9Å; I117-Q214 HydrophobicContact CD1-CG 3.96Å; I117-Q214 HydrophobicContact CG1-CG 4.48Å; I117-Q214 HydrophobicContact CG2-CG 4.24Å; I117-M228 HydrophobicContact CD1-CE 3.14Å
118A92.8Very high87.4Confident0 Ų043 Ų430%022%0.224CC..Hα-helixtrans-60.5-48.617700000111.2Y114 M115 T121 V122 S232 I235 Y239Y114-A118 WeakPolarHBondContact O-CB 3.06Å; Y114-A118 PolarHBondContact O-N 3.37Å; M115-A118 PolarHBondContact O-N 2.84Å; A118-T121 PolarHBondContact O-N 3.47Å; A118-V122 WeakPolarHBondContact O-CG2 3.5Å; A118-V122 PolarHBondContact O-N 2.91Å; A118-S232 VanDerWaalsContact CB-O 3.24Å; A118-S232 WeakPolarHBondContact CB-O 3.32Å; A118-I235 HydrophobicContact CB-CB 3.82Å; A118-I235 HydrophobicContact CB-CG2 3.67Å; A118-Y239 HydrophobicContact CB-CD2 4.23Å; A118-Y239 HydrophobicContact CB-CE2 4Å
119F93.8Very high87.8Confident133 Ų13340.2 Ų40.258%0.58322%0.217SC*.Hα-helixtrans-59.2-49.4177.6176.5-100.1000111.7M115 I116 T121 V122 G123 Y239M115-F119 VanDerWaalsContact O-CB 3.27Å; M115-F119 WeakPolarHBondContact O-CB 3.47Å; M115-F119 PolarHBondContact O-N 3.28Å; I116-F119 PolarHBondContact O-N 3.13Å; F119-T121 VanDerWaalsContact C-N 3.31Å; F119-T121 PolarHBondContact O-N 2.9Å; F119-V122 PolarHBondContact O-N 3.43Å; F119-G123 PolarHBondContact O-N 3.36Å; F119-Y239 HydrophobicContact CB-CE2 4.05Å
120L93.3Very high88Confident35 Ų3543.1 Ų43.118%0.18324%0.235CC..Hα-helixtrans-62.7-38.6177.2-70.1171000111.5I116 I117 G123 T124 A206 V209 I210I116-L120 HydrophobicContact CG2-CD1 3.78Å; I116-L120 HydrophobicContact CG2-CG 4.35Å; I116-L120 WeakPolarHBondContact O-CB 3.39Å; I116-L120 VanDerWaalsContact O-CG 3.27Å; I116-L120 WeakPolarHBondContact O-CG 3.37Å; I116-L120 PolarHBondContact O-N 3.31Å; I117-L120 PolarHBondContact O-N 3.1Å; L120-G123 PolarHBondContact O-N 2.81Å; L120-T124 WeakPolarHBondContact O-CB 3.42Å; L120-T124 PolarHBondContact O-N 2.99Å; L120-T124 PolarHBondContact O-OG1 3.41Å; L120-T124 VanDerWaalsContact O-OG1 3.12Å; L120-A206 HydrophobicContact CD2-CB 4.11Å; L120-V209 HydrophobicContact CD1-CB 4.06Å; L120-V209 HydrophobicContact CD1-CG1 3.53Å; L120-I210 HydrophobicContact CB-CD1 3.76Å; L120-I210 HydrophobicContact CB-CG1 3.52Å; L120-I210 HydrophobicContact CD1-CG1 4.21Å
121T91.7Very high88Confident14 Ų1440.2 Ų40.29%0.08622%0.216CC..Hα-helixtrans-64.9-46.7179.8-57.50000110.9F88 I117 A118 F119 M125F88-T121 HydrophobicContact CE2-CG2 4.48Å; F88-T121 HydrophobicContact CZ-CG2 3.99Å; I117-T121 VanDerWaalsContact O-CB 3.27Å; I117-T121 WeakPolarHBondContact O-CB 3.45Å; I117-T121 PolarHBondContact O-N 2.93Å; I117-T121 PolarHBondContact O-OG1 3.05Å; A118-T121 PolarHBondContact O-N 3.47Å; F119-T121 VanDerWaalsContact C-N 3.31Å; F119-T121 PolarHBondContact O-N 2.9Å; T121-M125 HydrophobicContact CG2-CE 4.07Å; T121-M125 WeakPolarHBondContact O-CB 3.26Å; T121-M125 WeakPolarHBondContact O-CG 3.44Å; T121-M125 PolarHBondContact O-N 3.38Å
122V91.1Very high87.4Confident19 Ų1941.9 Ų41.912%0.11522%0.219CC..Hα-helixtrans-64.2-43176.2174.80000110.5W81 F88 A118 F119 M125 G126 I240W81-V122 HydrophobicContact CZ3-CG1 4.34Å; F88-V122 HydrophobicContact CE2-CG2 4.11Å; A118-V122 WeakPolarHBondContact O-CG2 3.5Å; A118-V122 PolarHBondContact O-N 2.91Å; F119-V122 PolarHBondContact O-N 3.43Å; V122-M125 PolarHBondContact O-N 3.29Å; V122-G126 PolarHBondContact O-N 3.32Å; V122-I240 HydrophobicContact CB-CG1 4.39Å; V122-I240 HydrophobicContact CG1-CD1 4.49Å; V122-I240 HydrophobicContact CG1-CG1 3.71Å; V122-I240 HydrophobicContact CG2-CD1 4.05Å; V122-I240 HydrophobicContact CG2-CG1 3.78Å
123G90.9Very high86.7Confident30 Ų3037.3 Ų37.331%0.30922%0.219SC..Hα-helixtrans-58.8-51.317600000112.7F119 L120 M125 G126 L127F119-G123 PolarHBondContact O-N 3.36Å; L120-G123 PolarHBondContact O-N 2.81Å; G123-M125 PolarHBondContact O-N 2.96Å; G123-G126 PolarHBondContact O-N 2.94Å; G123-L127 WeakPolarHBondContact O-CB 3.4Å; G123-L127 VanDerWaalsContact O-CG 3.23Å; G123-L127 WeakPolarHBondContact O-CG 3.45Å; G123-L127 PolarHBondContact O-N 3.29Å
124T90.3Very high86Confident6 Ų640.5 Ų40.54%0.03723%0.228CC..Hα-helixtrans-57.6-49.2175-66.80000111.3L120 G126 L127 S128 A203 A206 D207L120-T124 WeakPolarHBondContact O-CB 3.42Å; L120-T124 PolarHBondContact O-N 2.99Å; L120-T124 PolarHBondContact O-OG1 3.41Å; L120-T124 VanDerWaalsContact O-OG1 3.12Å; T124-G126 VanDerWaalsContact C-N 3.28Å; T124-G126 PolarHBondContact O-N 3.15Å; T124-L127 PolarHBondContact O-N 2.87Å; T124-S128 WeakPolarHBondContact O-CB 3.47Å; T124-S128 PolarHBondContact O-N 2.96Å; T124-A203 HydrophobicContact CG2-CB 3.94Å; T124-A203 PolarHBondContact OG1-O 2.88Å; T124-A206 WeakPolarHBondContact OG1-CB 3.26Å; T124-D207 VanDerWaalsContact CG2-CG 3.43Å; T124-D207 WeakPolarHBondContact CG2-OD1 3.27Å
125M86.5Confident85.1Confident47 Ų4740.7 Ų40.723%0.23223%0.229CC..Hα-helixtrans-61.9-39.5-178.8-75.2-169.7-177.100111.5T84 F88 T121 V122 G123 N129T84-M125 HydrophobicContact CG2-SD 4.47Å; F88-M125 HydrophobicContact CE1-CE 3.73Å; F88-M125 HydrophobicContact CE1-SD 3.49Å; F88-M125 WeakPolarHBondContact CE1-SD 3.26Å; F88-M125 HydrophobicContact CZ-CE 3.84Å; F88-M125 HydrophobicContact CZ-SD 3.51Å; F88-M125 VanDerWaalsContact CZ-SD 3.51Å; T121-M125 HydrophobicContact CG2-CE 4.07Å; T121-M125 WeakPolarHBondContact O-CB 3.26Å; T121-M125 WeakPolarHBondContact O-CG 3.44Å; T121-M125 PolarHBondContact O-N 3.38Å; V122-M125 PolarHBondContact O-N 3.29Å; G123-M125 PolarHBondContact O-N 2.96Å; M125-N129 VanDerWaalsContact O-CB 3.3Å; M125-N129 WeakPolarHBondContact O-CB 3.43Å; M125-N129 PolarHBondContact O-N 3.28Å; M125-N129 PolarHBondContact O-ND2 3.19Å; M125-N129 PolarHBondContact O-OD1 3.46Å
126G85.3Confident84Confident6 Ų639.2 Ų39.26%0.06222%0.222CC..Hα-helixtrans-64.3-54.8174.500000113.6V122 G123 T124 S128 N129 T130V122-G126 PolarHBondContact O-N 3.32Å; G123-G126 PolarHBondContact O-N 2.94Å; T124-G126 VanDerWaalsContact C-N 3.28Å; T124-G126 PolarHBondContact O-N 3.15Å; G126-S128 VanDerWaalsContact C-N 3.25Å; G126-S128 PolarHBondContact O-N 3.3Å; G126-N129 PolarHBondContact O-N 3.06Å; G126-N129 VanDerWaalsContact O-N 3.11Å; G126-T130 WeakPolarHBondContact O-CB 3.36Å; G126-T130 PolarHBondContact O-N 3.47Å; G126-T130 PolarHBondContact O-OG1 3.25Å; G126-T130 VanDerWaalsContact O-OG1 3.09Å
127L87.3Confident82.7Confident51 Ų5138.8 Ų38.827%0.26722%0.215SC..Hα-helixtrans-57.3-41178.1-70.1167.3000111.5G123 T124 S131 L199 L202 A203G123-L127 WeakPolarHBondContact O-CB 3.4Å; G123-L127 VanDerWaalsContact O-CG 3.23Å; G123-L127 WeakPolarHBondContact O-CG 3.45Å; G123-L127 PolarHBondContact O-N 3.29Å; T124-L127 PolarHBondContact O-N 2.87Å; L127-S131 WeakPolarHBondContact O-CB 3.44Å; L127-S131 PolarHBondContact O-N 3.49Å; L127-L199 HydrophobicContact CD2-CD2 3.52Å; L127-L202 HydrophobicContact CD1-CB 4.07Å; L127-A203 HydrophobicContact CB-CB 3.95Å
128S83.9Confident81.2Confident0 Ų040 Ų400%022%0.223CC..Hα-helixtrans-64.1-50.3174.1-174.10000110.8T124 G126 T130 S131 L132 Q140 K144T124-S128 WeakPolarHBondContact O-CB 3.47Å; T124-S128 PolarHBondContact O-N 2.96Å; G126-S128 VanDerWaalsContact C-N 3.25Å; G126-S128 PolarHBondContact O-N 3.3Å; S128-T130 VanDerWaalsContact C-N 3.33Å; S128-T130 PolarHBondContact O-N 2.96Å; S128-S131 WeakPolarHBondContact O-CB 3.49Å; S128-S131 PolarHBondContact O-N 3.29Å; S128-S131 VanDerWaalsContact O-N 3.13Å; S128-S131 PolarHBondContact O-OG 2.71Å; S128-L132 PolarHBondContact O-N 2.9Å; S128-Q140 PolarHBondContact O-NE2 2.88Å; S128-Q140 PolarHBondContact OG-NE2 3.09Å; S128-K144 WeakPolarHBondContact OG-CE 3.49Å; S128-K144 PolarHBondContact OG-NZ 3.21Å
129N79.9Confident80Confident44 Ų4440.2 Ų40.224%0.23523%0.225CC..Hα-helixtrans-63.5-40.3-179.1-72.5-9.6000111.8M125 G126 S131 L132M125-N129 VanDerWaalsContact O-CB 3.3Å; M125-N129 WeakPolarHBondContact O-CB 3.43Å; M125-N129 PolarHBondContact O-N 3.28Å; M125-N129 PolarHBondContact O-ND2 3.19Å; M125-N129 PolarHBondContact O-OD1 3.46Å; G126-N129 PolarHBondContact O-N 3.06Å; G126-N129 VanDerWaalsContact O-N 3.11Å; N129-S131 VanDerWaalsContact C-N 3.3Å; N129-S131 PolarHBondContact O-N 3.49Å; N129-L132 WeakPolarHBondContact O-CB 3.36Å; N129-L132 PolarHBondContact O-N 3.36Å; N129-L132 VanDerWaalsContact O-N 3.15Å
130T80.4Confident78.9Confident64 Ų6434.1 Ų34.139%0.39320%0.198SC..Hα-helixtrans-63.8-35.2174.7-57.10000111.9G126 S128 L132 G133 Y134 L199G126-T130 WeakPolarHBondContact O-CB 3.36Å; G126-T130 PolarHBondContact O-N 3.47Å; G126-T130 PolarHBondContact O-OG1 3.25Å; G126-T130 VanDerWaalsContact O-OG1 3.09Å; S128-T130 VanDerWaalsContact C-N 3.33Å; S128-T130 PolarHBondContact O-N 2.96Å; T130-L132 PolarHBondContact O-N 3.03Å; T130-G133 PolarHBondContact O-N 2.93Å; T130-Y134 HydrophobicContact CG2-CE2 4.11Å; T130-Y134 WeakPolarHBondContact O-CD2 3.36Å; T130-L199 HydrophobicContact CG2-CD1 3.9Å
131S79.8Confident77.6Confident0 Ų033.4 Ų33.40%020%0.195CC..Hα-helixtrans-62-24.4175.773.30000113.5L127 S128 N129 G133 Y134 L135 Q140L127-S131 WeakPolarHBondContact O-CB 3.44Å; L127-S131 PolarHBondContact O-N 3.49Å; S128-S131 WeakPolarHBondContact O-CB 3.49Å; S128-S131 PolarHBondContact O-N 3.29Å; S128-S131 VanDerWaalsContact O-N 3.13Å; S128-S131 PolarHBondContact O-OG 2.71Å; N129-S131 VanDerWaalsContact C-N 3.3Å; N129-S131 PolarHBondContact O-N 3.49Å; S131-G133 PolarHBondContact O-N 3.1Å; S131-Y134 CarbonylContact O-C 3.55Å; S131-Y134 PolarHBondContact O-N 3.4Å; S131-L135 WeakPolarHBondContact O-CB 3.41Å; S131-L135 PolarHBondContact O-N 3.45Å; S131-Q140 PolarHBondContact OG-NE2 3.48Å
132L70.4Confident76.5Confident57 Ų5732.8 Ų32.830%0.29819%0.191SC..THydrogen-bonded Turntrans-67.1-19.3174.4-71.5169.5000113.2S128 N129 T130 Y137 Q140S128-L132 PolarHBondContact O-N 2.9Å; N129-L132 WeakPolarHBondContact O-CB 3.36Å; N129-L132 PolarHBondContact O-N 3.36Å; N129-L132 VanDerWaalsContact O-N 3.15Å; T130-L132 PolarHBondContact O-N 3.03Å; L132-Y137 HydrophobicContact CD2-CD2 4.01Å; L132-Q140 HydrophobicContact CD2-CB 4.19Å; L132-Q140 HydrophobicContact CD2-CG 4.44Å; L132-Q140 VanDerWaalsContact CD2-OE1 3.23Å
133G71.9Confident75.7Confident68 Ų6833.3 Ų33.370%0.70119%0.192SC*.THydrogen-bonded Turntrans-73.6-17170.400000113.2T130 S131T130-G133 PolarHBondContact O-N 2.93Å; S131-G133 PolarHBondContact O-N 3.1Å
134Y73.9Confident75.1Confident99 Ų9934.2 Ų34.239%0.38819%0.187SC..THydrogen-bonded Turntrans-118.9-16.3-173.8-63.9-77.9000113.7T130 S131 N193 T195 L199T130-Y134 HydrophobicContact CG2-CE2 4.11Å; T130-Y134 WeakPolarHBondContact O-CD2 3.36Å; S131-Y134 CarbonylContact O-C 3.55Å; S131-Y134 PolarHBondContact O-N 3.4Å; Y134-N193 HydrophobicContact CD1-CB 4.43Å; Y134-T195 HydrophobicContact CE1-CG2 4.27Å; Y134-T195 HydrophobicContact CE2-CG2 4.37Å; Y134-L199 HydrophobicContact CD2-CD1 3.97Å; Y134-L199 HydrophobicContact CE2-CD1 4.04Å
135L69.1Low74.3Confident5 Ų534 Ų343%0.02619%0.186CC..BIsolated β-bridgetrans-132.9145.4-178.1-63.5174.2000110S131 T139 F143 F192 V197 I200S131-L135 WeakPolarHBondContact O-CB 3.41Å; S131-L135 PolarHBondContact O-N 3.45Å; L135-T139 HydrophobicContact CD2-CG2 4.25Å; L135-F143 HydrophobicContact CD1-CD2 4.13Å; L135-F143 HydrophobicContact CD1-CE2 4.25Å; L135-F192 HydrophobicContact CD2-CD2 4.26Å; L135-V197 HydrophobicContact CD2-CG2 4.38Å; L135-I200 HydrophobicContact CD1-CG2 4.17Å
136N67Low73.6Confident52 Ų5233 Ų3328%0.27818%0.183SC..  trans-64.2150.5169.9-67.6-26.8000110.8T139 Q140N136-T139 WeakPolarHBondContact O-CB 3.48Å; N136-T139 PolarHBondContact O-N 3.13Å; N136-Q140 PolarHBondContact O-N 2.91Å
137Y64.6Low73.6Confident84 Ų8434.1 Ų34.133%0.32919%0.186SC..Hα-helixtrans-53.6-46.3179.2179.8-101.9000113.3L132 T139 Q140 V141L132-Y137 HydrophobicContact CD2-CD2 4.01Å; Y137-T139 PolarHBondContact O-N 2.92Å; Y137-Q140 WeakPolarHBondContact O-CB 3.27Å; Y137-Q140 PolarHBondContact O-N 3.46Å; Y137-V141 HydrophobicContact CD1-CG2 4.38Å; Y137-V141 HydrophobicContact CE1-CG2 4.07Å; Y137-V141 HydrophobicContact CE2-CG2 4.43Å; Y137-V141 WeakPolarHBondContact O-CG2 3.49Å; Y137-V141 PolarHBondContact O-N 3.38Å
138P62.1Low73.4Confident25 Ų2531.8 Ų31.816%0.16217%0.174CC..Hα-helixtrans-59.5-48.1176.7-23.235.4000112.7Q140 V141 I142P138-Q140 VanDerWaalsContact C-N 3.26Å; P138-Q140 PolarHBondContact O-N 3.4Å; P138-V141 PolarHBondContact O-N 2.99Å; P138-I142 VanDerWaalsContact O-CG1 3.3Å; P138-I142 WeakPolarHBondContact O-CG1 3.42Å; P138-I142 PolarHBondContact O-N 3.49Å
139T67.6Low73.4Confident5 Ų534.7 Ų34.73%0.03119%0.189CC..Hα-helixtrans-54-43.5176.2-44.50000111.4L135 N136 Y137 I142 F143 T182 D185 F192L135-T139 HydrophobicContact CD2-CG2 4.25Å; N136-T139 WeakPolarHBondContact O-CB 3.48Å; N136-T139 PolarHBondContact O-N 3.13Å; Y137-T139 PolarHBondContact O-N 2.92Å; T139-I142 PolarHBondContact O-N 2.95Å; T139-F143 HydrophobicContact CG2-CD2 4.14Å; T139-F143 HydrophobicContact CG2-CE2 3.91Å; T139-F143 VanDerWaalsContact O-CD2 3.28Å; T139-F143 WeakPolarHBondContact O-CD2 3.42Å; T139-F143 PolarHBondContact O-N 3.49Å; T139-T182 HydrophobicContact CG2-CG2 4.2Å; T139-D185 PolarHBondContact OG1-OD2 2.95Å; T139-F192 HydrophobicContact CG2-CD2 4.18Å; T139-F192 HydrophobicContact CG2-CE2 4.28Å
140Q69.9Low73.7Confident6 Ų634 Ų343%0.02819%0.187CC..Hα-helixtrans-63.6-44.1175.6-169.1-16350.200112.9S128 S131 L132 N136 Y137 P138 I142 F143 K144 I200S128-Q140 PolarHBondContact O-NE2 2.88Å; S128-Q140 PolarHBondContact OG-NE2 3.09Å; S131-Q140 PolarHBondContact OG-NE2 3.48Å; L132-Q140 HydrophobicContact CD2-CB 4.19Å; L132-Q140 HydrophobicContact CD2-CG 4.44Å; L132-Q140 VanDerWaalsContact CD2-OE1 3.23Å; N136-Q140 PolarHBondContact O-N 2.91Å; Y137-Q140 WeakPolarHBondContact O-CB 3.27Å; Y137-Q140 PolarHBondContact O-N 3.46Å; P138-Q140 VanDerWaalsContact C-N 3.26Å; P138-Q140 PolarHBondContact O-N 3.4Å; Q140-I142 PolarHBondContact O-N 3.08Å; Q140-F143 PolarHBondContact O-N 3.26Å; Q140-K144 WeakPolarHBondContact O-CG 3.4Å; Q140-K144 PolarHBondContact O-N 3.4Å; Q140-I200 HydrophobicContact CG-CD1 3.82Å; Q140-I200 HydrophobicContact CG-CG1 4.39Å
141V66.4Low74Confident19 Ų1931.1 Ų31.112%0.11517%0.169CC..Hα-helixtrans-59.1-39.4178.5-178.50000110Y137 P138 K144 C145 K302 I306Y137-V141 HydrophobicContact CD1-CG2 4.38Å; Y137-V141 HydrophobicContact CE1-CG2 4.07Å; Y137-V141 HydrophobicContact CE2-CG2 4.43Å; Y137-V141 WeakPolarHBondContact O-CG2 3.49Å; Y137-V141 PolarHBondContact O-N 3.38Å; P138-V141 PolarHBondContact O-N 2.99Å; V141-K144 WeakPolarHBondContact O-CB 3.4Å; V141-K144 PolarHBondContact O-N 3.12Å; V141-C145 PolarHBondContact O-N 3.04Å; V141-C145 PolarHBondContact O-SG 3.32Å; V141-K302 HydrophobicContact CG1-CB 4.13Å; V141-K302 HydrophobicContact CG1-CD 4.38Å; V141-K302 HydrophobicContact CG1-CG 4.44Å; V141-I306 HydrophobicContact CB-CD1 4.31Å; V141-I306 HydrophobicContact CG1-CD1 3.74Å; V141-I306 HydrophobicContact CG1-CG1 3.98Å
142I69.1Low74.3Confident1 Ų131.8 Ų31.81%0.00517%0.173CC..Hα-helixtrans-67.4-45.4179.3-53.5155000111.4P138 T139 Q140 K144 C145 C146 L178 F181 T182 D185 I306P138-I142 VanDerWaalsContact O-CG1 3.3Å; P138-I142 WeakPolarHBondContact O-CG1 3.42Å; P138-I142 PolarHBondContact O-N 3.49Å; T139-I142 PolarHBondContact O-N 2.95Å; Q140-I142 PolarHBondContact O-N 3.08Å; I142-K144 PolarHBondContact O-N 3.14Å; I142-C145 WeakPolarHBondContact O-CA 3.47Å; I142-C145 VanDerWaalsContact O-CB 3.24Å; I142-C145 WeakPolarHBondContact O-CB 3.31Å; I142-C145 PolarHBondContact O-N 3.01Å; I142-C146 PolarHBondContact O-N 3.4Å; I142-L178 HydrophobicContact CG2-CB 3.97Å; I142-L178 HydrophobicContact CG2-CD2 4.26Å; I142-L178 VanDerWaalsContact CG2-O 3.23Å; I142-L178 WeakPolarHBondContact CG2-O 3.28Å; I142-F181 HydrophobicContact CD1-CD1 3.47Å; I142-F181 VanDerWaalsContact CD1-CD1 3.47Å; I142-F181 HydrophobicContact CD1-CE1 3.87Å; I142-F181 HydrophobicContact CG1-CD1 3.79Å; I142-F181 HydrophobicContact CG1-CE1 4.18Å; I142-T182 HydrophobicContact CD1-CG2 4.42Å; I142-T182 WeakPolarHBondContact CG2-OG1 3.27Å; I142-D185 HydrophobicContact CD1-CB 4.3Å; I142-I306 HydrophobicContact CG1-CD1 4.24Å
143F74.4Confident75.1Confident31 Ų3134.2 Ų34.214%0.13619%0.185CC..Hα-helixtrans-56.3-39.7171.8-85-70.5000111.7L135 T139 Q140 C145 C146 F192 V197 I200 L204L135-F143 HydrophobicContact CD1-CD2 4.13Å; L135-F143 HydrophobicContact CD1-CE2 4.25Å; T139-F143 HydrophobicContact CG2-CD2 4.14Å; T139-F143 HydrophobicContact CG2-CE2 3.91Å; T139-F143 VanDerWaalsContact O-CD2 3.28Å; T139-F143 WeakPolarHBondContact O-CD2 3.42Å; T139-F143 PolarHBondContact O-N 3.49Å; Q140-F143 PolarHBondContact O-N 3.26Å; F143-C145 PolarHBondContact O-N 3.3Å; F143-C146 VanDerWaalsContact O-CB 3.28Å; F143-C146 WeakPolarHBondContact O-CB 3.32Å; F143-C146 PolarHBondContact O-N 2.97Å; F143-F192 AromaticContact CE2-CE2 3.75Å; F143-F192 HydrophobicContact CE2-CE2 3.75Å; F143-F192 HydrophobicContact CE2-CZ 4.25Å; F143-F192 AromaticContact CZ-CE2 3.81Å; F143-F192 HydrophobicContact CZ-CE2 3.81Å; F143-F192 AromaticContact CZ-CZ 3.86Å; F143-F192 HydrophobicContact CZ-CZ 3.86Å; F143-V197 HydrophobicContact CE1-CG1 3.97Å; F143-V197 HydrophobicContact CE2-CG2 4.22Å; F143-V197 HydrophobicContact CZ-CB 4.4Å; F143-V197 HydrophobicContact CZ-CG1 3.89Å; F143-V197 HydrophobicContact CZ-CG2 3.88Å; F143-I200 HydrophobicContact CB-CB 4.44Å; F143-I200 HydrophobicContact CB-CG1 3.69Å; F143-I200 HydrophobicContact CB-CG2 3.81Å; F143-I200 HydrophobicContact CD1-CG2 3.92Å; F143-I200 HydrophobicContact CD2-CG2 4.02Å; F143-I200 HydrophobicContact CG-CG1 4.45Å; F143-I200 HydrophobicContact CG-CG2 3.65Å; F143-L204 WeakPolarHBondContact O-CD1 3.26Å; F143-L204 WeakPolarHBondContact O-CD2 3.46Å
144K78.4Confident75.8Confident49 Ų4931.6 Ų31.621%0.21316%0.158CC..Hα-helixtrans-64.4-18.9174.8-71.8-169.3173.4179.20115S128 Q140 V141 I142 K147 I200 L204 K302S128-K144 WeakPolarHBondContact OG-CE 3.49Å; S128-K144 PolarHBondContact OG-NZ 3.21Å; Q140-K144 WeakPolarHBondContact O-CG 3.4Å; Q140-K144 PolarHBondContact O-N 3.4Å; V141-K144 WeakPolarHBondContact O-CB 3.4Å; V141-K144 PolarHBondContact O-N 3.12Å; I142-K144 PolarHBondContact O-N 3.14Å; K144-K147 WeakPolarHBondContact O-CD 3.1Å; K144-K147 VanDerWaalsContact O-CG 3.28Å; K144-K147 WeakPolarHBondContact O-CG 3.2Å; K144-I200 HydrophobicContact CG-CD1 4.14Å; K144-L204 HydrophobicContact CB-CD2 4.36Å; K144-L204 HydrophobicContact CG-CD2 4.23Å; K144-K302 VanDerWaalsContact CB-NZ 3.28Å
145C71.7Confident76.4Confident0 Ų026.9 Ų26.90%014%0.14CC..Hα-helixtrans-78.9-26.6172.6-63.80000111.2V141 I142 F143 K147 L178 T299V141-C145 PolarHBondContact O-N 3.04Å; V141-C145 PolarHBondContact O-SG 3.32Å; I142-C145 WeakPolarHBondContact O-CA 3.47Å; I142-C145 VanDerWaalsContact O-CB 3.24Å; I142-C145 WeakPolarHBondContact O-CB 3.31Å; I142-C145 PolarHBondContact O-N 3.01Å; F143-C145 PolarHBondContact O-N 3.3Å; C145-K147 PolarHBondContact O-N 2.65Å; C145-K147 VanDerWaalsContact O-N 3.15Å; C145-L178 HydrophobicContact CB-CD1 3.31Å; C145-L178 HydrophobicContact CB-CD2 3.49Å; C145-L178 VanDerWaalsContact CB-CD2 3.49Å; C145-L178 HydrophobicContact CB-CG 3.98Å; C145-T299 HydrophobicContact CB-CG2 3.63Å
146C73Confident77.3Confident26 Ų2630.1 Ų30.118%0.17616%0.16CC..THydrogen-bonded Turntrans-67.9-8.3174.7-57.70000114.1I142 F143 L148 I149 P150 L204I142-C146 PolarHBondContact O-N 3.4Å; F143-C146 VanDerWaalsContact O-CB 3.28Å; F143-C146 WeakPolarHBondContact O-CB 3.32Å; F143-C146 PolarHBondContact O-N 2.97Å; C146-L148 PolarHBondContact O-N 3.48Å; C146-I149 PolarHBondContact O-N 3.03Å; C146-P150 VanDerWaalsContact O-CD 3.23Å; C146-P150 WeakPolarHBondContact O-CD 3.48Å; C146-L204 HydrophobicContact CB-CD1 4.37Å
147K85.2Confident78.3Confident30 Ų3036.7 Ų36.713%0.1319%0.186CC..THydrogen-bonded Turntrans-56.2-18.1177.374.3178.7179.6164.50114.1K144 C145 I149 P150 V151 L204 V295 T298K144-K147 WeakPolarHBondContact O-CD 3.1Å; K144-K147 VanDerWaalsContact O-CG 3.28Å; K144-K147 WeakPolarHBondContact O-CG 3.2Å; C145-K147 PolarHBondContact O-N 2.65Å; C145-K147 VanDerWaalsContact O-N 3.15Å; K147-I149 PolarHBondContact O-N 3.37Å; K147-P150 WeakPolarHBondContact O-CD 3.45Å; K147-V151 WeakPolarHBondContact O-CB 3.46Å; K147-V151 WeakPolarHBondContact O-CG2 3.49Å; K147-V151 PolarHBondContact O-N 3Å; K147-L204 HydrophobicContact CB-CB 4.46Å; K147-L204 HydrophobicContact CB-CD2 3.89Å; K147-V295 HydrophobicContact CD-CG1 4.33Å; K147-V295 HydrophobicContact CG-CG1 3.85Å; K147-T298 PolarHBondContact NZ-OG1 2.94Å
148L82Confident79.4Confident2 Ų234.4 Ų34.41%0.0118%0.179CC..Hα-helixtrans-60-41.9-178.2-166.9152.8000112.5C146 V151 M152 A171 M174 L292 V295C146-L148 PolarHBondContact O-N 3.48Å; L148-V151 PolarHBondContact O-N 3.42Å; L148-M152 PolarHBondContact O-N 3.12Å; L148-A171 HydrophobicContact CD2-CB 3.17Å; L148-M174 HydrophobicContact CD1-CE 3.98Å; L148-M174 HydrophobicContact CD1-SD 3.79Å; L148-L292 HydrophobicContact CD2-CD1 4.25Å; L148-L292 HydrophobicContact CG-CD1 4.33Å; L148-V295 HydrophobicContact CB-CG1 3.93Å; L148-V295 HydrophobicContact CD1-CG1 4.49Å; L148-V295 HydrophobicContact CG-CG1 4.12Å
149I84.8Confident80.4Confident61 Ų6135.2 Ų35.231%0.31318%0.181SC..Hα-helixtrans-65.3-54.8178-65.2166.8000111.1C146 K147 V151 M152 L153 S175C146-I149 PolarHBondContact O-N 3.03Å; K147-I149 PolarHBondContact O-N 3.37Å; I149-V151 PolarHBondContact O-N 3.49Å; I149-M152 PolarHBondContact O-N 3.46Å; I149-M152 VanDerWaalsContact O-N 3.11Å; I149-L153 HydrophobicContact CG2-CD1 4.07Å; I149-L153 HydrophobicContact CG2-CG 4.47Å; I149-L153 PolarHBondContact O-N 3.26Å; I149-S175 WeakPolarHBondContact CD1-OG 3.47Å; I149-S175 WeakPolarHBondContact CG1-OG 3.31Å
150P86.6Confident81Confident31 Ų3137.8 Ų37.820%0.20121%0.208CC..Hα-helixtrans-54.1-39.7174.7-29.836.3000113.4C146 K147 L153 G154 A208C146-P150 VanDerWaalsContact O-CD 3.23Å; C146-P150 WeakPolarHBondContact O-CD 3.48Å; K147-P150 WeakPolarHBondContact O-CD 3.45Å; P150-L153 PolarHBondContact O-N 3.49Å; P150-G154 PolarHBondContact O-N 3.32Å; P150-A208 HydrophobicContact CB-CB 3.61Å; P150-A208 WeakPolarHBondContact O-CB 3.49Å
151V86.9Confident81.5Confident2 Ų240.2 Ų40.21%0.01222%0.219CC..Hα-helixtrans-63.9-43178.3170.10000111.1K147 L148 I149 G154 G155 A208 N212 A291 V295K147-V151 WeakPolarHBondContact O-CB 3.46Å; K147-V151 WeakPolarHBondContact O-CG2 3.49Å; K147-V151 PolarHBondContact O-N 3Å; L148-V151 PolarHBondContact O-N 3.42Å; I149-V151 PolarHBondContact O-N 3.49Å; V151-G154 PolarHBondContact O-N 3Å; V151-G155 PolarHBondContact O-N 3.28Å; V151-A208 HydrophobicContact CB-CB 4.39Å; V151-A208 HydrophobicContact CG2-CB 3.82Å; V151-N212 PolarHBondContact O-ND2 3.4Å; V151-A291 HydrophobicContact CG1-CB 4.33Å; V151-V295 HydrophobicContact CB-CG1 4.47Å; V151-V295 HydrophobicContact CB-CG2 4.31Å; V151-V295 HydrophobicContact CG1-CB 4.34Å; V151-V295 HydrophobicContact CG1-CG2 3.94Å; V151-V295 HydrophobicContact CG2-CB 4.5Å; V151-V295 HydrophobicContact CG2-CG1 4.28Å; V151-V295 HydrophobicContact CG2-CG2 3.78Å
152M85.7Confident82Confident15 Ų1551.1 Ų51.17%0.07426%0.257CS..Hα-helixtrans-64.3-46.9177.9-171178.271.800111.2L148 I149 G154 G155 V156 Y163 V168 A171 L292L148-M152 PolarHBondContact O-N 3.12Å; I149-M152 PolarHBondContact O-N 3.46Å; I149-M152 VanDerWaalsContact O-N 3.11Å; M152-G154 PolarHBondContact O-N 2.86Å; M152-G155 PolarHBondContact O-N 3.06Å; M152-G155 VanDerWaalsContact O-N 3.12Å; M152-V156 PolarHBondContact O-N 3.12Å; M152-V156 VanDerWaalsContact O-N 3.15Å; M152-Y163 HydrophobicContact CG-CD1 4.33Å; M152-Y163 HydrophobicContact CG-CD2 3.73Å; M152-Y163 HydrophobicContact CG-CE1 4.47Å; M152-Y163 HydrophobicContact CG-CE2 3.89Å; M152-Y163 HydrophobicContact CG-CG 3.96Å; M152-Y163 VanDerWaalsContact O-CE2 3.26Å; M152-Y163 WeakPolarHBondContact O-CE2 3.15Å; M152-Y163 HydrophobicContact SD-CG 4.49Å; M152-V168 HydrophobicContact CE-CB 4.13Å; M152-V168 HydrophobicContact CE-CG1 3.99Å; M152-V168 HydrophobicContact CE-CG2 3.76Å; M152-V168 HydrophobicContact SD-CB 4.43Å; M152-V168 HydrophobicContact SD-CG2 3.88Å; M152-A171 HydrophobicContact CE-CB 4.28Å; M152-A171 HydrophobicContact SD-CB 4.08Å; M152-L292 HydrophobicContact CB-CD1 4.16Å; M152-L292 HydrophobicContact CG-CD1 4.47Å
153L87.2Confident82.6Confident108 Ų10853.1 Ų53.157%0.56527%0.265SS*.Hα-helixtrans-60.4-44.6175.5-68.4175000111.8I149 P150 G155 V156 F157I149-L153 HydrophobicContact CG2-CD1 4.07Å; I149-L153 HydrophobicContact CG2-CG 4.47Å; I149-L153 PolarHBondContact O-N 3.26Å; P150-L153 PolarHBondContact O-N 3.49Å; L153-G155 VanDerWaalsContact C-N 3.25Å; L153-G155 PolarHBondContact O-N 2.94Å; L153-V156 PolarHBondContact O-N 3.08Å; L153-V156 VanDerWaalsContact O-N 3.17Å; L153-F157 PolarHBondContact O-N 3.47Å
154G86.6Confident82.9Confident12 Ų1255.1 Ų55.112%0.12428%0.278CS..Hα-helixtrans-61.8-32.3174.800000112.8P150 V151 M152 F157 I158P150-G154 PolarHBondContact O-N 3.32Å; V151-G154 PolarHBondContact O-N 3Å; M152-G154 PolarHBondContact O-N 2.86Å; G154-F157 PolarHBondContact O-N 3Å; G154-I158 WeakPolarHBondContact O-CB 3.09Å; G154-I158 WeakPolarHBondContact O-CG1 3.28Å; G154-I158 PolarHBondContact O-N 3.27Å
155G86.8Confident83Confident0 Ų058.3 Ų58.30%030%0.301CS..Hα-helixtrans-67.4-37.9174.800000112.6V151 M152 L153 Q159 G160 K161 N212V151-G155 PolarHBondContact O-N 3.28Å; M152-G155 PolarHBondContact O-N 3.06Å; M152-G155 VanDerWaalsContact O-N 3.12Å; L153-G155 VanDerWaalsContact C-N 3.25Å; L153-G155 PolarHBondContact O-N 2.94Å; G155-Q159 WeakPolarHBondContact O-CB 3.28Å; G155-Q159 PolarHBondContact O-N 3.31Å; G155-G160 PolarHBondContact O-N 2.98Å; G155-K161 PolarHBondContact O-N 2.78Å; G155-N212 VanDerWaalsContact CA-OD1 3.24Å; G155-N212 WeakPolarHBondContact CA-OD1 3.36Å; G155-N212 PolarHBondContact N-ND2 3.43Å; G155-N212 PolarHBondContact N-OD1 3.16Å
156V87.1Confident83.3Confident74 Ų7459.9 Ų59.945%0.44831%0.313SS..Hα-helixtrans-65.7-49172.4-1780000110.1M152 L153 G160 Y163M152-V156 PolarHBondContact O-N 3.12Å; M152-V156 VanDerWaalsContact O-N 3.15Å; L153-V156 PolarHBondContact O-N 3.08Å; L153-V156 VanDerWaalsContact O-N 3.17Å; V156-G160 WeakPolarHBondContact O-CA 3.46Å; V156-G160 PolarHBondContact O-N 3.5Å; V156-Y163 HydrophobicContact CG2-CD2 3.53Å; V156-Y163 HydrophobicContact CG2-CE2 3.68Å
157F88.8Confident83.4Confident189 Ų18959 Ų5983%0.82931%0.307SS*.Hα-helixtrans-74.1-43.8-172.6-167.6-99000113.8L153 G154L153-F157 PolarHBondContact O-N 3.47Å; G154-F157 PolarHBondContact O-N 3Å
158I87.6Confident83.3Confident37 Ų3759.9 Ų59.919%0.1932%0.315CS..Hα-helixtrans-88.3-38-172.5-60.6169.7000111.9G154 V209 N212 V213 K216G154-I158 WeakPolarHBondContact O-CB 3.09Å; G154-I158 WeakPolarHBondContact O-CG1 3.28Å; G154-I158 PolarHBondContact O-N 3.27Å; I158-V209 HydrophobicContact CD1-CB 4.39Å; I158-V209 HydrophobicContact CD1-CG1 4.16Å; I158-V209 HydrophobicContact CD1-CG2 4.28Å; I158-N212 HydrophobicContact CB-CB 4.36Å; I158-N212 HydrophobicContact CD1-CB 3.96Å; I158-V213 HydrophobicContact CD1-CG2 4.37Å; I158-V213 HydrophobicContact CG2-CG2 4.2Å; I158-K216 HydrophobicContact CG2-CD 4.28Å; I158-K216 PolarHBondContact O-NZ 3.4Å
159Q82.1Confident83.2Confident42 Ų4262.6 Ų62.620%0.19633%0.334CS..Hα-helixtrans-105.1-11.5-176.3-61.3179.325.900113.7G155 K161 N212 E215 K216G155-Q159 WeakPolarHBondContact O-CB 3.28Å; G155-Q159 PolarHBondContact O-N 3.31Å; Q159-K161 HydrophobicContact CB-CD 4.38Å; Q159-K161 HydrophobicContact CB-CG 4.11Å; Q159-K161 PolarHBondContact O-N 2.76Å; Q159-N212 PolarHBondContact NE2-O 2.8Å; Q159-N212 PolarHBondContact NE2-OD1 2.82Å; Q159-E215 PolarHBondContact NE2-OE2 3.36Å; Q159-E215 PolarHBondContact OE1-OE2 2.9Å; Q159-K216 HydrophobicContact CG-CB 4.18Å
160G80Confident82.9Confident58 Ų5859.7 Ų59.760%0.59832%0.319SS*.  trans69.522.1-17700000113.5G155 V156G155-G160 PolarHBondContact O-N 2.98Å; V156-G160 WeakPolarHBondContact O-CA 3.46Å; V156-G160 PolarHBondContact O-N 3.5Å
161K80.6Confident82.4Confident58 Ų5858.2 Ų58.225%0.25231%0.31SS..PPolyproline II helixtrans-72.2143.3-179.6-77.9178169.9165.40111.4G155 Q159 Y163 E215G155-K161 PolarHBondContact O-N 2.78Å; Q159-K161 HydrophobicContact CB-CD 4.38Å; Q159-K161 HydrophobicContact CB-CG 4.11Å; Q159-K161 PolarHBondContact O-N 2.76Å; K161-Y163 HydrophobicContact CB-CE2 4.02Å; K161-E215 IonicContact NZ-OE1 3.99Å; K161-E215 PolarHBondContact NZ-OE1 3.06Å; K161-E215 IonicContact NZ-OE2 2.61Å; K161-E215 PolarHBondContact NZ-OE2 3.41Å
162R78.4Confident82.1Confident247 Ų24762.2 Ų62.293%0.93233%0.33SS*.PPolyproline II helixtrans-101.4121.9169.3-62-170.2-179.4-168.20.9108.5
163Y80.6Confident81.8Confident43 Ų4362.6 Ų62.617%0.16933%0.334CS..PPolyproline II helixtrans-97.6141.8174.3-63.5-78.9000109.4M152 V156 K161 L292M152-Y163 HydrophobicContact CG-CD1 4.33Å; M152-Y163 HydrophobicContact CG-CD2 3.73Å; M152-Y163 HydrophobicContact CG-CE1 4.47Å; M152-Y163 HydrophobicContact CG-CE2 3.89Å; M152-Y163 HydrophobicContact CG-CG 3.96Å; M152-Y163 VanDerWaalsContact O-CE2 3.26Å; M152-Y163 WeakPolarHBondContact O-CE2 3.15Å; M152-Y163 HydrophobicContact SD-CG 4.49Å; V156-Y163 HydrophobicContact CG2-CD2 3.53Å; V156-Y163 HydrophobicContact CG2-CE2 3.68Å; K161-Y163 HydrophobicContact CB-CE2 4.02Å; Y163-L292 HydrophobicContact CD1-CD2 3.75Å; Y163-L292 HydrophobicContact CE1-CB 4.27Å; Y163-L292 HydrophobicContact CE1-CD2 3.53Å; Y163-L292 HydrophobicContact CE1-CG 4.42Å
164N81.3Confident81.2Confident74 Ų7457.5 Ų57.540%0.39631%0.307SS..PPolyproline II helixtrans-71.6155.9174.7-162.1-2.4000110A166 D167 V168 D342N164-A166 PolarHBondContact O-N 2.75Å; N164-D167 WeakPolarHBondContact O-CB 3.49Å; N164-D167 PolarHBondContact O-N 2.97Å; N164-V168 PolarHBondContact O-N 3.18Å; N164-D342 PolarHBondContact ND2-OD1 3.37Å
165V79.8Confident80.6Confident116 Ų11657.2 Ų57.270%0.70330%0.303SS*.Hα-helixtrans-59.1-31.5178.7-178.80000111V168 S169V165-V168 PolarHBondContact O-N 3.26Å; V165-S169 WeakPolarHBondContact O-CB 3.12Å; V165-S169 PolarHBondContact O-N 3.29Å; V165-S169 PolarHBondContact O-OG 3.19Å
166A77.6Confident80.2Confident32 Ų3261.7 Ų61.726%0.26433%0.327SS..Hα-helixtrans-66.5-34.6175.500000113.6N164 S169 A170 S338N164-A166 PolarHBondContact O-N 2.75Å; A166-S169 WeakPolarHBondContact CA-OG 2.92Å; A166-S169 PolarHBondContact O-OG 3.07Å; A166-A170 VanDerWaalsContact O-CB 3.3Å; A166-A170 WeakPolarHBondContact O-CB 3.21Å; A166-A170 PolarHBondContact O-N 3.17Å; A166-S338 WeakPolarHBondContact CB-OG 3.46Å
167D76.7Confident79.5Confident7 Ų758.2 Ų58.24%0.03731%0.306CS..Hα-helixtrans-68.7-38.6174.2-79.7-2.4000110.8N164 A171 S338N164-D167 WeakPolarHBondContact O-CB 3.49Å; N164-D167 PolarHBondContact O-N 2.97Å; D167-A171 WeakPolarHBondContact O-CB 3.38Å; D167-A171 PolarHBondContact O-N 2.9Å; D167-S338 PolarHBondContact N-OG 3.35Å; D167-S338 WeakPolarHBondContact OD1-CB 3.23Å; D167-S338 PolarHBondContact OD1-OG 2.67Å
168V81.7Confident78.5Confident50 Ų5049.5 Ų49.530%0.30327%0.268SS..Hα-helixtrans-68.9-43.5177.2178.40000111M152 N164 V165 A171 I172M152-V168 HydrophobicContact CE-CB 4.13Å; M152-V168 HydrophobicContact CE-CG1 3.99Å; M152-V168 HydrophobicContact CE-CG2 3.76Å; M152-V168 HydrophobicContact SD-CB 4.43Å; M152-V168 HydrophobicContact SD-CG2 3.88Å; N164-V168 PolarHBondContact O-N 3.18Å; V165-V168 PolarHBondContact O-N 3.26Å; V168-A171 WeakPolarHBondContact O-CB 3.42Å; V168-A171 PolarHBondContact O-N 3.2Å; V168-I172 HydrophobicContact CG1-CD1 3.92Å; V168-I172 VanDerWaalsContact O-CG1 3.3Å; V168-I172 WeakPolarHBondContact O-CG1 3.4Å; V168-I172 PolarHBondContact O-N 2.94Å
169S80.1Confident77.7Confident58 Ų5852.3 Ų52.341%0.40628%0.282SS..Hα-helixtrans-66.6-38.8178.368.10000111.7V165 A166 I172 C173V165-S169 WeakPolarHBondContact O-CB 3.12Å; V165-S169 PolarHBondContact O-N 3.29Å; V165-S169 PolarHBondContact O-OG 3.19Å; A166-S169 WeakPolarHBondContact CA-OG 2.92Å; A166-S169 PolarHBondContact O-OG 3.07Å; S169-I172 PolarHBondContact O-N 3.48Å; S169-C173 WeakPolarHBondContact O-CB 3.39Å; S169-C173 PolarHBondContact O-N 3.43Å
170A78.9Confident77.3Confident0 Ų057.1 Ų57.10%030%0.299CS..Hα-helixtrans-64.1-40.2173.500000112.2A166 C173 M174 L334 N335A166-A170 VanDerWaalsContact O-CB 3.3Å; A166-A170 WeakPolarHBondContact O-CB 3.21Å; A166-A170 PolarHBondContact O-N 3.17Å; A170-C173 PolarHBondContact O-N 2.93Å; A170-M174 PolarHBondContact O-N 3.1Å; A170-L334 HydrophobicContact CB-CB 3.84Å; A170-N335 HydrophobicContact CB-CB 3.77Å
171A76.3Confident76.8Confident1 Ų155.2 Ų55.21%0.00827%0.274CS..Hα-helixtrans-61.8-44.2175.100000112.6L148 M152 D167 V168 S175L148-A171 HydrophobicContact CD2-CB 3.17Å; M152-A171 HydrophobicContact CE-CB 4.28Å; M152-A171 HydrophobicContact SD-CB 4.08Å; D167-A171 WeakPolarHBondContact O-CB 3.38Å; D167-A171 PolarHBondContact O-N 2.9Å; V168-A171 WeakPolarHBondContact O-CB 3.42Å; V168-A171 PolarHBondContact O-N 3.2Å; A171-S175 WeakPolarHBondContact O-CB 3.24Å; A171-S175 PolarHBondContact O-N 3.26Å; A171-S175 PolarHBondContact O-OG 3.3Å
172I80.8Confident76.1Confident86 Ų8653.2 Ų53.244%0.44127%0.267SS..Hα-helixtrans-65.6-46.3176.8-68.1166.5000110.1V168 S169 M174 S175 L176V168-I172 HydrophobicContact CG1-CD1 3.92Å; V168-I172 VanDerWaalsContact O-CG1 3.3Å; V168-I172 WeakPolarHBondContact O-CG1 3.4Å; V168-I172 PolarHBondContact O-N 2.94Å; S169-I172 PolarHBondContact O-N 3.48Å; I172-M174 PolarHBondContact O-N 2.89Å; I172-S175 PolarHBondContact O-N 2.9Å; I172-S175 VanDerWaalsContact O-N 3.1Å; I172-L176 HydrophobicContact CG2-CD1 3.9Å; I172-L176 HydrophobicContact CG2-CG 4.23Å; I172-L176 WeakPolarHBondContact O-CG 3.45Å; I172-L176 PolarHBondContact O-N 3.46Å
173C79.4Confident75.5Confident23 Ų2346.4 Ų46.416%0.15525%0.248CC..Hα-helixtrans-58.1-48177.9-1760000111.8S169 A170 S175 L176 G177 L327S169-C173 WeakPolarHBondContact O-CB 3.39Å; S169-C173 PolarHBondContact O-N 3.43Å; A170-C173 PolarHBondContact O-N 2.93Å; C173-S175 VanDerWaalsContact C-N 3.3Å; C173-S175 PolarHBondContact O-N 3.4Å; C173-L176 PolarHBondContact O-N 3.4Å; C173-G177 PolarHBondContact O-N 3.04Å; C173-L327 WeakPolarHBondContact O-CD2 3.45Å
174M75Confident74.9Confident1 Ų144.4 Ų44.41%0.00524%0.241CC..Hα-helixtrans-57.6-43.4173.9-78.4-166-120.900112.1L148 A170 I172 G177 L178 T296 G331 I332 N335L148-M174 HydrophobicContact CD1-CE 3.98Å; L148-M174 HydrophobicContact CD1-SD 3.79Å; A170-M174 PolarHBondContact O-N 3.1Å; I172-M174 PolarHBondContact O-N 2.89Å; M174-G177 PolarHBondContact O-N 3.3Å; M174-L178 WeakPolarHBondContact O-CD1 3.44Å; M174-L178 VanDerWaalsContact O-CG 3.26Å; M174-L178 WeakPolarHBondContact O-CG 3.28Å; M174-L178 PolarHBondContact O-N 3.18Å; M174-L178 VanDerWaalsContact O-N 3.1Å; M174-T296 HydrophobicContact CE-CG2 3.76Å; M174-T296 HydrophobicContact SD-CG2 4.28Å; M174-G331 VanDerWaalsContact CE-O 3.31Å; M174-G331 WeakPolarHBondContact CE-O 3.08Å; M174-G331 VanDerWaalsContact CG-C 3.43Å; M174-I332 HydrophobicContact CE-CG1 4.33Å; M174-I332 HydrophobicContact CG-CG1 4.4Å; M174-I332 HydrophobicContact SD-CG1 3.68Å; M174-N335 HydrophobicContact CE-CB 3.35Å; M174-N335 VanDerWaalsContact CE-ND2 3.26Å; M174-N335 WeakPolarHBondContact CE-ND2 3.45Å
175S73.6Confident74.1Confident5 Ų541.4 Ų41.44%0.03522%0.224CC..Hα-helixtrans-68.1-38.7-177.9-55.50000112.1I149 A171 I172 C173 L178 I179I149-S175 WeakPolarHBondContact CD1-OG 3.47Å; I149-S175 WeakPolarHBondContact CG1-OG 3.31Å; A171-S175 WeakPolarHBondContact O-CB 3.24Å; A171-S175 PolarHBondContact O-N 3.26Å; A171-S175 PolarHBondContact O-OG 3.3Å; I172-S175 PolarHBondContact O-N 2.9Å; I172-S175 VanDerWaalsContact O-N 3.1Å; C173-S175 VanDerWaalsContact C-N 3.3Å; C173-S175 PolarHBondContact O-N 3.4Å; S175-L178 PolarHBondContact O-N 3.04Å; S175-I179 WeakPolarHBondContact O-CD1 3.45Å; S175-I179 VanDerWaalsContact O-CG1 3.24Å; S175-I179 WeakPolarHBondContact O-CG1 2.92Å; S175-I179 PolarHBondContact O-N 3.35Å
176L77.2Confident73.2Confident95 Ų9537.5 Ų37.550%0.49720%0.202SC..Hα-helixtrans-62.8-41.1173.6-72.1172.9000111.7I172 C173 L178 I179 W180 L327I172-L176 HydrophobicContact CG2-CD1 3.9Å; I172-L176 HydrophobicContact CG2-CG 4.23Å; I172-L176 WeakPolarHBondContact O-CG 3.45Å; I172-L176 PolarHBondContact O-N 3.46Å; C173-L176 PolarHBondContact O-N 3.4Å; L176-L178 VanDerWaalsContact C-N 3.3Å; L176-L178 PolarHBondContact O-N 2.86Å; L176-I179 PolarHBondContact O-N 2.66Å; L176-W180 WeakPolarHBondContact O-CB 3.49Å; L176-W180 PolarHBondContact O-N 2.96Å; L176-L327 HydrophobicContact CB-CD2 4.25Å
177G73.3Confident72.4Confident0 Ų040.6 Ų40.60%022%0.218CC..Hα-helixtrans-61.3-41.3176.200000112C173 M174 W180 F181C173-G177 PolarHBondContact O-N 3.04Å; M174-G177 PolarHBondContact O-N 3.3Å; G177-W180 PolarHBondContact O-N 3.35Å; G177-F181 WeakPolarHBondContact O-CB 3.47Å; G177-F181 PolarHBondContact O-N 2.8Å
178L67.8Low71.5Confident7 Ų743 Ų434%0.03723%0.233CC..Hα-helixtrans-69.1-38.8176.4-65.9164.1000112.5I142 C145 M174 S175 L176 F181 T182 T299 V328I142-L178 HydrophobicContact CG2-CB 3.97Å; I142-L178 HydrophobicContact CG2-CD2 4.26Å; I142-L178 VanDerWaalsContact CG2-O 3.23Å; I142-L178 WeakPolarHBondContact CG2-O 3.28Å; C145-L178 HydrophobicContact CB-CD1 3.31Å; C145-L178 HydrophobicContact CB-CD2 3.49Å; C145-L178 VanDerWaalsContact CB-CD2 3.49Å; C145-L178 HydrophobicContact CB-CG 3.98Å; M174-L178 WeakPolarHBondContact O-CD1 3.44Å; M174-L178 VanDerWaalsContact O-CG 3.26Å; M174-L178 WeakPolarHBondContact O-CG 3.28Å; M174-L178 PolarHBondContact O-N 3.18Å; M174-L178 VanDerWaalsContact O-N 3.1Å; S175-L178 PolarHBondContact O-N 3.04Å; L176-L178 VanDerWaalsContact C-N 3.3Å; L176-L178 PolarHBondContact O-N 2.86Å; L178-F181 WeakPolarHBondContact O-CB 3.46Å; L178-F181 PolarHBondContact O-N 3.2Å; L178-T182 PolarHBondContact O-N 2.93Å; L178-T182 PolarHBondContact O-OG1 3.5Å; L178-T299 HydrophobicContact CD1-CG2 4.39Å; L178-V328 HydrophobicContact CD2-CG2 3.96Å; L178-V328 HydrophobicContact CG-CG2 4Å
179I71.3Confident70.2Confident96 Ų9642 Ų4249%0.49223%0.23SC..Hα-helixtrans-63.5-45.2174.9-69.6162000110.1S175 L176 F181 T182 L183S175-I179 WeakPolarHBondContact O-CD1 3.45Å; S175-I179 VanDerWaalsContact O-CG1 3.24Å; S175-I179 WeakPolarHBondContact O-CG1 2.92Å; S175-I179 PolarHBondContact O-N 3.35Å; L176-I179 PolarHBondContact O-N 2.66Å; I179-F181 VanDerWaalsContact C-N 3.31Å; I179-F181 PolarHBondContact O-N 3.08Å; I179-T182 WeakPolarHBondContact O-CB 3.23Å; I179-T182 PolarHBondContact O-N 2.95Å; I179-T182 VanDerWaalsContact O-N 3.13Å; I179-L183 WeakPolarHBondContact O-CB 3.44Å; I179-L183 PolarHBondContact O-N 3.38Å
180W74.1Confident68.8Low142 Ų14244.8 Ų44.854%0.53825%0.247SC..Hα-helixtrans-63.7-39.1177.4-148.3-36.5000111.6L176 G177 T182 L183 A184L176-W180 WeakPolarHBondContact O-CB 3.49Å; L176-W180 PolarHBondContact O-N 2.96Å; G177-W180 PolarHBondContact O-N 3.35Å; W180-T182 VanDerWaalsContact C-N 3.34Å; W180-L183 PolarHBondContact O-N 2.85Å; W180-A184 PolarHBondContact O-N 3.47Å
181F68.6Low67.8Low19 Ų1950.1 Ų50.18%0.08328%0.275CS..Hα-helixtrans-60.8-43.5172.5-165.5-80.7000111.4I142 G177 L178 I179 L183 A184 D185 I306 F310 Y321 S324I142-F181 HydrophobicContact CD1-CD1 3.47Å; I142-F181 VanDerWaalsContact CD1-CD1 3.47Å; I142-F181 HydrophobicContact CD1-CE1 3.87Å; I142-F181 HydrophobicContact CG1-CD1 3.79Å; I142-F181 HydrophobicContact CG1-CE1 4.18Å; G177-F181 WeakPolarHBondContact O-CB 3.47Å; G177-F181 PolarHBondContact O-N 2.8Å; L178-F181 WeakPolarHBondContact O-CB 3.46Å; L178-F181 PolarHBondContact O-N 3.2Å; I179-F181 VanDerWaalsContact C-N 3.31Å; I179-F181 PolarHBondContact O-N 3.08Å; F181-L183 VanDerWaalsContact C-N 3.34Å; F181-A184 PolarHBondContact O-N 3.44Å; F181-D185 PolarHBondContact O-N 3.13Å; F181-I306 HydrophobicContact CE1-CG2 3.74Å; F181-I306 HydrophobicContact CE2-CG2 4.34Å; F181-I306 HydrophobicContact CZ-CG2 3.38Å; F181-F310 HydrophobicContact CE1-CE2 4.26Å; F181-F310 HydrophobicContact CZ-CD2 4.43Å; F181-F310 AromaticContact CZ-CE2 3.75Å; F181-F310 HydrophobicContact CZ-CE2 3.75Å; F181-F310 HydrophobicContact CZ-CZ 4.48Å; F181-Y321 HydrophobicContact CD1-CD1 4.32Å; F181-Y321 HydrophobicContact CD1-CE1 4.35Å; F181-Y321 AromaticContact CD2-CD1 3.91Å; F181-Y321 HydrophobicContact CD2-CD1 3.91Å; F181-Y321 AromaticContact CE1-CD1 3.93Å; F181-Y321 HydrophobicContact CE1-CD1 3.93Å; F181-Y321 AromaticContact CE1-CE1 3.9Å; F181-Y321 HydrophobicContact CE1-CE1 3.9Å; F181-Y321 AromaticContact CE2-CD1 3.47Å; F181-Y321 HydrophobicContact CE2-CD1 3.47Å; F181-Y321 VanDerWaalsContact CE2-CD1 3.47Å; F181-Y321 HydrophobicContact CE2-CE1 4.28Å; F181-Y321 HydrophobicContact CE2-CG 4.27Å; F181-Y321 HydrophobicContact CG-CD1 4.3Å; F181-Y321 AromaticContact CZ-CD1 3.46Å; F181-Y321 HydrophobicContact CZ-CD1 3.46Å; F181-Y321 VanDerWaalsContact CZ-CD1 3.46Å; F181-Y321 AromaticContact CZ-CE1 3.85Å; F181-Y321 HydrophobicContact CZ-CE1 3.85Å; F181-Y321 HydrophobicContact CZ-CG 4.44Å; F181-S324 VanDerWaalsContact CD2-OG 3.25Å; F181-S324 WeakPolarHBondContact CD2-OG 3.49Å
182T65.6Low67.1Low16 Ų1655.1 Ų55.110%0.09830%0.297CS..Hα-helixtrans-64.6-39.5176.5-46.20000111.7T139 I142 L178 I179 W180 A184 D185 S186T139-T182 HydrophobicContact CG2-CG2 4.2Å; I142-T182 HydrophobicContact CD1-CG2 4.42Å; I142-T182 WeakPolarHBondContact CG2-OG1 3.27Å; L178-T182 PolarHBondContact O-N 2.93Å; L178-T182 PolarHBondContact O-OG1 3.5Å; I179-T182 WeakPolarHBondContact O-CB 3.23Å; I179-T182 PolarHBondContact O-N 2.95Å; I179-T182 VanDerWaalsContact O-N 3.13Å; W180-T182 VanDerWaalsContact C-N 3.34Å; T182-A184 VanDerWaalsContact C-N 3.33Å; T182-D185 WeakPolarHBondContact O-CB 3.5Å; T182-D185 PolarHBondContact O-N 2.98Å; T182-S186 WeakPolarHBondContact O-CB 3.33Å; T182-S186 PolarHBondContact O-N 3.47Å; T182-S186 PolarHBondContact O-OG 3.2Å
183L66.2Low67Low104 Ų10454.3 Ų54.355%0.54529%0.294SS..Hα-helixtrans-64.4-42.5179.8-164.570.9000110.3I179 W180 F181 D185 S186 T187I179-L183 WeakPolarHBondContact O-CB 3.44Å; I179-L183 PolarHBondContact O-N 3.38Å; W180-L183 PolarHBondContact O-N 2.85Å; F181-L183 VanDerWaalsContact C-N 3.34Å; L183-D185 VanDerWaalsContact C-N 3.32Å; L183-D185 PolarHBondContact O-N 3.17Å; L183-S186 WeakPolarHBondContact CA-OG 3.47Å; L183-S186 PolarHBondContact O-N 2.93Å; L183-S186 PolarHBondContact O-OG 3.06Å; L183-T187 WeakPolarHBondContact O-CG2 3.42Å; L183-T187 PolarHBondContact O-N 2.61Å; L183-T187 VanDerWaalsContact O-N 3.1Å; L183-T187 PolarHBondContact O-OG1 3.37Å
184A68.3Low67.1Low1 Ų159.3 Ų59.31%0.00832%0.318CS..Hα-helixtrans-62.7-35.4172.800000113.1W180 F181 T182 T187 T188 Q320 Y321W180-A184 PolarHBondContact O-N 3.47Å; F181-A184 PolarHBondContact O-N 3.44Å; T182-A184 VanDerWaalsContact C-N 3.33Å; A184-T187 PolarHBondContact O-OG1 3.12Å; A184-T188 PolarHBondContact O-OG1 3.49Å; A184-Q320 HydrophobicContact CB-CB 3.61Å; A184-Y321 HydrophobicContact CB-CD1 4.17Å; A184-Y321 HydrophobicContact CB-CE1 4.04Å
185D64.8Low67.5Low10 Ų1062.5 Ų62.55%0.05334%0.338CS..Hα-helixtrans-69.5-43.4174.2-166.958.2000111.4T139 I142 F181 T182 L183 T187 T188 A189 Y321T139-D185 PolarHBondContact OG1-OD2 2.95Å; I142-D185 HydrophobicContact CD1-CB 4.3Å; F181-D185 PolarHBondContact O-N 3.13Å; T182-D185 WeakPolarHBondContact O-CB 3.5Å; T182-D185 PolarHBondContact O-N 2.98Å; L183-D185 VanDerWaalsContact C-N 3.32Å; L183-D185 PolarHBondContact O-N 3.17Å; D185-T187 PolarHBondContact O-N 2.83Å; D185-T188 PolarHBondContact O-N 3.36Å; D185-T188 PolarHBondContact O-OG1 2.76Å; D185-A189 PolarHBondContact O-N 2.93Å; D185-Y321 VanDerWaalsContact CA-OH 3.26Å; D185-Y321 WeakPolarHBondContact CA-OH 3.27Å; D185-Y321 HydrophobicContact CB-CE1 4.25Å; D185-Y321 PolarHBondContact OD1-OH 3.34Å
186S60.9Low67.9Low35 Ų3562.2 Ų62.225%0.24534%0.336CS..Hα-helixtrans-66.6-31.7-178.4720000114.1T182 L183 T188 A189T182-S186 WeakPolarHBondContact O-CB 3.33Å; T182-S186 PolarHBondContact O-N 3.47Å; T182-S186 PolarHBondContact O-OG 3.2Å; L183-S186 WeakPolarHBondContact CA-OG 3.47Å; L183-S186 PolarHBondContact O-N 2.93Å; L183-S186 PolarHBondContact O-OG 3.06Å; S186-T188 PolarHBondContact O-N 2.86Å; S186-A189 CarbonylContact O-C 3.6Å
187T60.3Low68.2Low97 Ų9758.9 Ų58.960%0.59532%0.319SS*.Hα-helixtrans-70.4-24.1173.753.50000112L183 A184 D185L183-T187 WeakPolarHBondContact O-CG2 3.42Å; L183-T187 PolarHBondContact O-N 2.61Å; L183-T187 VanDerWaalsContact O-N 3.1Å; L183-T187 PolarHBondContact O-OG1 3.37Å; A184-T187 PolarHBondContact O-OG1 3.12Å; D185-T187 PolarHBondContact O-N 2.83Å
188T57Low68.9Low56 Ų5662.5 Ų62.534%0.34434%0.341SS..Hα-helixtrans-92.8-24.1178.161.20000113.9A184 D185 S186 T318 Y321A184-T188 PolarHBondContact O-OG1 3.49Å; D185-T188 PolarHBondContact O-N 3.36Å; D185-T188 PolarHBondContact O-OG1 2.76Å; S186-T188 PolarHBondContact O-N 2.86Å; T188-T318 HydrophobicContact CG2-CG2 3.94Å; T188-Y321 PolarHBondContact OG1-OH 3.37Å
189A54.3Low69.8Low30 Ų3063.8 Ų63.825%0.24835%0.348CS..  trans-143.5101.1179.100000112.6D185 S186 N191D185-A189 PolarHBondContact O-N 2.93Å; S186-A189 CarbonylContact O-C 3.6Å; A189-N191 VanDerWaalsContact C-N 3.3Å; A189-N191 PolarHBondContact O-N 3.07Å
190P52.2Low70.6Confident116 Ų11659.2 Ų59.275%0.75333%0.325SS*.  trans-83.225.9-16633.3-36.5000116F192P190-F192 VanDerWaalsContact C-N 3.3Å; P190-F192 PolarHBondContact O-N 3.33Å; P190-F192 VanDerWaalsContact O-N 3.12Å
191N56.7Low71.2Confident112 Ų11254.7 Ų54.760%0.59931%0.314SS*.  trans-87.867.9174.6-78.3-52.1000111A189A189-N191 VanDerWaalsContact C-N 3.3Å; A189-N191 PolarHBondContact O-N 3.07Å
192F62.3Low72.3Confident106 Ų10658.3 Ų58.347%0.46533%0.334SS..BIsolated β-bridgetrans-111.395.6178.9-165.7-92.7000110.5L135 T139 F143 P190 V197L135-F192 HydrophobicContact CD2-CD2 4.26Å; T139-F192 HydrophobicContact CG2-CD2 4.18Å; T139-F192 HydrophobicContact CG2-CE2 4.28Å; F143-F192 AromaticContact CE2-CE2 3.75Å; F143-F192 HydrophobicContact CE2-CE2 3.75Å; F143-F192 HydrophobicContact CE2-CZ 4.25Å; F143-F192 AromaticContact CZ-CE2 3.81Å; F143-F192 HydrophobicContact CZ-CE2 3.81Å; F143-F192 AromaticContact CZ-CZ 3.86Å; F143-F192 HydrophobicContact CZ-CZ 3.86Å; P190-F192 VanDerWaalsContact C-N 3.3Å; P190-F192 PolarHBondContact O-N 3.33Å; P190-F192 VanDerWaalsContact O-N 3.12Å; F192-V197 HydrophobicContact CD1-CG2 4.3Å; F192-V197 HydrophobicContact CE1-CG2 3.55Å; F192-V197 HydrophobicContact CE2-CG2 3.94Å; F192-V197 HydrophobicContact CZ-CG2 3.35Å
193N77.8Confident73.5Confident69 Ų6957.6 Ų57.637%0.36933%0.33SS..  trans-99129.8177.9-169-33.4000111.1Y134 T195 G196 V197Y134-N193 HydrophobicContact CD1-CB 4.43Å; N193-T195 PolarHBondContact O-N 3.41Å; N193-T195 PolarHBondContact OD1-N 2.85Å; N193-T195 PolarHBondContact OD1-OG1 3.3Å; N193-G196 PolarHBondContact O-N 2.89Å; N193-V197 PolarHBondContact O-N 3Å
194L81.1Confident74.6Confident128 Ų12853.1 Ų53.167%0.6731%0.306SS*.Hα-helixtrans-54.1-37.4179.2-173.368.3000112.5G196 V197 V198L194-G196 VanDerWaalsContact C-N 3.3Å; L194-G196 PolarHBondContact O-N 3.48Å; L194-V197 WeakPolarHBondContact O-CB 3.42Å; L194-V197 PolarHBondContact O-N 3.45Å; L194-V197 VanDerWaalsContact O-N 3.12Å; L194-V198 WeakPolarHBondContact O-CG2 3.46Å; L194-V198 PolarHBondContact O-N 3.33Å
195T84.7Confident75.7Confident68 Ų6856.4 Ų56.442%0.41733%0.329SS..Hα-helixtrans-59.8-41.2177.7-56.30000111.6Y134 N193 V197 V198 L199Y134-T195 HydrophobicContact CE1-CG2 4.27Å; Y134-T195 HydrophobicContact CE2-CG2 4.37Å; N193-T195 PolarHBondContact O-N 3.41Å; N193-T195 PolarHBondContact OD1-N 2.85Å; N193-T195 PolarHBondContact OD1-OG1 3.3Å; T195-V197 VanDerWaalsContact C-N 3.34Å; T195-V197 PolarHBondContact O-N 2.97Å; T195-V198 PolarHBondContact O-N 3.14Å; T195-L199 HydrophobicContact CG2-CD1 4.2Å; T195-L199 WeakPolarHBondContact O-CB 3.35Å; T195-L199 VanDerWaalsContact O-CG 3.26Å; T195-L199 WeakPolarHBondContact O-CG 3.25Å; T195-L199 PolarHBondContact O-N 3.3Å
196G82.4Confident77.1Confident0 Ų056.7 Ų56.70%033%0.332CS..Hα-helixtrans-64.5-38175.800000112.7N193 L194 L199 I200N193-G196 PolarHBondContact O-N 2.89Å; L194-G196 VanDerWaalsContact C-N 3.3Å; L194-G196 PolarHBondContact O-N 3.48Å; G196-L199 PolarHBondContact O-N 3.21Å; G196-I200 WeakPolarHBondContact O-CG2 3.32Å; G196-I200 PolarHBondContact O-N 3.1Å
197V82.5Confident78.5Confident24 Ų2457.1 Ų57.115%0.14533%0.332CS..Hα-helixtrans-65.2-43.7176.7-178.90000111.3L135 F143 F192 N193 L194 T195 I200 S201L135-V197 HydrophobicContact CD2-CG2 4.38Å; F143-V197 HydrophobicContact CE1-CG1 3.97Å; F143-V197 HydrophobicContact CE2-CG2 4.22Å; F143-V197 HydrophobicContact CZ-CB 4.4Å; F143-V197 HydrophobicContact CZ-CG1 3.89Å; F143-V197 HydrophobicContact CZ-CG2 3.88Å; F192-V197 HydrophobicContact CD1-CG2 4.3Å; F192-V197 HydrophobicContact CE1-CG2 3.55Å; F192-V197 HydrophobicContact CE2-CG2 3.94Å; F192-V197 HydrophobicContact CZ-CG2 3.35Å; N193-V197 PolarHBondContact O-N 3Å; L194-V197 WeakPolarHBondContact O-CB 3.42Å; L194-V197 PolarHBondContact O-N 3.45Å; L194-V197 VanDerWaalsContact O-N 3.12Å; T195-V197 VanDerWaalsContact C-N 3.34Å; T195-V197 PolarHBondContact O-N 2.97Å; V197-I200 VanDerWaalsContact O-CG2 3.31Å; V197-I200 WeakPolarHBondContact O-CG2 3.32Å; V197-S201 VanDerWaalsContact O-CB 3.24Å; V197-S201 WeakPolarHBondContact O-CB 3.42Å; V197-S201 PolarHBondContact O-N 2.82Å; V197-S201 PolarHBondContact O-OG 3.08Å
198V87.8Confident80Confident77 Ų7752.6 Ų52.647%0.46731%0.305SS..Hα-helixtrans-63.8-46.8176.8174.30000110.8L194 T195 I200 S201 L202L194-V198 WeakPolarHBondContact O-CG2 3.46Å; L194-V198 PolarHBondContact O-N 3.33Å; T195-V198 PolarHBondContact O-N 3.14Å; V198-I200 PolarHBondContact O-N 3.08Å; V198-S201 PolarHBondContact O-N 2.93Å; V198-L202 HydrophobicContact CG1-CD1 4.18Å; V198-L202 WeakPolarHBondContact O-CD1 3.37Å; V198-L202 PolarHBondContact O-N 3.42Å
199L87.9Confident81.7Confident34 Ų3452.4 Ų52.418%0.17830%0.303CS..Hα-helixtrans-59.6-48.1178.7-72.8170.9000112.1L127 T130 Y134 T195 G196 S201 L202 A203L127-L199 HydrophobicContact CD2-CD2 3.52Å; T130-L199 HydrophobicContact CG2-CD1 3.9Å; Y134-L199 HydrophobicContact CD2-CD1 3.97Å; Y134-L199 HydrophobicContact CE2-CD1 4.04Å; T195-L199 HydrophobicContact CG2-CD1 4.2Å; T195-L199 WeakPolarHBondContact O-CB 3.35Å; T195-L199 VanDerWaalsContact O-CG 3.26Å; T195-L199 WeakPolarHBondContact O-CG 3.25Å; T195-L199 PolarHBondContact O-N 3.3Å; G196-L199 PolarHBondContact O-N 3.21Å; L199-S201 VanDerWaalsContact C-N 3.33Å; L199-S201 PolarHBondContact O-N 3.28Å; L199-L202 PolarHBondContact O-N 2.86Å; L199-A203 PolarHBondContact O-N 3.08Å; L199-A203 VanDerWaalsContact O-N 3.08Å
200I87.5Confident83.5Confident0 Ų051.5 Ų51.50%029%0.294CS..Hα-helixtrans-66.3-39.1178.9-163.262.8000110.4L135 Q140 F143 K144 G196 V197 V198 L202 A203 L204L135-I200 HydrophobicContact CD1-CG2 4.17Å; Q140-I200 HydrophobicContact CG-CD1 3.82Å; Q140-I200 HydrophobicContact CG-CG1 4.39Å; F143-I200 HydrophobicContact CB-CB 4.44Å; F143-I200 HydrophobicContact CB-CG1 3.69Å; F143-I200 HydrophobicContact CB-CG2 3.81Å; F143-I200 HydrophobicContact CD1-CG2 3.92Å; F143-I200 HydrophobicContact CD2-CG2 4.02Å; F143-I200 HydrophobicContact CG-CG1 4.45Å; F143-I200 HydrophobicContact CG-CG2 3.65Å; K144-I200 HydrophobicContact CG-CD1 4.14Å; G196-I200 WeakPolarHBondContact O-CG2 3.32Å; G196-I200 PolarHBondContact O-N 3.1Å; V197-I200 VanDerWaalsContact O-CG2 3.31Å; V197-I200 WeakPolarHBondContact O-CG2 3.32Å; V198-I200 PolarHBondContact O-N 3.08Å; I200-L202 PolarHBondContact O-N 3.38Å; I200-A203 HydrophobicContact CD1-CB 4.44Å; I200-A203 CarbonylContact O-C 3.6Å; I200-A203 WeakPolarHBondContact O-CA 3.46Å; I200-A203 VanDerWaalsContact O-CB 3.32Å; I200-A203 WeakPolarHBondContact O-CB 3.17Å; I200-A203 PolarHBondContact O-N 3.41Å; I200-L204 VanDerWaalsContact O-CG 3.28Å; I200-L204 WeakPolarHBondContact O-CG 3.22Å; I200-L204 PolarHBondContact O-N 3.22Å
201S86.6Confident85.2Confident46 Ų4646.4 Ų46.432%0.32226%0.263SS..Hα-helixtrans-61.4-42.9178.9-59.80000112.3V197 V198 L199 A203 L204 C205V197-S201 VanDerWaalsContact O-CB 3.24Å; V197-S201 WeakPolarHBondContact O-CB 3.42Å; V197-S201 PolarHBondContact O-N 2.82Å; V197-S201 PolarHBondContact O-OG 3.08Å; V198-S201 PolarHBondContact O-N 2.93Å; L199-S201 VanDerWaalsContact C-N 3.33Å; L199-S201 PolarHBondContact O-N 3.28Å; S201-A203 VanDerWaalsContact C-N 3.34Å; S201-A203 PolarHBondContact O-N 2.97Å; S201-L204 PolarHBondContact O-N 3.41Å; S201-C205 PolarHBondContact O-N 3.18Å; S201-C205 VanDerWaalsContact O-N 3.07Å; S201-C205 PolarHBondContact O-SG 2.89Å; S201-C205 VanDerWaalsContact O-SG 3.41Å
202L90.9Very high86.9Confident96 Ų9641 Ų4150%0.50323%0.234SC..Hα-helixtrans-61.1-42.2172-97.969.4000111.8L127 V198 L199 I200 L204 C205 A206L127-L202 HydrophobicContact CD1-CB 4.07Å; V198-L202 HydrophobicContact CG1-CD1 4.18Å; V198-L202 WeakPolarHBondContact O-CD1 3.37Å; V198-L202 PolarHBondContact O-N 3.42Å; L199-L202 PolarHBondContact O-N 2.86Å; I200-L202 PolarHBondContact O-N 3.38Å; L202-L204 VanDerWaalsContact C-N 3.32Å; L202-L204 PolarHBondContact O-N 3.41Å; L202-C205 PolarHBondContact O-N 2.83Å; L202-A206 PolarHBondContact O-N 2.98Å
203A91.4Very high88.3Confident1 Ų137.3 Ų37.31%0.00822%0.22CC..Hα-helixtrans-60.5-40.5175.900000111.8T124 L127 L199 I200 S201 A206 D207T124-A203 HydrophobicContact CG2-CB 3.94Å; T124-A203 PolarHBondContact OG1-O 2.88Å; L127-A203 HydrophobicContact CB-CB 3.95Å; L199-A203 PolarHBondContact O-N 3.08Å; L199-A203 VanDerWaalsContact O-N 3.08Å; I200-A203 HydrophobicContact CD1-CB 4.44Å; I200-A203 CarbonylContact O-C 3.6Å; I200-A203 WeakPolarHBondContact O-CA 3.46Å; I200-A203 VanDerWaalsContact O-CB 3.32Å; I200-A203 WeakPolarHBondContact O-CB 3.17Å; I200-A203 PolarHBondContact O-N 3.41Å; S201-A203 VanDerWaalsContact C-N 3.34Å; S201-A203 PolarHBondContact O-N 2.97Å; A203-A206 PolarHBondContact O-N 3.3Å; A203-D207 PolarHBondContact O-N 2.94Å
204L89.8Confident88.9Confident9 Ų934.7 Ų34.75%0.04721%0.205CC..Hα-helixtrans-66.4-37.9177.4-58172.8000112.5F143 K144 C146 K147 I200 S201 L202 D207 A208F143-L204 WeakPolarHBondContact O-CD1 3.26Å; F143-L204 WeakPolarHBondContact O-CD2 3.46Å; K144-L204 HydrophobicContact CB-CD2 4.36Å; K144-L204 HydrophobicContact CG-CD2 4.23Å; C146-L204 HydrophobicContact CB-CD1 4.37Å; K147-L204 HydrophobicContact CB-CB 4.46Å; K147-L204 HydrophobicContact CB-CD2 3.89Å; I200-L204 VanDerWaalsContact O-CG 3.28Å; I200-L204 WeakPolarHBondContact O-CG 3.22Å; I200-L204 PolarHBondContact O-N 3.22Å; S201-L204 PolarHBondContact O-N 3.41Å; L202-L204 VanDerWaalsContact C-N 3.32Å; L202-L204 PolarHBondContact O-N 3.41Å; L204-D207 PolarHBondContact O-N 3.22Å; L204-A208 WeakPolarHBondContact O-CB 3.41Å; L204-A208 PolarHBondContact O-N 3.44Å
205C91.8Very high89.3Confident71 Ų7128.6 Ų28.648%0.4817%0.174SC..Hα-helixtrans-63.9-43.6174.3-70.50000111.1S201 L202 A208 V209S201-C205 PolarHBondContact O-N 3.18Å; S201-C205 VanDerWaalsContact O-N 3.07Å; S201-C205 PolarHBondContact O-SG 2.89Å; S201-C205 VanDerWaalsContact O-SG 3.41Å; L202-C205 PolarHBondContact O-N 2.83Å; C205-A208 WeakPolarHBondContact O-CB 3.14Å; C205-A208 PolarHBondContact O-N 3.35Å; C205-V209 WeakPolarHBondContact O-CG2 3.26Å; C205-V209 PolarHBondContact O-N 3.49Å
206A92.4Very high89.5Confident15 Ų1530.4 Ų30.412%0.12418%0.176CC..Hα-helixtrans-64-42.7174.500000111.8L120 T124 L202 A203 A208 V209 I210L120-A206 HydrophobicContact CD2-CB 4.11Å; T124-A206 WeakPolarHBondContact OG1-CB 3.26Å; L202-A206 PolarHBondContact O-N 2.98Å; A203-A206 PolarHBondContact O-N 3.3Å; A206-A208 VanDerWaalsContact C-N 3.26Å; A206-A208 PolarHBondContact O-N 2.84Å; A206-V209 PolarHBondContact O-N 2.96Å; A206-V209 VanDerWaalsContact O-N 3.16Å; A206-I210 WeakPolarHBondContact O-CD1 3.24Å; A206-I210 WeakPolarHBondContact O-CG1 3.23Å; A206-I210 PolarHBondContact O-N 2.87Å
207D91.2Very high89.8Confident44 Ų4430.8 Ų30.824%0.23518%0.178CC..Hα-helixtrans-56.4-38.7172-88.5-21.5000112.8T124 A203 L204 I210 G211T124-D207 VanDerWaalsContact CG2-CG 3.43Å; T124-D207 WeakPolarHBondContact CG2-OD1 3.27Å; A203-D207 PolarHBondContact O-N 2.94Å; L204-D207 PolarHBondContact O-N 3.22Å; D207-I210 PolarHBondContact O-N 3.48Å; D207-G211 PolarHBondContact O-N 3.4Å
208A91.1Very high89.9Confident3 Ų329.6 Ų29.63%0.02517%0.171CC..Hα-helixtrans-66.7-42.5176.200000112.8P150 V151 L204 C205 A206 N212P150-A208 HydrophobicContact CB-CB 3.61Å; P150-A208 WeakPolarHBondContact O-CB 3.49Å; V151-A208 HydrophobicContact CB-CB 4.39Å; V151-A208 HydrophobicContact CG2-CB 3.82Å; L204-A208 WeakPolarHBondContact O-CB 3.41Å; L204-A208 PolarHBondContact O-N 3.44Å; C205-A208 WeakPolarHBondContact O-CB 3.14Å; C205-A208 PolarHBondContact O-N 3.35Å; A206-A208 VanDerWaalsContact C-N 3.26Å; A206-A208 PolarHBondContact O-N 2.84Å; A208-N212 WeakPolarHBondContact O-CB 3.34Å; A208-N212 PolarHBondContact O-N 3.13Å; A208-N212 PolarHBondContact O-ND2 3.3Å
209V93.1Very high89.7Confident52 Ų5230.3 Ų30.332%0.31517%0.168SC..Hα-helixtrans-64.2-45.8174.5177.50000109.9L120 I158 C205 A206 G211 N212 V213L120-V209 HydrophobicContact CD1-CB 4.06Å; L120-V209 HydrophobicContact CD1-CG1 3.53Å; I158-V209 HydrophobicContact CD1-CB 4.39Å; I158-V209 HydrophobicContact CD1-CG1 4.16Å; I158-V209 HydrophobicContact CD1-CG2 4.28Å; C205-V209 WeakPolarHBondContact O-CG2 3.26Å; C205-V209 PolarHBondContact O-N 3.49Å; A206-V209 PolarHBondContact O-N 2.96Å; A206-V209 VanDerWaalsContact O-N 3.16Å; V209-G211 PolarHBondContact O-N 2.82Å; V209-N212 PolarHBondContact O-N 3.31Å; V209-V213 HydrophobicContact CG1-CG2 3.88Å; V209-V213 VanDerWaalsContact O-CB 3.31Å; V209-V213 WeakPolarHBondContact O-CB 3.46Å; V209-V213 VanDerWaalsContact O-CG2 3.24Å; V209-V213 WeakPolarHBondContact O-CG2 3.48Å; V209-V213 PolarHBondContact O-N 3.45Å
210I91.7Very high89.5Confident10 Ų1034.5 Ų34.55%0.05119%0.19CC..Hα-helixtrans-54.5-57.2178-68.1161.8000110.3I117 L120 A206 D207 N212 V213 Q214I117-I210 HydrophobicContact CG2-CG2 4.27Å; L120-I210 HydrophobicContact CB-CD1 3.76Å; L120-I210 HydrophobicContact CB-CG1 3.52Å; L120-I210 HydrophobicContact CD1-CG1 4.21Å; A206-I210 WeakPolarHBondContact O-CD1 3.24Å; A206-I210 WeakPolarHBondContact O-CG1 3.23Å; A206-I210 PolarHBondContact O-N 2.87Å; D207-I210 PolarHBondContact O-N 3.48Å; I210-N212 VanDerWaalsContact C-N 3.3Å; I210-N212 PolarHBondContact O-N 2.98Å; I210-V213 PolarHBondContact O-N 2.89Å; I210-Q214 VanDerWaalsContact CG2-CD 3.46Å; I210-Q214 HydrophobicContact CG2-CG 4.05Å; I210-Q214 WeakPolarHBondContact O-CB 3.5Å; I210-Q214 WeakPolarHBondContact O-CG 3.21Å; I210-Q214 PolarHBondContact O-N 2.64Å
211G89.6Confident89.1Confident9 Ų937.4 Ų37.49%0.09320%0.204CC..Hα-helixtrans-60.3-38.4-176.400000113.3D207 V209 E215D207-G211 PolarHBondContact O-N 3.4Å; V209-G211 PolarHBondContact O-N 2.82Å; G211-E215 WeakPolarHBondContact O-CB 3.4Å; G211-E215 PolarHBondContact O-N 3.37Å
212N91.9Very high88.5Confident0 Ų038.6 Ų38.60%021%0.206CC..Hα-helixtrans-76.1-38.4-179.9-76.5-57.8000113.3V151 G155 I158 Q159 A208 V209 I210 K216V151-N212 PolarHBondContact O-ND2 3.4Å; G155-N212 VanDerWaalsContact CA-OD1 3.24Å; G155-N212 WeakPolarHBondContact CA-OD1 3.36Å; G155-N212 PolarHBondContact N-ND2 3.43Å; G155-N212 PolarHBondContact N-OD1 3.16Å; I158-N212 HydrophobicContact CB-CB 4.36Å; I158-N212 HydrophobicContact CD1-CB 3.96Å; Q159-N212 PolarHBondContact NE2-O 2.8Å; Q159-N212 PolarHBondContact NE2-OD1 2.82Å; A208-N212 WeakPolarHBondContact O-CB 3.34Å; A208-N212 PolarHBondContact O-N 3.13Å; A208-N212 PolarHBondContact O-ND2 3.3Å; V209-N212 PolarHBondContact O-N 3.31Å; I210-N212 VanDerWaalsContact C-N 3.3Å; I210-N212 PolarHBondContact O-N 2.98Å; N212-K216 WeakPolarHBondContact O-CB 3.47Å; N212-K216 PolarHBondContact O-N 2.95Å
213V91.3Very high87.8Confident27 Ų2734 Ų3416%0.16418%0.182CC..Hα-helixtrans-68.7-41174.4172.50000110.2T113 I117 I158 V209 I210 K216 A217T113-V213 HydrophobicContact CG2-CG1 3.62Å; I117-V213 HydrophobicContact CD1-CG1 3.85Å; I117-V213 HydrophobicContact CG1-CG1 3.9Å; I158-V213 HydrophobicContact CD1-CG2 4.37Å; I158-V213 HydrophobicContact CG2-CG2 4.2Å; V209-V213 HydrophobicContact CG1-CG2 3.88Å; V209-V213 VanDerWaalsContact O-CB 3.31Å; V209-V213 WeakPolarHBondContact O-CB 3.46Å; V209-V213 VanDerWaalsContact O-CG2 3.24Å; V209-V213 WeakPolarHBondContact O-CG2 3.48Å; V209-V213 PolarHBondContact O-N 3.45Å; I210-V213 PolarHBondContact O-N 2.89Å; V213-K216 PolarHBondContact O-N 2.88Å; V213-A217 VanDerWaalsContact O-CB 3.28Å; V213-A217 WeakPolarHBondContact O-CB 3.27Å; V213-A217 PolarHBondContact O-N 2.83Å
214Q90.3Very high87.2Confident15 Ų1534.8 Ų34.87%0.0719%0.188CC..Hα-helixtrans-57.6-51.3174.4-76.1178.4-21.700110.7I117 I210 K216 A217 M218 M228I117-Q214 HydrophobicContact CD1-CG 3.96Å; I117-Q214 HydrophobicContact CG1-CG 4.48Å; I117-Q214 HydrophobicContact CG2-CG 4.24Å; I210-Q214 VanDerWaalsContact CG2-CD 3.46Å; I210-Q214 HydrophobicContact CG2-CG 4.05Å; I210-Q214 WeakPolarHBondContact O-CB 3.5Å; I210-Q214 WeakPolarHBondContact O-CG 3.21Å; I210-Q214 PolarHBondContact O-N 2.64Å; Q214-K216 PolarHBondContact O-N 2.82Å; Q214-A217 PolarHBondContact O-N 2.71Å; Q214-M218 VanDerWaalsContact O-CB 3.31Å; Q214-M218 WeakPolarHBondContact O-CB 3.45Å; Q214-M218 WeakPolarHBondContact O-CG 3.49Å; Q214-M218 PolarHBondContact O-N 3.43Å; Q214-M228 HydrophobicContact CB-CE 3.98Å; Q214-M228 HydrophobicContact CG-CE 3.55Å
215E89.9Confident86.8Confident0 Ų034.6 Ų34.60%019%0.187CC..Hα-helixtrans-58.1-48.3177.2-179.7178.5-174.700112.2Q159 K161 G211 A217 M218 K219 I286 G290 A291Q159-E215 PolarHBondContact NE2-OE2 3.36Å; Q159-E215 PolarHBondContact OE1-OE2 2.9Å; K161-E215 IonicContact NZ-OE1 3.99Å; K161-E215 PolarHBondContact NZ-OE1 3.06Å; K161-E215 IonicContact NZ-OE2 2.61Å; K161-E215 PolarHBondContact NZ-OE2 3.41Å; G211-E215 WeakPolarHBondContact O-CB 3.4Å; G211-E215 PolarHBondContact O-N 3.37Å; E215-A217 PolarHBondContact O-N 3.28Å; E215-M218 PolarHBondContact O-N 3.49Å; E215-K219 HydrophobicContact CG-CD 3.97Å; E215-K219 WeakPolarHBondContact O-CB 3.37Å; E215-K219 WeakPolarHBondContact O-CG 3.11Å; E215-K219 PolarHBondContact O-N 3.12Å; E215-K219 WeakPolarHBondContact OE1-CE 3.44Å; E215-K219 IonicContact OE1-NZ 2.71Å; E215-K219 PolarHBondContact OE1-NZ 3.47Å; E215-I286 HydrophobicContact CB-CG2 3.52Å; E215-I286 HydrophobicContact CG-CG2 4.04Å; E215-G290 WeakPolarHBondContact OE1-CA 3.37Å; E215-A291 HydrophobicContact CB-CB 4.37Å; E215-A291 VanDerWaalsContact OE2-CB 3.24Å; E215-A291 WeakPolarHBondContact OE2-CB 3.28Å; E215-A291 PolarHBondContact OE2-N 3.49Å
216K88.8Confident86.4Confident106 Ų10631.2 Ų31.246%0.46116%0.164SC..Hα-helixtrans-61.1-46.1-179-171.3174.5-176.4172.70111.5I158 Q159 N212 V213 Q214 L220I158-K216 HydrophobicContact CG2-CD 4.28Å; I158-K216 PolarHBondContact O-NZ 3.4Å; Q159-K216 HydrophobicContact CG-CB 4.18Å; N212-K216 WeakPolarHBondContact O-CB 3.47Å; N212-K216 PolarHBondContact O-N 2.95Å; V213-K216 PolarHBondContact O-N 2.88Å; Q214-K216 PolarHBondContact O-N 2.82Å; K216-L220 WeakPolarHBondContact O-CB 3.49Å; K216-L220 PolarHBondContact O-N 3.43Å
217A87.7Confident86.1Confident7 Ų730.8 Ų30.86%0.05816%0.159CC..Hα-helixtrans-66-43.6-179.600000111.9I109 T113 V213 Q214 E215 K219 H221I109-A217 HydrophobicContact CD1-CB 3.99Å; I109-A217 HydrophobicContact CG1-CB 4.4Å; I109-A217 HydrophobicContact CG2-CB 4.32Å; T113-A217 HydrophobicContact CG2-CB 4.02Å; V213-A217 VanDerWaalsContact O-CB 3.28Å; V213-A217 WeakPolarHBondContact O-CB 3.27Å; V213-A217 PolarHBondContact O-N 2.83Å; Q214-A217 PolarHBondContact O-N 2.71Å; E215-A217 PolarHBondContact O-N 3.28Å; A217-K219 PolarHBondContact O-N 3.17Å; A217-H221 WeakPolarHBondContact O-CB 3.47Å; A217-H221 PolarHBondContact O-N 3.04Å
218M84.7Confident85.9Confident0 Ų028.7 Ų28.70%015%0.148CC..Hα-helixtrans-66-37.4179.6-70.3173.273.900112.4Q214 E215 N222 A223 N225 M228 L283 K287Q214-M218 VanDerWaalsContact O-CB 3.31Å; Q214-M218 WeakPolarHBondContact O-CB 3.45Å; Q214-M218 WeakPolarHBondContact O-CG 3.49Å; Q214-M218 PolarHBondContact O-N 3.43Å; E215-M218 PolarHBondContact O-N 3.49Å; M218-N222 VanDerWaalsContact O-CA 3.25Å; M218-N222 WeakPolarHBondContact O-CA 3.23Å; M218-N222 PolarHBondContact O-N 3.14Å; M218-N222 VanDerWaalsContact O-N 3.09Å; M218-A223 PolarHBondContact O-N 3.43Å; M218-N225 WeakPolarHBondContact CE-OD1 2.91Å; M218-M228 HydrophobicContact CG-CG 4.3Å; M218-M228 HydrophobicContact CG-SD 4.28Å; M218-M228 HydrophobicContact SD-CG 4.17Å; M218-L283 HydrophobicContact CE-CB 4.18Å; M218-L283 HydrophobicContact SD-CD2 3.97Å; M218-K287 HydrophobicContact CE-CB 3.94Å; M218-K287 HydrophobicContact CE-CD 4.18Å; M218-K287 HydrophobicContact CE-CG 4.39Å
219K83.9Confident85.7Confident91 Ų9128.6 Ų28.640%0.39615%0.147SC..Hα-helixtrans-76.1-38.9176.7-72.7-177175.11790113.2E215 A217 K287E215-K219 HydrophobicContact CG-CD 3.97Å; E215-K219 WeakPolarHBondContact O-CB 3.37Å; E215-K219 WeakPolarHBondContact O-CG 3.11Å; E215-K219 PolarHBondContact O-N 3.12Å; E215-K219 WeakPolarHBondContact OE1-CE 3.44Å; E215-K219 IonicContact OE1-NZ 2.71Å; E215-K219 PolarHBondContact OE1-NZ 3.47Å; A217-K219 PolarHBondContact O-N 3.17Å; K219-K287 VanDerWaalsContact CE-O 3.32Å; K219-K287 WeakPolarHBondContact CE-O 3.34Å
220L83.4Confident85.6Confident122 Ų12226.5 Ų26.564%0.63913%0.134SC*.Hα-helixtrans-70.6-39.3-178.7-176.265000112.3K216K216-L220 WeakPolarHBondContact O-CB 3.49Å; K216-L220 PolarHBondContact O-N 3.43Å
221H80.4Confident85.5Confident62 Ų6229.2 Ų29.229%0.28714%0.144SC..THydrogen-bonded Turntrans-104.33.1-174.9-65.3-77.9000113.7R108 I109 P110 A217 A223R108-H221 HydrophobicContact CB-CB 4.09Å; R108-H221 WeakPolarHBondContact CB-O 3.32Å; R108-H221 VanDerWaalsContact CD-O 3.28Å; R108-H221 WeakPolarHBondContact CD-O 3.44Å; R108-H221 PolarHBondContact O-ND1 3.47Å; I109-H221 HydrophobicContact CG1-CB 3.74Å; P110-H221 WeakPolarHBondContact CD-NE2 3.38Å; A217-H221 WeakPolarHBondContact O-CB 3.47Å; A217-H221 PolarHBondContact O-N 3.04Å; H221-A223 PolarHBondContact O-N 3.45Å; H221-A223 VanDerWaalsContact O-N 3.15Å
222N74.1Confident85.5Confident71 Ų7129 Ų2938%0.3814%0.141SC..THydrogen-bonded Turntrans45.844.2-174.8-72.9-46.6000112.5R108 M218R108-N222 WeakPolarHBondContact CD-O 3.45Å; R108-N222 PolarHBondContact NH1-O 3.29Å; M218-N222 VanDerWaalsContact O-CA 3.25Å; M218-N222 WeakPolarHBondContact O-CA 3.23Å; M218-N222 PolarHBondContact O-N 3.14Å; M218-N222 VanDerWaalsContact O-N 3.09Å
223A74.4Confident85.5Confident0 Ų029.7 Ų29.70%014%0.144CC..  trans-72.4154.2-176.300000111.6I109 M218 H221 K287I109-A223 HydrophobicContact CD1-CB 3.3Å; I109-A223 HydrophobicContact CG1-CB 3.71Å; M218-A223 PolarHBondContact O-N 3.43Å; H221-A223 PolarHBondContact O-N 3.45Å; H221-A223 VanDerWaalsContact O-N 3.15Å; A223-K287 PolarHBondContact O-NZ 3.45Å
224S80Confident85.6Confident17 Ų1730.1 Ų30.112%0.11915%0.148CC..  trans-75.8150.4171.3-178.50000110.6S226 E227 M228S224-S226 VanDerWaalsContact C-N 3.27Å; S224-S226 PolarHBondContact O-N 2.96Å; S224-S226 PolarHBondContact OG-N 3.46Å; S224-E227 PolarHBondContact O-N 3.23Å; S224-M228 PolarHBondContact O-N 3.32Å; S224-M228 VanDerWaalsContact O-N 3.14Å
225N82.1Confident85.7Confident5 Ų531.3 Ų31.33%0.02715%0.154CC..Hα-helixtrans-60.5-42174.3-58.4-38.2000110.2M218 M228 V229 L283M218-N225 WeakPolarHBondContact CE-OD1 2.91Å; N225-M228 VanDerWaalsContact O-CB 3.31Å; N225-M228 WeakPolarHBondContact O-CB 3.26Å; N225-M228 PolarHBondContact O-N 3.48Å; N225-V229 WeakPolarHBondContact O-CG2 3.44Å; N225-V229 PolarHBondContact O-N 3.05Å; N225-L283 HydrophobicContact CB-CB 4.19Å
226S82.1Confident85.8Confident0 Ų031.3 Ų31.30%015%0.154CC..Hα-helixtrans-68.2-38-178.8-39.90000112.3E98 S224 M228 V229 L230E98-S226 WeakPolarHBondContact CG-OG 3.45Å; E98-S226 PolarHBondContact OE1-OG 3.01Å; E98-S226 WeakPolarHBondContact OE2-CB 3.38Å; E98-S226 PolarHBondContact OE2-OG 3.28Å; S224-S226 VanDerWaalsContact C-N 3.27Å; S224-S226 PolarHBondContact O-N 2.96Å; S224-S226 PolarHBondContact OG-N 3.46Å; S226-M228 VanDerWaalsContact C-N 3.27Å; S226-M228 PolarHBondContact O-N 3.22Å; S226-V229 PolarHBondContact O-N 3.04Å; S226-L230 VanDerWaalsContact O-CB 3.23Å; S226-L230 WeakPolarHBondContact O-CB 3.3Å; S226-L230 PolarHBondContact O-N 3.32Å
227E85.9Confident86Confident5 Ų528.9 Ų28.92%0.02314%0.144CC..Hα-helixtrans-59.3-43.2171.9-173.1-165.4171.500110.3L99 R107 R108 Y114 S224 L230 Y231L99-E227 HydrophobicContact CD1-CB 4.45Å; R107-E227 VanDerWaalsContact CA-OE1 3.32Å; R107-E227 WeakPolarHBondContact CA-OE1 3.31Å; R108-E227 PolarHBondContact N-OE1 2.88Å; Y114-E227 WeakPolarHBondContact OH-CG 3.37Å; Y114-E227 PolarHBondContact OH-OE1 3.36Å; S224-E227 PolarHBondContact O-N 3.23Å; E227-L230 PolarHBondContact O-N 3Å; E227-Y231 HydrophobicContact CG-CD2 3.75Å; E227-Y231 HydrophobicContact CG-CE2 3.69Å; E227-Y231 WeakPolarHBondContact O-CD2 3.45Å; E227-Y231 PolarHBondContact O-N 3.23Å; E227-Y231 VanDerWaalsContact O-N 3.17Å
228M86.7Confident86.2Confident1 Ų132 Ų321%0.00516%0.162CC..Hα-helixtrans-63-45.5-179.7-164.165.7176.800112.5I109 Y114 I117 Q214 M218 S224 N225 S226 S232 L283I109-M228 HydrophobicContact CD1-SD 3.58Å; I109-M228 VanDerWaalsContact CD1-SD 3.58Å; Y114-M228 HydrophobicContact CD1-SD 4.24Å; Y114-M228 HydrophobicContact CE1-CE 4.49Å; Y114-M228 HydrophobicContact CE1-SD 3.49Å; Y114-M228 WeakPolarHBondContact CE1-SD 3.49Å; I117-M228 HydrophobicContact CD1-CE 3.14Å; Q214-M228 HydrophobicContact CB-CE 3.98Å; Q214-M228 HydrophobicContact CG-CE 3.55Å; M218-M228 HydrophobicContact CG-CG 4.3Å; M218-M228 HydrophobicContact CG-SD 4.28Å; M218-M228 HydrophobicContact SD-CG 4.17Å; S224-M228 PolarHBondContact O-N 3.32Å; S224-M228 VanDerWaalsContact O-N 3.14Å; N225-M228 VanDerWaalsContact O-CB 3.31Å; N225-M228 WeakPolarHBondContact O-CB 3.26Å; N225-M228 PolarHBondContact O-N 3.48Å; S226-M228 VanDerWaalsContact C-N 3.27Å; S226-M228 PolarHBondContact O-N 3.22Å; M228-S232 VanDerWaalsContact O-CB 3.23Å; M228-S232 WeakPolarHBondContact O-CB 3.5Å; M228-S232 PolarHBondContact O-N 3.26Å; M228-S232 PolarHBondContact O-OG 3.43Å; M228-L283 HydrophobicContact CB-CD1 4.42Å
229V88.2Confident86.6Confident1 Ų135.9 Ų35.91%0.00618%0.177CC..Hα-helixtrans-65.3-51.8176.5179.30000109.7Y91 N225 S226 Y231 S232 Y233 Y276 I279 L283Y91-V229 HydrophobicContact CD2-CG1 4.23Å; N225-V229 WeakPolarHBondContact O-CG2 3.44Å; N225-V229 PolarHBondContact O-N 3.05Å; S226-V229 PolarHBondContact O-N 3.04Å; V229-Y231 PolarHBondContact O-N 3.03Å; V229-S232 PolarHBondContact O-N 2.85Å; V229-Y233 HydrophobicContact CB-CD2 4.23Å; V229-Y233 HydrophobicContact CB-CE2 4.47Å; V229-Y233 HydrophobicContact CG1-CD2 3.61Å; V229-Y233 HydrophobicContact CG1-CE2 3.96Å; V229-Y233 HydrophobicContact CG1-CG 4.34Å; V229-Y233 WeakPolarHBondContact O-CB 3.4Å; V229-Y233 WeakPolarHBondContact O-CD2 3.36Å; V229-Y233 PolarHBondContact O-N 3.01Å; V229-Y276 HydrophobicContact CB-CE2 4.29Å; V229-Y276 HydrophobicContact CG1-CD2 3.97Å; V229-Y276 HydrophobicContact CG1-CE2 3.61Å; V229-I279 HydrophobicContact CG2-CG2 4.13Å; V229-L283 HydrophobicContact CG2-CD1 3.27Å
230L89.8Confident86.9Confident7 Ų731.7 Ų31.74%0.03716%0.159CC..Hα-helixtrans-51.7-58.6-176.317460.5000112.3S92 L96 L99 S226 E227 S234S92-L230 VanDerWaalsContact O-CD1 3.23Å; S92-L230 WeakPolarHBondContact O-CD1 3.42Å; L96-L230 HydrophobicContact CB-CD1 4.44Å; L96-L230 HydrophobicContact CD1-CD1 4.48Å; L96-L230 HydrophobicContact CD2-CD1 3.7Å; L96-L230 HydrophobicContact CD2-CD2 3.59Å; L96-L230 HydrophobicContact CD2-CG 4.26Å; L96-L230 HydrophobicContact CG-CD1 3.52Å; L96-L230 HydrophobicContact CG-CD2 4.25Å; L99-L230 HydrophobicContact CD2-CD2 3.81Å; S226-L230 VanDerWaalsContact O-CB 3.23Å; S226-L230 WeakPolarHBondContact O-CB 3.3Å; S226-L230 PolarHBondContact O-N 3.32Å; E227-L230 PolarHBondContact O-N 3Å; L230-S234 WeakPolarHBondContact O-CB 3.49Å; L230-S234 PolarHBondContact O-N 3.44Å; L230-S234 PolarHBondContact O-OG 3.49Å
231Y89.9Confident87.2Confident68 Ų6828.8 Ų28.827%0.26714%0.144SC..Hα-helixtrans-71.3-40.2-174.1-72.8-67.7000112.9R107 Y114 E227 V229 I235R107-Y231 HydrophobicContact CG-CE2 4.14Å; Y114-Y231 HydrophobicContact CD2-CG 4.42Å; Y114-Y231 HydrophobicContact CE1-CD2 4.45Å; Y114-Y231 HydrophobicContact CE2-CD2 4.01Å; Y114-Y231 HydrophobicContact CE2-CG 4.17Å; Y114-Y231 AromaticContact CZ-CD2 3.87Å; E227-Y231 HydrophobicContact CG-CD2 3.75Å; E227-Y231 HydrophobicContact CG-CE2 3.69Å; E227-Y231 WeakPolarHBondContact O-CD2 3.45Å; E227-Y231 PolarHBondContact O-N 3.23Å; E227-Y231 VanDerWaalsContact O-N 3.17Å; V229-Y231 PolarHBondContact O-N 3.03Å; Y231-I235 WeakPolarHBondContact O-CB 3.21Å; Y231-I235 WeakPolarHBondContact O-CD1 3.45Å; Y231-I235 VanDerWaalsContact O-CG1 3.26Å; Y231-I235 WeakPolarHBondContact O-CG1 3.14Å; Y231-I235 PolarHBondContact O-N 3.47Å; Y231-I235 VanDerWaalsContact O-N 3.13Å
232S90.8Very high87.7Confident3 Ų330.4 Ų30.42%0.02115%0.154CC..Hα-helixtrans-66.1-44.3-178.9-52.40000111.4Y114 A118 M228 V229 G236Y114-S232 WeakPolarHBondContact CD1-OG 3.29Å; A118-S232 VanDerWaalsContact CB-O 3.24Å; A118-S232 WeakPolarHBondContact CB-O 3.32Å; M228-S232 VanDerWaalsContact O-CB 3.23Å; M228-S232 WeakPolarHBondContact O-CB 3.5Å; M228-S232 PolarHBondContact O-N 3.26Å; M228-S232 PolarHBondContact O-OG 3.43Å; V229-S232 PolarHBondContact O-N 2.85Å; S232-G236 PolarHBondContact O-N 3.46Å
233Y91.5Very high88.4Confident15 Ų1528.7 Ų28.76%0.05915%0.154CC..Hα-helixtrans-80.4-28.8-178-71-93.3000112.5F88 Y91 V229 G236 F237 I279F88-Y233 AromaticContact CD1-CD1 3.76Å; F88-Y233 HydrophobicContact CD1-CD1 3.76Å; F88-Y233 HydrophobicContact CD1-CE1 4.25Å; F88-Y233 AromaticContact CD2-CD1 3.84Å; F88-Y233 HydrophobicContact CD2-CD1 3.84Å; F88-Y233 AromaticContact CE1-CD1 3.68Å; F88-Y233 HydrophobicContact CE1-CD1 3.68Å; F88-Y233 AromaticContact CE1-CE1 3.77Å; F88-Y233 HydrophobicContact CE1-CE1 3.77Å; F88-Y233 AromaticContact CE2-CD1 3.78Å; F88-Y233 HydrophobicContact CE2-CD1 3.78Å; F88-Y233 HydrophobicContact CE2-CE1 4.33Å; F88-Y233 AromaticContact CG-CD1 3.85Å; F88-Y233 HydrophobicContact CG-CD1 3.85Å; F88-Y233 AromaticContact CZ-CD1 3.69Å; F88-Y233 HydrophobicContact CZ-CD1 3.69Å; F88-Y233 AromaticContact CZ-CE1 3.82Å; F88-Y233 HydrophobicContact CZ-CE1 3.82Å; Y91-Y233 AromaticContact CD2-CD1 3.57Å; Y91-Y233 HydrophobicContact CD2-CD1 3.57Å; Y91-Y233 HydrophobicContact CD2-CD2 4.2Å; Y91-Y233 AromaticContact CD2-CE1 3.57Å; Y91-Y233 HydrophobicContact CD2-CE1 3.57Å; Y91-Y233 HydrophobicContact CD2-CE2 4.17Å; Y91-Y233 AromaticContact CD2-CG 3.89Å; Y91-Y233 HydrophobicContact CD2-CG 3.89Å; Y91-Y233 AromaticContact CD2-CZ 3.86Å; Y91-Y233 HydrophobicContact CE2-CD1 4.24Å; Y91-Y233 AromaticContact CE2-CE1 3.77Å; Y91-Y233 HydrophobicContact CE2-CE1 3.77Å; Y91-Y233 AromaticContact CE2-CZ 3.96Å; Y91-Y233 HydrophobicContact CG-CD1 4.4Å; V229-Y233 HydrophobicContact CB-CD2 4.23Å; V229-Y233 HydrophobicContact CB-CE2 4.47Å; V229-Y233 HydrophobicContact CG1-CD2 3.61Å; V229-Y233 HydrophobicContact CG1-CE2 3.96Å; V229-Y233 HydrophobicContact CG1-CG 4.34Å; V229-Y233 WeakPolarHBondContact O-CB 3.4Å; V229-Y233 WeakPolarHBondContact O-CD2 3.36Å; V229-Y233 PolarHBondContact O-N 3.01Å; Y233-G236 PolarHBondContact O-N 3.3Å; Y233-F237 WeakPolarHBondContact O-CB 3.26Å; Y233-F237 PolarHBondContact O-N 3.05Å; Y233-I279 HydrophobicContact CE2-CG1 4.46Å; Y233-I279 WeakPolarHBondContact OH-CD1 3.37Å
234S92.3Very high88.9Confident37 Ų3729.5 Ų29.526%0.25916%0.158SC..Hα-helixtrans-65.3-43.6172-62.40000111.7S92 L230 F237 V238S92-S234 WeakPolarHBondContact CB-OG 3.4Å; S92-S234 WeakPolarHBondContact OG-CA 3.16Å; S92-S234 PolarHBondContact OG-N 3.32Å; S92-S234 PolarHBondContact OG-OG 3.19Å; S92-S234 VanDerWaalsContact OG-OG 3.13Å; L230-S234 WeakPolarHBondContact O-CB 3.49Å; L230-S234 PolarHBondContact O-N 3.44Å; L230-S234 PolarHBondContact O-OG 3.49Å; S234-F237 WeakPolarHBondContact O-CB 3.27Å; S234-F237 PolarHBondContact O-N 3.34Å; S234-V238 PolarHBondContact O-N 3.22Å
235I92.8Very high89.2Confident39 Ų3932.3 Ų32.320%0.217%0.174CC..Hα-helixtrans-68.6-40.6175.6-64167.8000110M115 A118 Y231 F237 V238 Y239M115-I235 HydrophobicContact CG-CD1 4.12Å; M115-I235 HydrophobicContact CG-CG2 4.37Å; A118-I235 HydrophobicContact CB-CB 3.82Å; A118-I235 HydrophobicContact CB-CG2 3.67Å; Y231-I235 WeakPolarHBondContact O-CB 3.21Å; Y231-I235 WeakPolarHBondContact O-CD1 3.45Å; Y231-I235 VanDerWaalsContact O-CG1 3.26Å; Y231-I235 WeakPolarHBondContact O-CG1 3.14Å; Y231-I235 PolarHBondContact O-N 3.47Å; Y231-I235 VanDerWaalsContact O-N 3.13Å; I235-F237 VanDerWaalsContact C-N 3.28Å; I235-F237 PolarHBondContact O-N 3Å; I235-V238 PolarHBondContact O-N 3.5Å; I235-Y239 HydrophobicContact CG2-CD2 4.15Å; I235-Y239 HydrophobicContact CG2-CE2 3.6Å; I235-Y239 PolarHBondContact O-N 3.26Å; I235-Y239 VanDerWaalsContact O-N 3.08Å
236G91.6Very high89.4Confident0 Ų037.3 Ų37.30%021%0.208CC..Hα-helixtrans-59.5-38.4174.700000112.8S232 Y233 V238 Y239 I240S232-G236 PolarHBondContact O-N 3.46Å; Y233-G236 PolarHBondContact O-N 3.3Å; G236-V238 VanDerWaalsContact C-N 3.33Å; G236-V238 PolarHBondContact O-N 2.79Å; G236-Y239 PolarHBondContact O-N 3.06Å; G236-I240 WeakPolarHBondContact O-CG1 3.46Å; G236-I240 PolarHBondContact O-N 3.08Å
237F92.8Very high89.3Confident56 Ų5642.6 Ų42.625%0.24624%0.241CC..Hα-helixtrans-58.7-46174.9171.1-95.8000110.9L85 F88 A89 Y233 S234 I235 Y239 I240 L241L85-F237 HydrophobicContact CD1-CE2 4.28Å; L85-F237 HydrophobicContact CD2-CD2 4.33Å; L85-F237 HydrophobicContact CD2-CE2 3.56Å; L85-F237 HydrophobicContact CD2-CZ 4.35Å; L85-F237 HydrophobicContact CG-CD2 3.92Å; L85-F237 HydrophobicContact CG-CE2 3.6Å; L85-F237 WeakPolarHBondContact O-CD2 3.47Å; F88-F237 HydrophobicContact CB-CB 4.03Å; F88-F237 HydrophobicContact CB-CD2 4.46Å; A89-F237 HydrophobicContact CB-CD2 3.93Å; A89-F237 HydrophobicContact CB-CE2 3.76Å; Y233-F237 WeakPolarHBondContact O-CB 3.26Å; Y233-F237 PolarHBondContact O-N 3.05Å; S234-F237 WeakPolarHBondContact O-CB 3.27Å; S234-F237 PolarHBondContact O-N 3.34Å; I235-F237 VanDerWaalsContact C-N 3.28Å; I235-F237 PolarHBondContact O-N 3Å; F237-Y239 VanDerWaalsContact C-N 3.34Å; F237-Y239 PolarHBondContact O-N 3.33Å; F237-I240 PolarHBondContact O-N 3.11Å; F237-L241 HydrophobicContact CE1-CD2 4.06Å; F237-L241 HydrophobicContact CZ-CD2 4.38Å; F237-L241 VanDerWaalsContact O-CB 3.24Å; F237-L241 WeakPolarHBondContact O-CB 3.46Å; F237-L241 PolarHBondContact O-N 3.26Å
238V93.6Very high88.8Confident72 Ų7247 Ų4744%0.43627%0.272SS..Hα-helixtrans-61.6-42.7176.8177.70000111S234 I235 G236 L241 L242S234-V238 PolarHBondContact O-N 3.22Å; I235-V238 PolarHBondContact O-N 3.5Å; G236-V238 VanDerWaalsContact C-N 3.33Å; G236-V238 PolarHBondContact O-N 2.79Å; V238-L241 PolarHBondContact O-N 3.48Å; V238-L242 HydrophobicContact CG1-CD1 3.99Å; V238-L242 HydrophobicContact CG1-CG 4.38Å; V238-L242 WeakPolarHBondContact O-CB 3.22Å; V238-L242 VanDerWaalsContact O-CG 3.28Å; V238-L242 WeakPolarHBondContact O-CG 3.46Å; V238-L242 PolarHBondContact O-N 3.06Å
239Y92.2Very high88.1Confident81 Ų8148.3 Ų48.332%0.31829%0.286SS..Hα-helixtrans-62.7-44.2176.6-68.8-34.9000113A118 F119 I235 G236 F237 G243A118-Y239 HydrophobicContact CB-CD2 4.23Å; A118-Y239 HydrophobicContact CB-CE2 4Å; F119-Y239 HydrophobicContact CB-CE2 4.05Å; I235-Y239 HydrophobicContact CG2-CD2 4.15Å; I235-Y239 HydrophobicContact CG2-CE2 3.6Å; I235-Y239 PolarHBondContact O-N 3.26Å; I235-Y239 VanDerWaalsContact O-N 3.08Å; G236-Y239 PolarHBondContact O-N 3.06Å; F237-Y239 VanDerWaalsContact C-N 3.34Å; F237-Y239 PolarHBondContact O-N 3.33Å; Y239-G243 PolarHBondContact O-N 3.1Å
240I90.2Very high87.5Confident3 Ų350.6 Ų50.62%0.01530%0.298CS..Hα-helixtrans-67.7-41.5177.9-63.1171.1000110.5W81 L85 F88 V122 G236 F237 G243 L244W81-I240 HydrophobicContact CE3-CG2 4.26Å; W81-I240 HydrophobicContact CZ3-CG1 4.5Å; L85-I240 HydrophobicContact CB-CG2 3.87Å; L85-I240 HydrophobicContact CD1-CG2 4.16Å; L85-I240 HydrophobicContact CG-CG2 4.48Å; F88-I240 HydrophobicContact CD2-CD1 3.92Å; F88-I240 HydrophobicContact CE2-CD1 3.9Å; F88-I240 HydrophobicContact CG-CD1 4.26Å; F88-I240 HydrophobicContact CZ-CD1 4.23Å; V122-I240 HydrophobicContact CB-CG1 4.39Å; V122-I240 HydrophobicContact CG1-CD1 4.49Å; V122-I240 HydrophobicContact CG1-CG1 3.71Å; V122-I240 HydrophobicContact CG2-CD1 4.05Å; V122-I240 HydrophobicContact CG2-CG1 3.78Å; G236-I240 WeakPolarHBondContact O-CG1 3.46Å; G236-I240 PolarHBondContact O-N 3.08Å; F237-I240 PolarHBondContact O-N 3.11Å; I240-G243 PolarHBondContact O-N 3.42Å; I240-L244 HydrophobicContact CG2-CD1 3.87Å; I240-L244 HydrophobicContact CG2-CG 4.25Å; I240-L244 WeakPolarHBondContact O-CB 3.25Å; I240-L244 WeakPolarHBondContact O-CG 3.4Å; I240-L244 PolarHBondContact O-N 2.89Å
241L90.2Very high87Confident61 Ų6152.1 Ų52.132%0.31932%0.316SS..Hα-helixtrans-59-49.4177.4-178.467.6000110.5L85 F237 V238 G243 L244 T245 L250L85-L241 HydrophobicContact CD1-CB 3.93Å; L85-L241 HydrophobicContact CD1-CD1 3.82Å; F237-L241 HydrophobicContact CE1-CD2 4.06Å; F237-L241 HydrophobicContact CZ-CD2 4.38Å; F237-L241 VanDerWaalsContact O-CB 3.24Å; F237-L241 WeakPolarHBondContact O-CB 3.46Å; F237-L241 PolarHBondContact O-N 3.26Å; V238-L241 PolarHBondContact O-N 3.48Å; L241-G243 PolarHBondContact O-N 3.24Å; L241-L244 PolarHBondContact O-N 3.46Å; L241-T245 WeakPolarHBondContact O-CG2 3.47Å; L241-T245 PolarHBondContact O-N 3.13Å; L241-T245 PolarHBondContact O-OG1 3.09Å; L241-L250 HydrophobicContact CD1-CD1 3.73Å
242L90.9Very high86.4Confident97 Ų9753.2 Ų53.251%0.50833%0.331SS..Hα-helixtrans-58.7-48.5175.7-72172.9000111.3V238 L244 T245 C246V238-L242 HydrophobicContact CG1-CD1 3.99Å; V238-L242 HydrophobicContact CG1-CG 4.38Å; V238-L242 WeakPolarHBondContact O-CB 3.22Å; V238-L242 VanDerWaalsContact O-CG 3.28Å; V238-L242 WeakPolarHBondContact O-CG 3.46Å; V238-L242 PolarHBondContact O-N 3.06Å; L242-L244 VanDerWaalsContact C-N 3.33Å; L242-L244 PolarHBondContact O-N 2.93Å; L242-T245 WeakPolarHBondContact CA-OG1 3.43Å; L242-T245 PolarHBondContact O-N 3.01Å; L242-T245 PolarHBondContact O-OG1 2.87Å; L242-C246 PolarHBondContact O-N 3.37Å; L242-C246 PolarHBondContact O-SG 3.22Å
243G87.8Confident85.6Confident35 Ų3553.3 Ų53.336%0.36133%0.332SS..Hα-helixtrans-58.4-41.5177.500000113.5Y239 I240 L241 C246 T247Y239-G243 PolarHBondContact O-N 3.1Å; I240-G243 PolarHBondContact O-N 3.42Å; L241-G243 PolarHBondContact O-N 3.24Å; G243-C246 PolarHBondContact O-N 3.23Å; G243-T247 WeakPolarHBondContact O-CB 3.49Å; G243-T247 PolarHBondContact O-N 2.89Å; G243-T247 PolarHBondContact O-OG1 3.47Å
244L85.3Confident85.1Confident16 Ų1655.1 Ų55.18%0.08434%0.344CS..Hα-helixtrans-70.8-35.3177.6-79175.2000112.9W81 L85 I240 L241 L242 T247 S248 G249 L250W81-L244 HydrophobicContact CB-CD1 4.42Å; W81-L244 HydrophobicContact CB-CD2 3.82Å; W81-L244 HydrophobicContact CB-CG 4.43Å; L85-L244 HydrophobicContact CB-CD1 4.18Å; L85-L244 HydrophobicContact CD1-CD1 3.69Å; I240-L244 HydrophobicContact CG2-CD1 3.87Å; I240-L244 HydrophobicContact CG2-CG 4.25Å; I240-L244 WeakPolarHBondContact O-CB 3.25Å; I240-L244 WeakPolarHBondContact O-CG 3.4Å; I240-L244 PolarHBondContact O-N 2.89Å; L241-L244 PolarHBondContact O-N 3.46Å; L242-L244 VanDerWaalsContact C-N 3.33Å; L242-L244 PolarHBondContact O-N 2.93Å; L244-T247 PolarHBondContact O-N 3.39Å; L244-S248 PolarHBondContact O-N 2.88Å; L244-S248 VanDerWaalsContact O-N 3.16Å; L244-G249 PolarHBondContact O-N 3.39Å; L244-L250 HydrophobicContact CB-CB 4.38Å; L244-L250 HydrophobicContact CB-CD1 4.16Å
245T85.6Confident84.4Confident77 Ų7757.5 Ų57.547%0.47236%0.358SS..Hα-helixtrans-66.7-40.9173.454.70000111.7L241 L242 T247 S248 L250L241-T245 WeakPolarHBondContact O-CG2 3.47Å; L241-T245 PolarHBondContact O-N 3.13Å; L241-T245 PolarHBondContact O-OG1 3.09Å; L242-T245 WeakPolarHBondContact CA-OG1 3.43Å; L242-T245 PolarHBondContact O-N 3.01Å; L242-T245 PolarHBondContact O-OG1 2.87Å; T245-T247 VanDerWaalsContact C-N 3.34Å; T245-T247 PolarHBondContact O-N 3.42Å; T245-S248 PolarHBondContact O-N 3.34Å; T245-L250 HydrophobicContact CG2-CD1 4.48Å
246C86.4Confident83.5Confident109 Ų10958.8 Ų58.874%0.73636%0.362SS*.Hα-helixtrans-66.2-34.8176.3-670000112.8L242 G243 S248L242-C246 PolarHBondContact O-N 3.37Å; L242-C246 PolarHBondContact O-SG 3.22Å; G243-C246 PolarHBondContact O-N 3.23Å; C246-S248 VanDerWaalsContact C-N 3.32Å
247T80.6Confident82.6Confident112 Ų11258.9 Ų58.969%0.68736%0.362SS*.THydrogen-bonded Turntrans-87.8-0.6-178.5-44.80000112.4G243 L244 T245 G249G243-T247 WeakPolarHBondContact O-CB 3.49Å; G243-T247 PolarHBondContact O-N 2.89Å; G243-T247 PolarHBondContact O-OG1 3.47Å; L244-T247 PolarHBondContact O-N 3.39Å; T245-T247 VanDerWaalsContact C-N 3.34Å; T245-T247 PolarHBondContact O-N 3.42Å; T247-G249 PolarHBondContact O-N 3.18Å
248S75.1Confident81.7Confident97 Ų9758.9 Ų58.968%0.67837%0.373SS*.THydrogen-bonded Turntrans52.917.5-175.2-52.50000115.3L244 T245 C246 L250L244-S248 PolarHBondContact O-N 2.88Å; L244-S248 VanDerWaalsContact O-N 3.16Å; T245-S248 PolarHBondContact O-N 3.34Å; C246-S248 VanDerWaalsContact C-N 3.32Å; S248-L250 VanDerWaalsContact C-N 3.31Å; S248-L250 PolarHBondContact O-N 2.82Å
249G72.4Confident81Confident29 Ų2962.8 Ų62.830%0.29938%0.384SS..  trans-81.8-7.6-177.100000114.3L244 T247L244-G249 PolarHBondContact O-N 3.39Å; T247-G249 PolarHBondContact O-N 3.18Å
250L76.6Confident80.1Confident48 Ų4863.9 Ų63.925%0.25140%0.395SS..Hα-helixtrans-71-42-175.6-162.2140.5000112.4L241 L244 T245 S248 A253 V254L241-L250 HydrophobicContact CD1-CD1 3.73Å; L244-L250 HydrophobicContact CB-CB 4.38Å; L244-L250 HydrophobicContact CB-CD1 4.16Å; T245-L250 HydrophobicContact CG2-CD1 4.48Å; S248-L250 VanDerWaalsContact C-N 3.31Å; S248-L250 PolarHBondContact O-N 2.82Å; L250-A253 PolarHBondContact O-N 3.22Å; L250-V254 HydrophobicContact CD2-CG2 3.89Å; L250-V254 HydrophobicContact CG-CG2 4.44Å; L250-V254 VanDerWaalsContact O-CG2 3.25Å; L250-V254 WeakPolarHBondContact O-CG2 3.3Å; L250-V254 PolarHBondContact O-N 3.39Å
251G77.9Confident79.3Confident40 Ų4066.8 Ų66.841%0.41242%0.415SS..Hα-helixtrans-58.8-57.9-179.700000113.2A253 V254 T255G251-A253 VanDerWaalsContact C-N 3.28Å; G251-A253 PolarHBondContact O-N 3.46Å; G251-V254 PolarHBondContact O-N 2.96Å; G251-T255 PolarHBondContact O-N 3.09Å; G251-T255 PolarHBondContact O-OG1 2.94Å; G251-T255 VanDerWaalsContact O-OG1 3.07Å
252P77.3Confident78.5Confident90 Ų9070 Ų7058%0.58444%0.437SS*.Hα-helixtrans-57.6-38.5179.8-25.834.3000113.5F256P252-F256 WeakPolarHBondContact O-CB 3.35Å; P252-F256 PolarHBondContact O-N 3.33Å
253A75.3Confident77.7Confident6 Ų674.1 Ų74.15%0.0545%0.445CS..Hα-helixtrans-68.5-42.5179.200000112.4C79 Y82 L250 G251 F256 C257C79-A253 HydrophobicContact CB-CB 4.43Å; Y82-A253 HydrophobicContact CD1-CB 4.23Å; Y82-A253 HydrophobicContact CD2-CB 4.16Å; Y82-A253 HydrophobicContact CG-CB 3.72Å; L250-A253 PolarHBondContact O-N 3.22Å; G251-A253 VanDerWaalsContact C-N 3.28Å; G251-A253 PolarHBondContact O-N 3.46Å; A253-F256 PolarHBondContact O-N 3.08Å; A253-C257 PolarHBondContact O-N 3.3Å; A253-C257 PolarHBondContact O-SG 2.8Å; A253-C257 VanDerWaalsContact O-SG 3.37Å
254V79.7Confident77.2Confident52 Ų5273.3 Ų73.332%0.31543%0.433SS..Hα-helixtrans-64.2-45.3176.1172.30000110.7Y82 L250 G251 F256 C257 A258Y82-V254 HydrophobicContact CD2-CG2 4.29Å; Y82-V254 HydrophobicContact CE2-CG2 3.53Å; L250-V254 HydrophobicContact CD2-CG2 3.89Å; L250-V254 HydrophobicContact CG-CG2 4.44Å; L250-V254 VanDerWaalsContact O-CG2 3.25Å; L250-V254 WeakPolarHBondContact O-CG2 3.3Å; L250-V254 PolarHBondContact O-N 3.39Å; G251-V254 PolarHBondContact O-N 2.96Å; V254-F256 VanDerWaalsContact C-N 3.29Å; V254-F256 PolarHBondContact O-N 3.47Å; V254-C257 PolarHBondContact O-N 3.39Å; V254-A258 WeakPolarHBondContact O-CB 3.14Å; V254-A258 PolarHBondContact O-N 2.99Å
255T78.2Confident77Confident88 Ų8876.3 Ų76.354%0.5444%0.444SS..Hα-helixtrans-61.8-38.4177.6-52.70000111.7G251 A258 K259G251-T255 PolarHBondContact O-N 3.09Å; G251-T255 PolarHBondContact O-OG1 2.94Å; G251-T255 VanDerWaalsContact O-OG1 3.07Å; T255-A258 PolarHBondContact O-N 3.4Å; T255-K259 PolarHBondContact O-N 3.03Å
256F74.8Confident76.9Confident65 Ų6574.1 Ų74.129%0.28544%0.437SS..Hα-helixtrans-67.3-46176.4-173.8-99.1000112.2F76 P252 A253 V254 A258 K259F76-F256 AromaticContact CD2-CE1 3.51Å; F76-F256 HydrophobicContact CD2-CE1 3.51Å; F76-F256 HydrophobicContact CD2-CZ 4.21Å; F76-F256 HydrophobicContact CE2-CD1 4.29Å; F76-F256 AromaticContact CE2-CE1 3.54Å; F76-F256 HydrophobicContact CE2-CE1 3.54Å; F76-F256 HydrophobicContact CE2-CZ 4.42Å; F76-F256 HydrophobicContact CG-CE1 4.07Å; F76-F256 HydrophobicContact CZ-CD1 4.47Å; F76-F256 HydrophobicContact CZ-CE1 4.13Å; P252-F256 WeakPolarHBondContact O-CB 3.35Å; P252-F256 PolarHBondContact O-N 3.33Å; A253-F256 PolarHBondContact O-N 3.08Å; V254-F256 VanDerWaalsContact C-N 3.29Å; V254-F256 PolarHBondContact O-N 3.47Å; F256-A258 VanDerWaalsContact C-N 3.28Å; F256-A258 PolarHBondContact O-N 3.17Å; F256-K259 WeakPolarHBondContact O-CB 3.37Å; F256-K259 PolarHBondContact O-N 3.21Å
257C72.5Confident76.8Confident2 Ų273.8 Ų73.81%0.01442%0.421CS..Hα-helixtrans-67.2-28.7176.3-67.20000113Y82 A253 V254 K259 N260 T264 Y265Y82-C257 VanDerWaalsContact CD1-SG 3.6Å; Y82-C257 HydrophobicContact CE1-CB 3.9Å; Y82-C257 WeakPolarHBondContact CE1-SG 3.49Å; A253-C257 PolarHBondContact O-N 3.3Å; A253-C257 PolarHBondContact O-SG 2.8Å; A253-C257 VanDerWaalsContact O-SG 3.37Å; V254-C257 PolarHBondContact O-N 3.39Å; C257-K259 VanDerWaalsContact C-N 3.32Å; C257-N260 CarbonylContact O-C 3.57Å; C257-T264 HydrophobicContact CB-CG2 3.74Å; C257-Y265 HydrophobicContact CB-CE2 4.34Å
258A74Confident77Confident57 Ų5768.6 Ų68.647%0.47139%0.39SS..Hα-helixtrans-73.4-18.3176.200000113.8V254 T255 F256 N260 P261V254-A258 WeakPolarHBondContact O-CB 3.14Å; V254-A258 PolarHBondContact O-N 2.99Å; T255-A258 PolarHBondContact O-N 3.4Å; F256-A258 VanDerWaalsContact C-N 3.28Å; F256-A258 PolarHBondContact O-N 3.17Å; A258-N260 VanDerWaalsContact C-N 3.31Å; A258-N260 PolarHBondContact O-N 3.13Å; A258-P261 WeakPolarHBondContact O-CD 3.34Å
259K77.9Confident77.6Confident153 Ų15368 Ų6867%0.66538%0.375SS*.Hα-helixtrans-66-31.9175.9-77.2-180177.9-175.40113.1T255 F256 C257T255-K259 PolarHBondContact O-N 3.03Å; F256-K259 WeakPolarHBondContact O-CB 3.37Å; F256-K259 PolarHBondContact O-N 3.21Å; C257-K259 VanDerWaalsContact C-N 3.32Å
260N73.6Confident78.4Confident104 Ų10470.4 Ų70.456%0.55638%0.381SS*.SBendtrans-138.673.7177.2-77.9-57.5000109.9C257 A258 V262 T264C257-N260 CarbonylContact O-C 3.57Å; A258-N260 VanDerWaalsContact C-N 3.31Å; A258-N260 PolarHBondContact O-N 3.13Å; N260-V262 PolarHBondContact O-N 3.42Å; N260-T264 WeakPolarHBondContact O-CB 3.35Å; N260-T264 PolarHBondContact O-N 3.15Å; N260-T264 PolarHBondContact O-OG1 3.11Å
261P73.3Confident79Confident65 Ų6568.3 Ų68.342%0.42237%0.369SS..Hα-helixtrans-67.5-41.8-167.525-31.5000111.8A258 Y265A258-P261 WeakPolarHBondContact O-CD 3.34Å; P261-Y265 HydrophobicContact CB-CD2 4.02Å; P261-Y265 HydrophobicContact CB-CE2 4.31Å; P261-Y265 VanDerWaalsContact O-CB 3.3Å; P261-Y265 WeakPolarHBondContact O-CB 3.36Å; P261-Y265 VanDerWaalsContact O-CD2 3.3Å; P261-Y265 WeakPolarHBondContact O-CD2 3.13Å; P261-Y265 PolarHBondContact O-N 2.85Å
262V74.6Confident79.6Confident128 Ų12866.4 Ų66.478%0.77635%0.35SS*.Hα-helixtrans-65.5-45-176-178.90000111.9N260 G266N260-V262 PolarHBondContact O-N 3.42Å; V262-G266 WeakPolarHBondContact O-CA 3.23Å; V262-G266 PolarHBondContact O-N 2.57Å; V262-G266 VanDerWaalsContact O-N 3.11Å
263R74.1Confident80.3Confident184 Ų18464.2 Ų64.269%0.69433%0.333SS*.Hα-helixtrans-71.4-46.7178.5-71.2-173.3177.1179.2-0.1111.6Y267R263-Y267 HydrophobicContact CB-CE2 4.36Å; R263-Y267 WeakPolarHBondContact O-CB 3.19Å; R263-Y267 WeakPolarHBondContact O-CD2 3.23Å; R263-Y267 PolarHBondContact O-N 3.45Å
264T76.4Confident81.1Confident17 Ų1764.7 Ų64.710%0.10434%0.335CS..Hα-helixtrans-66.6-53.8-176-61.10000112.4F76 C257 N260 G266 Y267 A268F76-T264 HydrophobicContact CE1-CG2 4.11Å; F76-T264 HydrophobicContact CZ-CG2 3.5Å; C257-T264 HydrophobicContact CB-CG2 3.74Å; N260-T264 WeakPolarHBondContact O-CB 3.35Å; N260-T264 PolarHBondContact O-N 3.15Å; N260-T264 PolarHBondContact O-OG1 3.11Å; T264-G266 VanDerWaalsContact C-N 3.34Å; T264-Y267 PolarHBondContact O-N 3.39Å; T264-A268 VanDerWaalsContact O-CB 3.3Å; T264-A268 WeakPolarHBondContact O-CB 3.33Å; T264-A268 PolarHBondContact O-N 2.84Å
265Y80.4Confident81.5Confident79 Ų7962.2 Ų62.231%0.3132%0.32SS..Hα-helixtrans-73.2-29.5-178.3-68.8-71.5000111.6Y82 C257 P261 A268 F269Y82-Y265 PolarHBondContact OH-OH 2.68Å; C257-Y265 HydrophobicContact CB-CE2 4.34Å; P261-Y265 HydrophobicContact CB-CD2 4.02Å; P261-Y265 HydrophobicContact CB-CE2 4.31Å; P261-Y265 VanDerWaalsContact O-CB 3.3Å; P261-Y265 WeakPolarHBondContact O-CB 3.36Å; P261-Y265 VanDerWaalsContact O-CD2 3.3Å; P261-Y265 WeakPolarHBondContact O-CD2 3.13Å; P261-Y265 PolarHBondContact O-N 2.85Å; Y265-A268 PolarHBondContact O-N 2.95Å; Y265-F269 WeakPolarHBondContact O-CB 3.27Å; Y265-F269 PolarHBondContact O-N 2.65Å
266G84.2Confident82.2Confident32 Ų3258.3 Ų58.333%0.3330%0.296SS..Hα-helixtrans-61.4-49.1171.100000112.5V262 T264 F269 L270V262-G266 WeakPolarHBondContact O-CA 3.23Å; V262-G266 PolarHBondContact O-N 2.57Å; V262-G266 VanDerWaalsContact O-N 3.11Å; T264-G266 VanDerWaalsContact C-N 3.34Å; G266-F269 PolarHBondContact O-N 3.13Å; G266-L270 PolarHBondContact O-N 3.17Å
267Y83.6Confident82.9Confident101 Ų10157.7 Ų57.740%0.39629%0.293SS..Hα-helixtrans-66.7-41.7175.1-67.3-43000112.4L69 R263 T264 F269 L270 F271L69-Y267 HydrophobicContact CD2-CD1 4.42Å; L69-Y267 HydrophobicContact CD2-CE1 4.08Å; R263-Y267 HydrophobicContact CB-CE2 4.36Å; R263-Y267 WeakPolarHBondContact O-CB 3.19Å; R263-Y267 WeakPolarHBondContact O-CD2 3.23Å; R263-Y267 PolarHBondContact O-N 3.45Å; T264-Y267 PolarHBondContact O-N 3.39Å; Y267-F269 VanDerWaalsContact C-N 3.28Å; Y267-F269 PolarHBondContact O-N 3.5Å; Y267-L270 PolarHBondContact O-N 3.3Å; Y267-F271 WeakPolarHBondContact O-CB 3.08Å; Y267-F271 PolarHBondContact O-N 2.92Å
268A84.4Confident83.7Confident4 Ų457.6 Ų57.63%0.03329%0.293CS..Hα-helixtrans-61.6-37.2176.100000112L83 V86 T264 Y265 S272L83-A268 HydrophobicContact CD1-CB 4.37Å; V86-A268 HydrophobicContact CG1-CB 4.23Å; T264-A268 VanDerWaalsContact O-CB 3.3Å; T264-A268 WeakPolarHBondContact O-CB 3.33Å; T264-A268 PolarHBondContact O-N 2.84Å; Y265-A268 PolarHBondContact O-N 2.95Å; A268-S272 VanDerWaalsContact O-CB 3.27Å; A268-S272 WeakPolarHBondContact O-CB 3.23Å; A268-S272 PolarHBondContact O-N 2.9Å; A268-S272 PolarHBondContact O-OG 3Å
269F89.5Confident84.5Confident83 Ų8356 Ų5636%0.36428%0.276SS..Hα-helixtrans-65.8-51.6175176.3-97.8000111.5F90 F94 Y265 G266 Y267 F271 S272 L273F90-F269 HydrophobicContact CD1-CD2 4.2Å; F90-F269 AromaticContact CE1-CD2 3.83Å; F90-F269 HydrophobicContact CE1-CD2 3.83Å; F90-F269 HydrophobicContact CE1-CE2 4.43Å; F90-F269 HydrophobicContact CZ-CD2 4.11Å; F94-F269 HydrophobicContact CE1-CE2 4.12Å; F94-F269 HydrophobicContact CZ-CD2 4.27Å; F94-F269 AromaticContact CZ-CE2 3.63Å; F94-F269 HydrophobicContact CZ-CE2 3.63Å; F94-F269 HydrophobicContact CZ-CZ 4.14Å; Y265-F269 WeakPolarHBondContact O-CB 3.27Å; Y265-F269 PolarHBondContact O-N 2.65Å; G266-F269 PolarHBondContact O-N 3.13Å; Y267-F269 VanDerWaalsContact C-N 3.28Å; Y267-F269 PolarHBondContact O-N 3.5Å; F269-F271 VanDerWaalsContact C-N 3.3Å; F269-F271 PolarHBondContact O-N 3.35Å; F269-S272 PolarHBondContact O-N 3.29Å; F269-S272 VanDerWaalsContact O-N 3.15Å; F269-L273 HydrophobicContact CE1-CD2 4.1Å; F269-L273 HydrophobicContact CZ-CD2 4.46Å; F269-L273 VanDerWaalsContact O-CB 3.28Å; F269-L273 WeakPolarHBondContact O-CB 3.16Å; F269-L273 PolarHBondContact O-N 3.19Å
270L89.4Confident85Confident81 Ų8148.7 Ų48.742%0.42424%0.244SC..Hα-helixtrans-61.2-40177.8-72.3173.6000112.1L66 G266 Y267 L273 T274L66-L270 HydrophobicContact CD1-CB 3.86Å; G266-L270 PolarHBondContact O-N 3.17Å; Y267-L270 PolarHBondContact O-N 3.3Å; L270-L273 PolarHBondContact O-N 3.48Å; L270-T274 WeakPolarHBondContact O-CB 3.38Å; L270-T274 WeakPolarHBondContact O-CG2 3.26Å; L270-T274 PolarHBondContact O-N 2.92Å; L270-T274 PolarHBondContact O-OG1 3.37Å
271F88.4Confident85.7Confident3 Ų344.7 Ų44.71%0.01322%0.222CC..Hα-helixtrans-61-44.9174.1171.8-105.3000111.5Y63 L66 Q67 I70 L83 Q87 Y267 F269 T274 G275Y63-F271 HydrophobicContact CD1-CE2 4.46Å; Y63-F271 AromaticContact CD2-CD2 3.71Å; Y63-F271 HydrophobicContact CD2-CD2 3.71Å; Y63-F271 AromaticContact CD2-CE2 3.6Å; Y63-F271 HydrophobicContact CD2-CE2 3.6Å; Y63-F271 HydrophobicContact CD2-CG 4.46Å; Y63-F271 HydrophobicContact CD2-CZ 4.29Å; Y63-F271 WeakPolarHBondContact CD2-O 3.14Å; Y63-F271 HydrophobicContact CE1-CE2 4.03Å; Y63-F271 HydrophobicContact CE1-CZ 4.46Å; Y63-F271 HydrophobicContact CE2-CD1 4.4Å; Y63-F271 AromaticContact CE2-CD2 3.56Å; Y63-F271 HydrophobicContact CE2-CD2 3.56Å; Y63-F271 AromaticContact CE2-CE1 4Å; Y63-F271 HydrophobicContact CE2-CE1 4Å; Y63-F271 AromaticContact CE2-CE2 3.04Å; Y63-F271 HydrophobicContact CE2-CE2 3.04Å; Y63-F271 HydrophobicContact CE2-CG 4.22Å; Y63-F271 AromaticContact CE2-CZ 3.32Å; Y63-F271 HydrophobicContact CE2-CZ 3.32Å; Y63-F271 HydrophobicContact CG-CD2 4.48Å; Y63-F271 HydrophobicContact CG-CE2 4.28Å; Y63-F271 AromaticContact CZ-CE2 3.29Å; Y63-F271 AromaticContact CZ-CZ 3.42Å; Y63-F271 VanDerWaalsContact CZ-CZ 3.42Å; Y63-F271 WeakPolarHBondContact OH-CZ 3.33Å; L66-F271 HydrophobicContact CB-CB 4.42Å; L66-F271 HydrophobicContact CB-CD2 4.31Å; Q67-F271 HydrophobicContact CB-CD2 4.35Å; Q67-F271 HydrophobicContact CB-CE2 3.73Å; Q67-F271 HydrophobicContact CG-CE2 3.91Å; Q67-F271 HydrophobicContact CG-CZ 4.39Å; I70-F271 HydrophobicContact CD1-CB 3.88Å; I70-F271 HydrophobicContact CD1-CD2 4.29Å; I70-F271 HydrophobicContact CD1-CG 4.03Å; L83-F271 HydrophobicContact CD2-CD1 4.23Å; L83-F271 HydrophobicContact CD2-CE1 3.71Å; L83-F271 HydrophobicContact CD2-CZ 4.09Å; L83-F271 HydrophobicContact CG-CE1 4.33Å; Q87-F271 HydrophobicContact CB-CE1 4.33Å; Q87-F271 VanDerWaalsContact CD-CE1 3.49Å; Q87-F271 HydrophobicContact CG-CD1 4.46Å; Q87-F271 HydrophobicContact CG-CE1 4.09Å; Q87-F271 VanDerWaalsContact OE1-CE1 3.3Å; Y267-F271 WeakPolarHBondContact O-CB 3.08Å; Y267-F271 PolarHBondContact O-N 2.92Å; F269-F271 VanDerWaalsContact C-N 3.3Å; F269-F271 PolarHBondContact O-N 3.35Å; F271-T274 PolarHBondContact O-OG1 2.86Å; F271-G275 PolarHBondContact O-N 3.44Å
272S90.9Very high86.5Confident1 Ų142.2 Ų42.21%0.00721%0.206CC..Hα-helixtrans-71-36.8178.4-55.70000112.2Q87 Y91 A268 F269 Y276Q87-S272 WeakPolarHBondContact CA-OG 3.2Å; Y91-S272 WeakPolarHBondContact CE1-O 3.44Å; A268-S272 VanDerWaalsContact O-CB 3.27Å; A268-S272 WeakPolarHBondContact O-CB 3.23Å; A268-S272 PolarHBondContact O-N 2.9Å; A268-S272 PolarHBondContact O-OG 3Å; F269-S272 PolarHBondContact O-N 3.29Å; F269-S272 VanDerWaalsContact O-N 3.15Å; S272-Y276 VanDerWaalsContact O-CB 3.3Å; S272-Y276 WeakPolarHBondContact O-CB 3.4Å; S272-Y276 PolarHBondContact O-N 3.09Å
273L91.8Very high87.2Confident44 Ų4436.2 Ų36.223%0.2317%0.169CC..Hα-helixtrans-65.6-53179.1-176.966.6000111F94 F269 L270 G275 Y276 F277F94-L273 HydrophobicContact CE1-CD1 4.1Å; F94-L273 HydrophobicContact CE2-CB 4.22Å; F94-L273 HydrophobicContact CE2-CD1 3.97Å; F94-L273 HydrophobicContact CZ-CB 4.29Å; F94-L273 HydrophobicContact CZ-CD1 3.7Å; F269-L273 HydrophobicContact CE1-CD2 4.1Å; F269-L273 HydrophobicContact CZ-CD2 4.46Å; F269-L273 VanDerWaalsContact O-CB 3.28Å; F269-L273 WeakPolarHBondContact O-CB 3.16Å; F269-L273 PolarHBondContact O-N 3.19Å; L270-L273 PolarHBondContact O-N 3.48Å; L273-G275 VanDerWaalsContact C-N 3.3Å; L273-G275 PolarHBondContact O-N 2.85Å; L273-Y276 PolarHBondContact O-N 3.41Å; L273-F277 HydrophobicContact CD1-CD2 4.17Å; L273-F277 HydrophobicContact CD1-CE2 3.42Å; L273-F277 VanDerWaalsContact CD1-CE2 3.42Å; L273-F277 HydrophobicContact CD1-CZ 4.01Å; L273-F277 HydrophobicContact CD2-CE2 4.32Å; L273-F277 HydrophobicContact CG-CD2 4.04Å; L273-F277 HydrophobicContact CG-CE2 3.58Å; L273-F277 WeakPolarHBondContact O-CD2 3.19Å; L273-F277 PolarHBondContact O-N 3.41Å
274T90.6Very high87.8Confident15 Ų1527.4 Ų27.49%0.09214%0.136CC..Hα-helixtrans-63.9-37.2177.6540000111.8I62 L66 L270 F271 G278I62-T274 HydrophobicContact CB-CG2 4.27Å; I62-T274 HydrophobicContact CG2-CG2 3.71Å; L66-T274 HydrophobicContact CD1-CG2 4.45Å; L270-T274 WeakPolarHBondContact O-CB 3.38Å; L270-T274 WeakPolarHBondContact O-CG2 3.26Å; L270-T274 PolarHBondContact O-N 2.92Å; L270-T274 PolarHBondContact O-OG1 3.37Å; F271-T274 PolarHBondContact O-OG1 2.86Å; T274-G278 PolarHBondContact O-N 3.45Å
275G89.8Confident88.3Confident0 Ų026.6 Ų26.60%013%0.131CC..Hα-helixtrans-64.8-40.3174.100000113.5Y63 Y91 F271 L273 G278 I279Y63-G275 VanDerWaalsContact CD2-CA 3.47Å; Y91-G275 VanDerWaalsContact CZ-C 3.44Å; Y91-G275 WeakPolarHBondContact OH-CA 3.5Å; Y91-G275 PolarHBondContact OH-O 3.24Å; Y91-G275 VanDerWaalsContact OH-O 3.1Å; F271-G275 PolarHBondContact O-N 3.44Å; L273-G275 VanDerWaalsContact C-N 3.3Å; L273-G275 PolarHBondContact O-N 2.85Å; G275-G278 PolarHBondContact O-N 3.1Å; G275-I279 PolarHBondContact O-N 3.1Å
276Y91.3Very high88.6Confident6 Ų623.3 Ų23.32%0.02412%0.118CC..Hα-helixtrans-63.3-48.5176.6-179.3-93.6000110.8Y91 F94 G95 E98 V229 S272 L273 G278 I279 S280Y91-Y276 HydrophobicContact CD1-CD2 4.34Å; Y91-Y276 HydrophobicContact CG-CD2 4.15Å; Y91-Y276 WeakPolarHBondContact O-CE2 3.46Å; Y91-Y276 PolarHBondContact OH-N 3.36Å; F94-Y276 HydrophobicContact CB-CD1 3.82Å; F94-Y276 HydrophobicContact CB-CD2 3.69Å; F94-Y276 HydrophobicContact CB-CE1 3.87Å; F94-Y276 HydrophobicContact CB-CE2 3.69Å; F94-Y276 HydrophobicContact CB-CG 3.75Å; F94-Y276 HydrophobicContact CD2-CD1 4.43Å; F94-Y276 HydrophobicContact CD2-CD2 4.29Å; F94-Y276 AromaticContact CD2-CG 3.93Å; F94-Y276 HydrophobicContact CD2-CG 3.93Å; F94-Y276 HydrophobicContact CG-CD1 4.43Å; F94-Y276 HydrophobicContact CG-CG 4.26Å; G95-Y276 WeakPolarHBondContact CA-OH 3.28Å; E98-Y276 PolarHBondContact OE2-OH 2.66Å; V229-Y276 HydrophobicContact CB-CE2 4.29Å; V229-Y276 HydrophobicContact CG1-CD2 3.97Å; V229-Y276 HydrophobicContact CG1-CE2 3.61Å; S272-Y276 VanDerWaalsContact O-CB 3.3Å; S272-Y276 WeakPolarHBondContact O-CB 3.4Å; S272-Y276 PolarHBondContact O-N 3.09Å; L273-Y276 PolarHBondContact O-N 3.41Å; Y276-G278 VanDerWaalsContact C-N 3.32Å; Y276-G278 PolarHBondContact O-N 2.56Å; Y276-I279 VanDerWaalsContact O-CG2 3.23Å; Y276-I279 WeakPolarHBondContact O-CG2 3.18Å; Y276-I279 PolarHBondContact O-N 3.49Å; Y276-S280 WeakPolarHBondContact O-CB 3.44Å; Y276-S280 PolarHBondContact O-N 2.93Å; Y276-S280 PolarHBondContact O-OG 2.89Å; Y276-S280 VanDerWaalsContact O-OG 3.09Å
277F90.1Very high88.6Confident53 Ų5323 Ų2323%0.23211%0.108CC..Hα-helixtrans-59.3-44.7174.8-70-57000111.7L36 F59 L273 S280 F281L36-F277 HydrophobicContact CD1-CD1 3.35Å; L36-F277 HydrophobicContact CD1-CE1 3.68Å; L36-F277 HydrophobicContact CD1-CG 4.39Å; L36-F277 HydrophobicContact CD2-CD1 3.42Å; L36-F277 VanDerWaalsContact CD2-CD1 3.42Å; L36-F277 HydrophobicContact CD2-CE1 3.41Å; L36-F277 VanDerWaalsContact CD2-CE1 3.41Å; L36-F277 HydrophobicContact CG-CD1 3.95Å; L36-F277 HydrophobicContact CG-CE1 4.08Å; F59-F277 HydrophobicContact CB-CB 4.3Å; F59-F277 HydrophobicContact CD1-CB 3.53Å; F59-F277 HydrophobicContact CD1-CD2 4.09Å; F59-F277 HydrophobicContact CD1-CG 4.12Å; F59-F277 HydrophobicContact CD2-CB 3.92Å; F59-F277 HydrophobicContact CE1-CB 3.73Å; F59-F277 AromaticContact CE1-CD2 3.71Å; F59-F277 HydrophobicContact CE1-CD2 3.71Å; F59-F277 AromaticContact CE1-CG 3.85Å; F59-F277 HydrophobicContact CE1-CG 3.85Å; F59-F277 HydrophobicContact CE2-CB 4.13Å; F59-F277 HydrophobicContact CG-CB 3.64Å; F59-F277 HydrophobicContact CZ-CB 4.03Å; F59-F277 HydrophobicContact CZ-CD2 4.34Å; F59-F277 HydrophobicContact CZ-CG 4.14Å; L273-F277 HydrophobicContact CD1-CD2 4.17Å; L273-F277 HydrophobicContact CD1-CE2 3.42Å; L273-F277 VanDerWaalsContact CD1-CE2 3.42Å; L273-F277 HydrophobicContact CD1-CZ 4.01Å; L273-F277 HydrophobicContact CD2-CE2 4.32Å; L273-F277 HydrophobicContact CG-CD2 4.04Å; L273-F277 HydrophobicContact CG-CE2 3.58Å; L273-F277 WeakPolarHBondContact O-CD2 3.19Å; L273-F277 PolarHBondContact O-N 3.41Å; F277-S280 PolarHBondContact O-N 3.45Å; F277-F281 WeakPolarHBondContact O-CD2 3.28Å; F277-F281 PolarHBondContact O-N 2.93Å; F277-F281 VanDerWaalsContact O-N 3.1Å
278G89.7Confident88.6Confident0 Ų020.3 Ų20.30%010%0.1CC..Hα-helixtrans-57.2-50.6176.700000113.3Y60 T274 G275 Y276 S280 F281 V282Y60-G278 WeakPolarHBondContact CE2-O 3.33Å; Y60-G278 VanDerWaalsContact CZ-C 3.48Å; T274-G278 PolarHBondContact O-N 3.45Å; G275-G278 PolarHBondContact O-N 3.1Å; Y276-G278 VanDerWaalsContact C-N 3.32Å; Y276-G278 PolarHBondContact O-N 2.56Å; G278-S280 VanDerWaalsContact C-N 3.32Å; G278-S280 PolarHBondContact O-N 3.15Å; G278-F281 PolarHBondContact O-N 3.37Å; G278-V282 PolarHBondContact O-N 3.03Å
279I89.8Confident88.5Confident22 Ų2222.6 Ų22.611%0.11311%0.109CC..Hα-helixtrans-65.8-35.9-179.5-164.681.8000111.3Y60 Y91 V229 Y233 G275 Y276 F281 V282 L283Y60-I279 VanDerWaalsContact OH-CA 3.29Å; Y60-I279 WeakPolarHBondContact OH-CA 3.45Å; Y60-I279 PolarHBondContact OH-N 3.26Å; Y91-I279 HydrophobicContact CD2-CG2 4.37Å; Y91-I279 HydrophobicContact CE2-CG2 3.89Å; V229-I279 HydrophobicContact CG2-CG2 4.13Å; Y233-I279 HydrophobicContact CE2-CG1 4.46Å; Y233-I279 WeakPolarHBondContact OH-CD1 3.37Å; G275-I279 PolarHBondContact O-N 3.1Å; Y276-I279 VanDerWaalsContact O-CG2 3.23Å; Y276-I279 WeakPolarHBondContact O-CG2 3.18Å; Y276-I279 PolarHBondContact O-N 3.49Å; I279-F281 PolarHBondContact O-N 3.29Å; I279-V282 PolarHBondContact O-N 3.48Å; I279-L283 HydrophobicContact CG1-CD1 4.27Å; I279-L283 HydrophobicContact CG1-CG 4.43Å; I279-L283 WeakPolarHBondContact O-CG 3.41Å; I279-L283 PolarHBondContact O-N 3.07Å
280S88.8Confident88.2Confident1 Ų118.7 Ų18.71%0.0079%0.093CC..Hα-helixtrans-61.7-43.3175.9-68.30000112.2Y276 F277 G278 L283 A284Y276-S280 WeakPolarHBondContact O-CB 3.44Å; Y276-S280 PolarHBondContact O-N 2.93Å; Y276-S280 PolarHBondContact O-OG 2.89Å; Y276-S280 VanDerWaalsContact O-OG 3.09Å; F277-S280 PolarHBondContact O-N 3.45Å; G278-S280 VanDerWaalsContact C-N 3.32Å; G278-S280 PolarHBondContact O-N 3.15Å; S280-L283 PolarHBondContact O-N 3.17Å; S280-A284 WeakPolarHBondContact O-CB 3.38Å; S280-A284 PolarHBondContact O-N 3.26Å
281F89.7Confident88Confident19 Ų1914.9 Ų14.98%0.0837%0.073CC..Hα-helixtrans-66.6-36.2173.4-77.8-70.9000112.8V35 L36 V56 F59 F277 G278 I279 A284 L285V35-F281 HydrophobicContact CG1-CD1 3.83Å; V35-F281 HydrophobicContact CG1-CE1 3.68Å; V35-F281 HydrophobicContact CG1-CE2 4.49Å; V35-F281 HydrophobicContact CG1-CG 4.32Å; V35-F281 HydrophobicContact CG1-CZ 4.03Å; L36-F281 HydrophobicContact CD1-CE2 3.75Å; L36-F281 HydrophobicContact CD1-CZ 3.89Å; V56-F281 HydrophobicContact CG2-CB 3.75Å; F59-F281 AromaticContact CD2-CD2 3.82Å; F59-F281 HydrophobicContact CD2-CD2 3.82Å; F59-F281 AromaticContact CD2-CE2 3.62Å; F59-F281 HydrophobicContact CD2-CE2 3.62Å; F59-F281 HydrophobicContact CE2-CD2 4.15Å; F59-F281 AromaticContact CE2-CE2 3.45Å; F59-F281 HydrophobicContact CE2-CE2 3.45Å; F59-F281 VanDerWaalsContact CE2-CE2 3.45Å; F59-F281 HydrophobicContact CE2-CZ 4.32Å; F277-F281 WeakPolarHBondContact O-CD2 3.28Å; F277-F281 PolarHBondContact O-N 2.93Å; F277-F281 VanDerWaalsContact O-N 3.1Å; G278-F281 PolarHBondContact O-N 3.37Å; I279-F281 PolarHBondContact O-N 3.29Å; F281-A284 PolarHBondContact O-N 3.47Å; F281-L285 WeakPolarHBondContact O-CB 3.09Å; F281-L285 PolarHBondContact O-N 3.11Å
282V89.6Confident87.8Confident14 Ų1415 Ų159%0.0857%0.074CC..Hα-helixtrans-64.7-45.3174.7166.60000111.3V56 Y60 G278 I279 A284 L285 I286 T298V56-V282 HydrophobicContact CG1-CG2 4.39Å; V56-V282 HydrophobicContact CG2-CG2 3.78Å; Y60-V282 HydrophobicContact CD2-CG2 4.44Å; Y60-V282 HydrophobicContact CE2-CG2 3.52Å; G278-V282 PolarHBondContact O-N 3.03Å; I279-V282 PolarHBondContact O-N 3.48Å; V282-A284 VanDerWaalsContact C-N 3.32Å; V282-A284 PolarHBondContact O-N 3.01Å; V282-L285 WeakPolarHBondContact O-CB 3.16Å; V282-L285 PolarHBondContact O-N 2.87Å; V282-I286 HydrophobicContact CG1-CD1 3.88Å; V282-I286 HydrophobicContact CG1-CG1 4.39Å; V282-I286 VanDerWaalsContact O-CG1 3.28Å; V282-I286 WeakPolarHBondContact O-CG1 3.25Å; V282-I286 PolarHBondContact O-N 3.44Å; V282-T298 HydrophobicContact CG2-CG2 3.54Å
283L88.7Confident87.4Confident1 Ų116.2 Ų16.21%0.0058%0.08CC..Hα-helixtrans-64.5-38.3177.4-72171.2000111.6M218 N225 M228 V229 I279 S280 L285 I286 K287M218-L283 HydrophobicContact CE-CB 4.18Å; M218-L283 HydrophobicContact SD-CD2 3.97Å; N225-L283 HydrophobicContact CB-CB 4.19Å; M228-L283 HydrophobicContact CB-CD1 4.42Å; V229-L283 HydrophobicContact CG2-CD1 3.27Å; I279-L283 HydrophobicContact CG1-CD1 4.27Å; I279-L283 HydrophobicContact CG1-CG 4.43Å; I279-L283 WeakPolarHBondContact O-CG 3.41Å; I279-L283 PolarHBondContact O-N 3.07Å; S280-L283 PolarHBondContact O-N 3.17Å; L283-L285 VanDerWaalsContact C-N 3.34Å; L283-L285 PolarHBondContact O-N 3.44Å; L283-I286 HydrophobicContact CD2-CD1 4.32Å; L283-I286 PolarHBondContact O-N 2.95Å; L283-K287 WeakPolarHBondContact O-CB 3.42Å; L283-K287 PolarHBondContact O-N 3.35Å
284A86.9Confident87.1Confident0 Ų014.2 Ų14.20%07%0.07CC..Hα-helixtrans-60.8-43.3171.900000112V33 V35 S280 F281 V282 I286 K287 I288V33-A284 HydrophobicContact CG1-CB 4.15Å; V35-A284 HydrophobicContact CG2-CB 3.39Å; S280-A284 WeakPolarHBondContact O-CB 3.38Å; S280-A284 PolarHBondContact O-N 3.26Å; F281-A284 PolarHBondContact O-N 3.47Å; V282-A284 VanDerWaalsContact C-N 3.32Å; V282-A284 PolarHBondContact O-N 3.01Å; A284-I286 VanDerWaalsContact C-N 3.35Å; A284-I286 PolarHBondContact O-N 2.95Å; A284-K287 PolarHBondContact O-N 3.36Å; A284-I288 VanDerWaalsContact O-CG1 3.32Å; A284-I288 WeakPolarHBondContact O-CG1 3.24Å; A284-I288 PolarHBondContact O-N 2.92Å
285L85.9Confident86.7Confident0 Ų014.1 Ų14.10%07%0.069CC..Hα-helixtrans-64.3-39.2176.4-165.870.1000111.4F49 C52 F281 V282 L283 F289 G290 A294 V297F49-L285 HydrophobicContact CD2-CD1 4.03Å; F49-L285 HydrophobicContact CE2-CD1 4.26Å; C52-L285 HydrophobicContact CB-CB 4.5Å; C52-L285 HydrophobicContact CB-CD1 3.82Å; F281-L285 WeakPolarHBondContact O-CB 3.09Å; F281-L285 PolarHBondContact O-N 3.11Å; V282-L285 WeakPolarHBondContact O-CB 3.16Å; V282-L285 PolarHBondContact O-N 2.87Å; L283-L285 VanDerWaalsContact C-N 3.34Å; L283-L285 PolarHBondContact O-N 3.44Å; L285-F289 HydrophobicContact CD1-CD2 3.6Å; L285-F289 HydrophobicContact CD1-CE2 4.19Å; L285-F289 HydrophobicContact CD1-CG 4.4Å; L285-F289 WeakPolarHBondContact O-CA 3.36Å; L285-F289 WeakPolarHBondContact O-CB 3.36Å; L285-F289 PolarHBondContact O-N 3.2Å; L285-G290 PolarHBondContact O-N 3.02Å; L285-A294 HydrophobicContact CB-CB 4.23Å; L285-A294 HydrophobicContact CD2-CB 3.94Å; L285-A294 HydrophobicContact CG-CB 4.08Å; L285-V297 HydrophobicContact CD2-CB 3.82Å; L285-V297 HydrophobicContact CD2-CG1 4.05Å; L285-V297 HydrophobicContact CD2-CG2 3.88Å
286I87.4Confident86.2Confident9 Ų914.6 Ų14.65%0.0467%0.072CC..Hα-helixtrans-63.4-43.4173.1-67.8169.7000110.9E215 V282 L283 A284 G290 A294E215-I286 HydrophobicContact CB-CG2 3.52Å; E215-I286 HydrophobicContact CG-CG2 4.04Å; V282-I286 HydrophobicContact CG1-CD1 3.88Å; V282-I286 HydrophobicContact CG1-CG1 4.39Å; V282-I286 VanDerWaalsContact O-CG1 3.28Å; V282-I286 WeakPolarHBondContact O-CG1 3.25Å; V282-I286 PolarHBondContact O-N 3.44Å; L283-I286 HydrophobicContact CD2-CD1 4.32Å; L283-I286 PolarHBondContact O-N 2.95Å; A284-I286 VanDerWaalsContact C-N 3.35Å; A284-I286 PolarHBondContact O-N 2.95Å; I286-G290 WeakPolarHBondContact O-CA 3.3Å; I286-G290 PolarHBondContact O-N 3.17Å; I286-A294 HydrophobicContact CD1-CB 4.36Å; I286-A294 HydrophobicContact CG1-CB 3.42Å; I286-A294 VanDerWaalsContact CG1-CB 3.42Å
287K84.4Confident85.8Confident27 Ų2715 Ų1512%0.1178%0.075CC..Hα-helixtrans-64.2-48.9180-170.5174176.7173.20111.7V33 M218 K219 A223 L283 A284V33-K287 HydrophobicContact CG2-CD 4.22Å; M218-K287 HydrophobicContact CE-CB 3.94Å; M218-K287 HydrophobicContact CE-CD 4.18Å; M218-K287 HydrophobicContact CE-CG 4.39Å; K219-K287 VanDerWaalsContact CE-O 3.32Å; K219-K287 WeakPolarHBondContact CE-O 3.34Å; A223-K287 PolarHBondContact O-NZ 3.45Å; L283-K287 WeakPolarHBondContact O-CB 3.42Å; L283-K287 PolarHBondContact O-N 3.35Å; A284-K287 PolarHBondContact O-N 3.36Å
288I82.6Confident85.4Confident44 Ų4412.8 Ų12.823%0.2267%0.066CC..Hα-helixtrans-77.6-48.5-174.9-58.4164.5000111.8V33 A284V33-I288 HydrophobicContact CB-CD1 4.27Å; V33-I288 HydrophobicContact CB-CG1 4.38Å; V33-I288 HydrophobicContact CG1-CD1 3.91Å; V33-I288 HydrophobicContact CG1-CG1 4.17Å; V33-I288 HydrophobicContact CG2-CD1 4.32Å; V33-I288 HydrophobicContact CG2-CG1 3.89Å; A284-I288 VanDerWaalsContact O-CG1 3.32Å; A284-I288 WeakPolarHBondContact O-CG1 3.24Å; A284-I288 PolarHBondContact O-N 2.92Å
289F82.6Confident84.8Confident51 Ų5112.9 Ų12.922%0.2247%0.066CC..Hα-helixtrans-111.5-13.7-168.1-63.7-77.3000113.6K45 F49 L285 I293K45-F289 WeakPolarHBondContact O-CZ 3.37Å; F49-F289 HydrophobicContact CB-CE1 4.21Å; F49-F289 HydrophobicContact CB-CE2 3.91Å; F49-F289 HydrophobicContact CB-CZ 3.57Å; F49-F289 HydrophobicContact CD2-CD1 4.49Å; F49-F289 HydrophobicContact CD2-CD2 4.22Å; F49-F289 HydrophobicContact CD2-CE1 4.39Å; F49-F289 HydrophobicContact CD2-CE2 4.09Å; F49-F289 HydrophobicContact CD2-CG 4.41Å; F49-F289 HydrophobicContact CD2-CZ 4.2Å; F49-F289 HydrophobicContact CG-CZ 4.37Å; L285-F289 HydrophobicContact CD1-CD2 3.6Å; L285-F289 HydrophobicContact CD1-CE2 4.19Å; L285-F289 HydrophobicContact CD1-CG 4.4Å; L285-F289 WeakPolarHBondContact O-CA 3.36Å; L285-F289 WeakPolarHBondContact O-CB 3.36Å; L285-F289 PolarHBondContact O-N 3.2Å; F289-I293 HydrophobicContact CB-CB 4Å; F289-I293 HydrophobicContact CB-CD1 3.75Å; F289-I293 HydrophobicContact CB-CG1 4.43Å; F289-I293 HydrophobicContact CB-CG2 3.94Å; F289-I293 HydrophobicContact CD1-CD1 4.42Å; F289-I293 HydrophobicContact CG-CD1 4.49Å; F289-I293 WeakPolarHBondContact O-CD1 3.45Å
290G84.4Confident84.1Confident2 Ų212.3 Ų12.32%0.0217%0.066CC..  trans93.5167.1179.400000114.6E215 L285 I286 L292 I293 A294E215-G290 WeakPolarHBondContact OE1-CA 3.37Å; L285-G290 PolarHBondContact O-N 3.02Å; I286-G290 WeakPolarHBondContact O-CA 3.3Å; I286-G290 PolarHBondContact O-N 3.17Å; G290-L292 PolarHBondContact O-N 3.04Å; G290-I293 PolarHBondContact O-N 3.12Å; G290-A294 PolarHBondContact O-N 3.46Å
291A85.1Confident83.6Confident1 Ų113.4 Ų13.41%0.0087%0.07CC..Hα-helixtrans-63.3-36.9-172.100000113.8V151 E215 A294 V295V151-A291 HydrophobicContact CG1-CB 4.33Å; E215-A291 HydrophobicContact CB-CB 4.37Å; E215-A291 VanDerWaalsContact OE2-CB 3.24Å; E215-A291 WeakPolarHBondContact OE2-CB 3.28Å; E215-A291 PolarHBondContact OE2-N 3.49Å; A291-A294 PolarHBondContact O-N 2.88Å; A291-V295 WeakPolarHBondContact O-CB 3.35Å; A291-V295 WeakPolarHBondContact O-CG2 3.45Å; A291-V295 PolarHBondContact O-N 3.2Å
292L82.9Confident82.9Confident6 Ų613.8 Ų13.83%0.0317%0.072CC..Hα-helixtrans-63.9-44.7-178.2-175.868000112.4L148 M152 Y163 G290 V295 T296L148-L292 HydrophobicContact CD2-CD1 4.25Å; L148-L292 HydrophobicContact CG-CD1 4.33Å; M152-L292 HydrophobicContact CB-CD1 4.16Å; M152-L292 HydrophobicContact CG-CD1 4.47Å; Y163-L292 HydrophobicContact CD1-CD2 3.75Å; Y163-L292 HydrophobicContact CE1-CB 4.27Å; Y163-L292 HydrophobicContact CE1-CD2 3.53Å; Y163-L292 HydrophobicContact CE1-CG 4.42Å; G290-L292 PolarHBondContact O-N 3.04Å; L292-V295 PolarHBondContact O-N 2.95Å; L292-T296 PolarHBondContact O-N 3.48Å; L292-T296 PolarHBondContact O-OG1 2.73Å
293I82.7Confident81.9Confident26 Ų2614.2 Ų14.213%0.1338%0.076CC..Hα-helixtrans-66-43.6178.4-68.6173.5000109.6F49 F289 G290 V295 T296 V297 K339F49-I293 HydrophobicContact CD2-CG2 4.43Å; F49-I293 HydrophobicContact CE2-CG2 3.68Å; F289-I293 HydrophobicContact CB-CB 4Å; F289-I293 HydrophobicContact CB-CD1 3.75Å; F289-I293 HydrophobicContact CB-CG1 4.43Å; F289-I293 HydrophobicContact CB-CG2 3.94Å; F289-I293 HydrophobicContact CD1-CD1 4.42Å; F289-I293 HydrophobicContact CG-CD1 4.49Å; F289-I293 WeakPolarHBondContact O-CD1 3.45Å; G290-I293 PolarHBondContact O-N 3.12Å; I293-V295 VanDerWaalsContact C-N 3.31Å; I293-V295 PolarHBondContact O-N 2.78Å; I293-T296 WeakPolarHBondContact O-CB 3.39Å; I293-T296 PolarHBondContact O-N 3.04Å; I293-T296 VanDerWaalsContact O-N 3.15Å; I293-V297 HydrophobicContact CG2-CG2 4.42Å; I293-V297 WeakPolarHBondContact O-CG2 3.42Å; I293-V297 PolarHBondContact O-N 3.29Å; I293-K339 HydrophobicContact CD1-CD 3.7Å; I293-K339 HydrophobicContact CG1-CD 3.6Å
294A86.3Confident80.9Confident2 Ų219.6 Ų19.62%0.01710%0.103CC..Hα-helixtrans-61.5-39.7177.900000113.2L285 I286 G290 A291 T298L285-A294 HydrophobicContact CB-CB 4.23Å; L285-A294 HydrophobicContact CD2-CB 3.94Å; L285-A294 HydrophobicContact CG-CB 4.08Å; I286-A294 HydrophobicContact CD1-CB 4.36Å; I286-A294 HydrophobicContact CG1-CB 3.42Å; I286-A294 VanDerWaalsContact CG1-CB 3.42Å; G290-A294 PolarHBondContact O-N 3.46Å; A291-A294 PolarHBondContact O-N 2.88Å; A294-T298 WeakPolarHBondContact O-CB 3.24Å; A294-T298 WeakPolarHBondContact O-CG2 3.32Å; A294-T298 PolarHBondContact O-N 2.9Å; A294-T298 PolarHBondContact O-OG1 2.84Å
295V82.3Confident80Confident13 Ų1321.2 Ų21.28%0.07911%0.113CC..Hα-helixtrans-66.9-38175.1162.30000111.8K147 L148 V151 A291 L292 I293 T298 T299K147-V295 HydrophobicContact CD-CG1 4.33Å; K147-V295 HydrophobicContact CG-CG1 3.85Å; L148-V295 HydrophobicContact CB-CG1 3.93Å; L148-V295 HydrophobicContact CD1-CG1 4.49Å; L148-V295 HydrophobicContact CG-CG1 4.12Å; V151-V295 HydrophobicContact CB-CG1 4.47Å; V151-V295 HydrophobicContact CB-CG2 4.31Å; V151-V295 HydrophobicContact CG1-CB 4.34Å; V151-V295 HydrophobicContact CG1-CG2 3.94Å; V151-V295 HydrophobicContact CG2-CB 4.5Å; V151-V295 HydrophobicContact CG2-CG1 4.28Å; V151-V295 HydrophobicContact CG2-CG2 3.78Å; A291-V295 WeakPolarHBondContact O-CB 3.35Å; A291-V295 WeakPolarHBondContact O-CG2 3.45Å; A291-V295 PolarHBondContact O-N 3.2Å; L292-V295 PolarHBondContact O-N 2.95Å; I293-V295 VanDerWaalsContact C-N 3.31Å; I293-V295 PolarHBondContact O-N 2.78Å; V295-T298 WeakPolarHBondContact CA-OG1 3.46Å; V295-T298 PolarHBondContact O-OG1 3.29Å; V295-T298 VanDerWaalsContact O-OG1 3.13Å; V295-T299 VanDerWaalsContact O-CB 3.27Å; V295-T299 WeakPolarHBondContact O-CB 3.38Å; V295-T299 PolarHBondContact O-N 3.29Å; V295-T299 PolarHBondContact O-OG1 3.34Å
296T78.6Confident79.1Confident9 Ų922 Ų226%0.05512%0.117CC..Hα-helixtrans-62.8-49.5175.6-54.80000111.6M174 L292 I293 T298 T299 G300 N335M174-T296 HydrophobicContact CE-CG2 3.76Å; M174-T296 HydrophobicContact SD-CG2 4.28Å; L292-T296 PolarHBondContact O-N 3.48Å; L292-T296 PolarHBondContact O-OG1 2.73Å; I293-T296 WeakPolarHBondContact O-CB 3.39Å; I293-T296 PolarHBondContact O-N 3.04Å; I293-T296 VanDerWaalsContact O-N 3.15Å; T296-T298 PolarHBondContact O-N 3.35Å; T296-T299 PolarHBondContact O-N 3.49Å; T296-G300 PolarHBondContact O-N 3.26Å; T296-N335 PolarHBondContact OG1-ND2 3.22Å
297V82.5Confident78.1Confident16 Ų1625.5 Ų25.510%0.09714%0.138CC..Hα-helixtrans-61.8-45.5178.7173.60000111.3F49 V53 V56 F57 L285 I293 T299 G300 R301F49-V297 HydrophobicContact CE2-CG2 4.16Å; F49-V297 HydrophobicContact CZ-CG2 4.18Å; V53-V297 HydrophobicContact CB-CG1 4.37Å; V53-V297 HydrophobicContact CG1-CG1 4.21Å; V53-V297 HydrophobicContact CG2-CG1 3.89Å; V53-V297 HydrophobicContact CG2-CG2 3.86Å; V56-V297 HydrophobicContact CB-CG1 4.39Å; V56-V297 HydrophobicContact CG1-CG1 4.09Å; F57-V297 HydrophobicContact CD2-CG1 4.47Å; F57-V297 HydrophobicContact CE2-CG1 4Å; L285-V297 HydrophobicContact CD2-CB 3.82Å; L285-V297 HydrophobicContact CD2-CG1 4.05Å; L285-V297 HydrophobicContact CD2-CG2 3.88Å; I293-V297 HydrophobicContact CG2-CG2 4.42Å; I293-V297 WeakPolarHBondContact O-CG2 3.42Å; I293-V297 PolarHBondContact O-N 3.29Å; V297-T299 VanDerWaalsContact C-N 3.26Å; V297-T299 PolarHBondContact O-N 2.92Å; V297-G300 PolarHBondContact O-N 3.31Å; V297-R301 PolarHBondContact O-N 3.2Å
298T83.1Confident77.2Confident6 Ų628.3 Ų28.34%0.03715%0.154CC..Hα-helixtrans-67.3-27.2178.855.10000113.1V56 K147 V282 A294 V295 T296 K302V56-T298 HydrophobicContact CG1-CG2 4.14Å; K147-T298 PolarHBondContact NZ-OG1 2.94Å; V282-T298 HydrophobicContact CG2-CG2 3.54Å; A294-T298 WeakPolarHBondContact O-CB 3.24Å; A294-T298 WeakPolarHBondContact O-CG2 3.32Å; A294-T298 PolarHBondContact O-N 2.9Å; A294-T298 PolarHBondContact O-OG1 2.84Å; V295-T298 WeakPolarHBondContact CA-OG1 3.46Å; V295-T298 PolarHBondContact O-OG1 3.29Å; V295-T298 VanDerWaalsContact O-OG1 3.13Å; T296-T298 PolarHBondContact O-N 3.35Å; T298-K302 WeakPolarHBondContact O-CG 3.47Å; T298-K302 PolarHBondContact O-N 3Å
299T77Confident76.2Confident1 Ų127.2 Ų27.21%0.00615%0.151CC..Hα-helixtrans-74.7-44.7174.1-58.50000111.1C145 L178 V295 T296 V297 R301 K302 A303C145-T299 HydrophobicContact CB-CG2 3.63Å; L178-T299 HydrophobicContact CD1-CG2 4.39Å; V295-T299 VanDerWaalsContact O-CB 3.27Å; V295-T299 WeakPolarHBondContact O-CB 3.38Å; V295-T299 PolarHBondContact O-N 3.29Å; V295-T299 PolarHBondContact O-OG1 3.34Å; T296-T299 PolarHBondContact O-N 3.49Å; V297-T299 VanDerWaalsContact C-N 3.26Å; V297-T299 PolarHBondContact O-N 2.92Å; T299-R301 VanDerWaalsContact C-N 3.31Å; T299-R301 PolarHBondContact O-N 3.41Å; T299-K302 WeakPolarHBondContact O-CB 3.42Å; T299-K302 PolarHBondContact O-N 2.83Å; T299-K302 VanDerWaalsContact O-N 3.08Å; T299-A303 PolarHBondContact O-N 3.34Å
300G74.1Confident75.3Confident10 Ų1026.4 Ų26.410%0.10315%0.147CC..Hα-helixtrans-57.6-42.6173.600000112.6T296 V297 K302 A303 M304T296-G300 PolarHBondContact O-N 3.26Å; V297-G300 PolarHBondContact O-N 3.31Å; G300-K302 PolarHBondContact O-N 2.99Å; G300-A303 PolarHBondContact O-N 3.45Å; G300-M304 PolarHBondContact O-N 3.43Å
301R79.1Confident74.4Confident24 Ų2432.1 Ų32.19%0.09118%0.176CC..Hα-helixtrans-57-49.2171.6176.1-153.254.1128.8-19.2112F57 Y60 L61 V297 T299 A303 M304 T305F57-R301 HydrophobicContact CD1-CB 4.37Å; F57-R301 HydrophobicContact CD1-CG 4.49Å; F57-R301 HydrophobicContact CD2-CB 4.29Å; F57-R301 HydrophobicContact CE1-CB 4.1Å; F57-R301 HydrophobicContact CE2-CB 4.05Å; F57-R301 HydrophobicContact CG-CB 4.48Å; F57-R301 HydrophobicContact CZ-CB 3.96Å; Y60-R301 PolarHBondContact O-NH1 3.33Å; L61-R301 HydrophobicContact CD2-CG 4.48Å; V297-R301 PolarHBondContact O-N 3.2Å; T299-R301 VanDerWaalsContact C-N 3.31Å; T299-R301 PolarHBondContact O-N 3.41Å; R301-A303 VanDerWaalsContact C-N 3.3Å; R301-A303 PolarHBondContact O-N 3.38Å; R301-M304 WeakPolarHBondContact O-CB 3.35Å; R301-M304 PolarHBondContact O-N 2.99Å; R301-M304 VanDerWaalsContact O-N 3.13Å; R301-T305 PolarHBondContact O-N 3.39Å; R301-T305 PolarHBondContact O-OG1 3.49Å; R301-T305 VanDerWaalsContact O-OG1 3.09Å
302K74.2Confident73.1Confident28 Ų2839.6 Ų39.612%0.12221%0.208CC..Hα-helixtrans-61.1-40.7-179.4-75.3178.4-179.3-170.90111.8V141 K144 T298 T299 G300 M304 T305 I306V141-K302 HydrophobicContact CG1-CB 4.13Å; V141-K302 HydrophobicContact CG1-CD 4.38Å; V141-K302 HydrophobicContact CG1-CG 4.44Å; K144-K302 VanDerWaalsContact CB-NZ 3.28Å; T298-K302 WeakPolarHBondContact O-CG 3.47Å; T298-K302 PolarHBondContact O-N 3Å; T299-K302 WeakPolarHBondContact O-CB 3.42Å; T299-K302 PolarHBondContact O-N 2.83Å; T299-K302 VanDerWaalsContact O-N 3.08Å; G300-K302 PolarHBondContact O-N 2.99Å; K302-M304 VanDerWaalsContact C-N 3.34Å; K302-M304 PolarHBondContact O-N 3.11Å; K302-T305 PolarHBondContact O-N 3.47Å; K302-I306 WeakPolarHBondContact O-CG1 3.4Å; K302-I306 PolarHBondContact O-N 2.73Å
303A69.4Low71.9Confident22 Ų2244.1 Ų44.118%0.18223%0.228CC..Hα-helixtrans-59.2-44.7173.700000111.3T299 G300 R301 T305 I306 V307 V328T299-A303 PolarHBondContact O-N 3.34Å; G300-A303 PolarHBondContact O-N 3.45Å; R301-A303 VanDerWaalsContact C-N 3.3Å; R301-A303 PolarHBondContact O-N 3.38Å; A303-T305 PolarHBondContact O-N 3.24Å; A303-I306 WeakPolarHBondContact O-CB 3.15Å; A303-I306 PolarHBondContact O-N 2.75Å; A303-V307 WeakPolarHBondContact O-CG2 3.43Å; A303-V307 PolarHBondContact O-N 3.49Å; A303-V328 HydrophobicContact CB-CG1 4.26Å
304M68.3Low70.3Confident115 Ų11548.2 Ų48.257%0.56727%0.265SS*.Hα-helixtrans-61.8-40.6173.9-78.2-158.9177.300113F57 G300 R301 K302 I306 V307 L308F57-M304 HydrophobicContact CD1-SD 4.16Å; F57-M304 HydrophobicContact CE1-CE 4.36Å; F57-M304 HydrophobicContact CE1-CG 4.23Å; F57-M304 HydrophobicContact CE1-SD 3.55Å; F57-M304 VanDerWaalsContact CE1-SD 3.55Å; G300-M304 PolarHBondContact O-N 3.43Å; R301-M304 WeakPolarHBondContact O-CB 3.35Å; R301-M304 PolarHBondContact O-N 2.99Å; R301-M304 VanDerWaalsContact O-N 3.13Å; K302-M304 VanDerWaalsContact C-N 3.34Å; K302-M304 PolarHBondContact O-N 3.11Å; M304-I306 VanDerWaalsContact C-N 3.29Å; M304-I306 PolarHBondContact O-N 3.3Å; M304-V307 PolarHBondContact O-N 3.03Å; M304-L308 WeakPolarHBondContact O-CB 3.21Å; M304-L308 PolarHBondContact O-N 2.93Å
305T67.3Low69Low33 Ų3352 Ų5220%0.20228%0.282CS..Hα-helixtrans-62-38.3176.2-49.10000111.8L61 R301 K302 A303 L308 S309L61-T305 VanDerWaalsContact CD2-OG1 3.24Å; L61-T305 WeakPolarHBondContact CD2-OG1 3.35Å; R301-T305 PolarHBondContact O-N 3.39Å; R301-T305 PolarHBondContact O-OG1 3.49Å; R301-T305 VanDerWaalsContact O-OG1 3.09Å; K302-T305 PolarHBondContact O-N 3.47Å; A303-T305 PolarHBondContact O-N 3.24Å; T305-L308 PolarHBondContact O-N 3.49Å; T305-S309 WeakPolarHBondContact O-CB 3.17Å; T305-S309 PolarHBondContact O-N 3.46Å
306I66.9Low67.6Low17 Ų1756.1 Ų56.19%0.08731%0.309CS..Hα-helixtrans-62-49.6174.9-67.8165.6000110V141 I142 F181 K302 A303 M304 L308 S309 F310V141-I306 HydrophobicContact CB-CD1 4.31Å; V141-I306 HydrophobicContact CG1-CD1 3.74Å; V141-I306 HydrophobicContact CG1-CG1 3.98Å; I142-I306 HydrophobicContact CG1-CD1 4.24Å; F181-I306 HydrophobicContact CE1-CG2 3.74Å; F181-I306 HydrophobicContact CE2-CG2 4.34Å; F181-I306 HydrophobicContact CZ-CG2 3.38Å; K302-I306 WeakPolarHBondContact O-CG1 3.4Å; K302-I306 PolarHBondContact O-N 2.73Å; A303-I306 WeakPolarHBondContact O-CB 3.15Å; A303-I306 PolarHBondContact O-N 2.75Å; M304-I306 VanDerWaalsContact C-N 3.29Å; M304-I306 PolarHBondContact O-N 3.3Å; I306-L308 VanDerWaalsContact C-N 3.28Å; I306-L308 PolarHBondContact O-N 3.32Å; I306-S309 WeakPolarHBondContact O-CB 3.31Å; I306-S309 PolarHBondContact O-N 2.89Å; I306-S309 VanDerWaalsContact O-N 3.11Å; I306-F310 HydrophobicContact CG2-CD2 3.74Å; I306-F310 HydrophobicContact CG2-CE2 3.6Å; I306-F310 VanDerWaalsContact O-CD2 3.28Å; I306-F310 WeakPolarHBondContact O-CD2 3.41Å; I306-F310 PolarHBondContact O-N 2.88Å
307V67.1Low66.6Low83 Ų8362.1 Ų62.150%0.50333%0.334SS..Hα-helixtrans-55.9-45.7176.61730000110.7A303 M304 S309 F310 I311A303-V307 WeakPolarHBondContact O-CG2 3.43Å; A303-V307 PolarHBondContact O-N 3.49Å; M304-V307 PolarHBondContact O-N 3.03Å; V307-S309 VanDerWaalsContact C-N 3.34Å; V307-S309 PolarHBondContact O-N 3.33Å; V307-F310 PolarHBondContact O-N 3.46Å; V307-I311 HydrophobicContact CG1-CD1 4.1Å; V307-I311 WeakPolarHBondContact O-CG1 3.33Å; V307-I311 PolarHBondContact O-N 3.18Å; V307-I311 VanDerWaalsContact O-N 3.12Å
308L64.1Low65.8Low85 Ų8563.3 Ų63.345%0.44534%0.341SS..Hα-helixtrans-62.3-40.7177.9-145.471.9000111.9M304 T305 I306 F310 I311 F312M304-L308 WeakPolarHBondContact O-CB 3.21Å; M304-L308 PolarHBondContact O-N 2.93Å; T305-L308 PolarHBondContact O-N 3.49Å; I306-L308 VanDerWaalsContact C-N 3.28Å; I306-L308 PolarHBondContact O-N 3.32Å; L308-F310 PolarHBondContact O-N 2.84Å; L308-I311 PolarHBondContact O-N 2.85Å; L308-I311 VanDerWaalsContact O-N 3.17Å; L308-F312 HydrophobicContact CD1-CE2 4.26Å; L308-F312 HydrophobicContact CD2-CE2 4.44Å; L308-F312 HydrophobicContact CG-CD2 3.95Å; L308-F312 HydrophobicContact CG-CE2 3.95Å; L308-F312 WeakPolarHBondContact O-CD2 3.49Å; L308-F312 PolarHBondContact O-N 2.87Å
309S61.4Low65.2Low22 Ų2270.6 Ų70.615%0.15437%0.373CS..Hα-helixtrans-62.6-39.8176.5-174.50000111.9T305 I306 V307 I311 F312 F313T305-S309 WeakPolarHBondContact O-CB 3.17Å; T305-S309 PolarHBondContact O-N 3.46Å; I306-S309 WeakPolarHBondContact O-CB 3.31Å; I306-S309 PolarHBondContact O-N 2.89Å; I306-S309 VanDerWaalsContact O-N 3.11Å; V307-S309 VanDerWaalsContact C-N 3.34Å; V307-S309 PolarHBondContact O-N 3.33Å; S309-I311 VanDerWaalsContact C-N 3.32Å; S309-I311 PolarHBondContact O-N 3.34Å; S309-F312 PolarHBondContact O-N 3.18Å; S309-F313 WeakPolarHBondContact O-CA 3.47Å; S309-F313 VanDerWaalsContact O-CB 3.32Å; S309-F313 WeakPolarHBondContact O-CB 3.26Å; S309-F313 WeakPolarHBondContact O-CD2 3.41Å; S309-F313 PolarHBondContact O-N 3.01Å
310F64.8Low64.8Low34 Ų3474.9 Ų74.915%0.14939%0.393CS..Hα-helixtrans-68.2-29174.3-81.9-78.5000113.6F181 I306 V307 L308 K315 Y321F181-F310 HydrophobicContact CE1-CE2 4.26Å; F181-F310 HydrophobicContact CZ-CD2 4.43Å; F181-F310 AromaticContact CZ-CE2 3.75Å; F181-F310 HydrophobicContact CZ-CE2 3.75Å; F181-F310 HydrophobicContact CZ-CZ 4.48Å; I306-F310 HydrophobicContact CG2-CD2 3.74Å; I306-F310 HydrophobicContact CG2-CE2 3.6Å; I306-F310 VanDerWaalsContact O-CD2 3.28Å; I306-F310 WeakPolarHBondContact O-CD2 3.41Å; I306-F310 PolarHBondContact O-N 2.88Å; V307-F310 PolarHBondContact O-N 3.46Å; L308-F310 PolarHBondContact O-N 2.84Å; F310-K315 HydrophobicContact CD1-CB 3.94Å; F310-K315 HydrophobicContact CD1-CD 4.37Å; F310-K315 HydrophobicContact CE1-CB 3.98Å; F310-K315 HydrophobicContact CE1-CD 4.12Å; F310-Y321 HydrophobicContact CE1-CE2 4.04Å; F310-Y321 HydrophobicContact CE2-CE1 4.46Å; F310-Y321 HydrophobicContact CZ-CD1 4.44Å; F310-Y321 AromaticContact CZ-CE1 3.91Å; F310-Y321 HydrophobicContact CZ-CE1 3.91Å; F310-Y321 HydrophobicContact CZ-CE2 4.15Å; F310-Y321 AromaticContact CZ-CZ 3.74Å
311I64.5Low64.4Low122 Ų12275 Ų7563%0.62639%0.39SS*.Hα-helixtrans-74.4-42.3175.9-65.8172.2000110.9V307 L308 S309V307-I311 HydrophobicContact CG1-CD1 4.1Å; V307-I311 WeakPolarHBondContact O-CG1 3.33Å; V307-I311 PolarHBondContact O-N 3.18Å; V307-I311 VanDerWaalsContact O-N 3.12Å; L308-I311 PolarHBondContact O-N 2.85Å; L308-I311 VanDerWaalsContact O-N 3.17Å; S309-I311 VanDerWaalsContact C-N 3.32Å; S309-I311 PolarHBondContact O-N 3.34Å
312F58.9Low64Low157 Ų15777.2 Ų77.269%0.68941%0.406SS*.Hα-helixtrans-85.5-34.4-175.7-85.2-81.6000114L308 S309L308-F312 HydrophobicContact CD1-CE2 4.26Å; L308-F312 HydrophobicContact CD2-CE2 4.44Å; L308-F312 HydrophobicContact CG-CD2 3.95Å; L308-F312 HydrophobicContact CG-CE2 3.95Å; L308-F312 WeakPolarHBondContact O-CD2 3.49Å; L308-F312 PolarHBondContact O-N 2.87Å; S309-F312 PolarHBondContact O-N 3.18Å
313F56.3Low64.1Low102 Ų10284.3 Ų84.345%0.44743%0.432SS..THydrogen-bonded Turntrans-104.4109.3175.6-61.1-79000107.9E68 S309 K315E68-F313 WeakPolarHBondContact OE1-CE2 3.42Å; S309-F313 WeakPolarHBondContact O-CA 3.47Å; S309-F313 VanDerWaalsContact O-CB 3.32Å; S309-F313 WeakPolarHBondContact O-CB 3.26Å; S309-F313 WeakPolarHBondContact O-CD2 3.41Å; S309-F313 PolarHBondContact O-N 3.01Å; F313-K315 VanDerWaalsContact C-N 3.25Å; F313-K315 PolarHBondContact O-N 2.99Å
314A50.5Low64Low111 Ų11183.3 Ų83.392%0.91742%0.424SS*.THydrogen-bonded Turntrans-59.288.7176.100000110.2
315K58.3Low64Low83 Ų8379 Ų7936%0.36141%0.409SS..  trans-102.6151.7172.4-71.5-176.1-175.1179.50108.4F310 F313 F317F310-K315 HydrophobicContact CD1-CB 3.94Å; F310-K315 HydrophobicContact CD1-CD 4.37Å; F310-K315 HydrophobicContact CE1-CB 3.98Å; F310-K315 HydrophobicContact CE1-CD 4.12Å; F313-K315 VanDerWaalsContact C-N 3.25Å; F313-K315 PolarHBondContact O-N 2.99Å; K315-F317 PolarHBondContact O-N 3.17Å
316P53.8Low64.3Low99 Ų9982.6 Ų82.664%0.64343%0.426SS*.  trans-56.9111.617623.3-32.8000109.8
317F56.7Low64.7Low135 Ų13584.1 Ų84.159%0.59243%0.434SS*.  trans-86.1124.6-178.1-177.1-98000109.8K315 V322K315-F317 PolarHBondContact O-N 3.17Å; F317-V322 HydrophobicContact CE1-CG2 4.02Å; F317-V322 HydrophobicContact CE2-CG2 4.36Å; F317-V322 HydrophobicContact CZ-CG2 3.41Å; F317-V322 VanDerWaalsContact CZ-CG2 3.41Å
318T65.9Low64.7Low40 Ų4080.4 Ų80.425%0.24541%0.412CS..  trans-111.5146.2173.263.80000110.7T188 Q320 Y321T188-T318 HydrophobicContact CG2-CG2 3.94Å; T318-Q320 PolarHBondContact O-N 2.9Å; T318-Q320 VanDerWaalsContact O-N 3.08Å; T318-Y321 WeakPolarHBondContact O-CD2 3.3Å; T318-Y321 PolarHBondContact O-N 3.38Å; T318-Y321 VanDerWaalsContact O-N 3.12Å; T318-Y321 WeakPolarHBondContact OG1-CD2 3.38Å; T318-Y321 WeakPolarHBondContact OG1-CE2 3.3Å
319F71.6Confident65Low159 Ų15981 Ų8170%0.69742%0.419SS*.Hα-helixtrans-59.4-21.8178.2-108.9-88.8000113.4Y321 V322F319-Y321 VanDerWaalsContact C-N 3.26Å; F319-Y321 PolarHBondContact O-N 2.95Å; F319-V322 PolarHBondContact O-N 3.34Å
320Q67.3Low65.7Low91 Ų9184.3 Ų84.343%0.42543%0.434SS..Hα-helixtrans-65-27.1177.6-68175.3-22.300112.8A184 T318 V322 S324A184-Q320 HydrophobicContact CB-CB 3.61Å; T318-Q320 PolarHBondContact O-N 2.9Å; T318-Q320 VanDerWaalsContact O-N 3.08Å; Q320-V322 VanDerWaalsContact C-N 3.33Å; Q320-V322 PolarHBondContact O-N 3.49Å; Q320-S324 WeakPolarHBondContact O-CB 3.44Å; Q320-S324 PolarHBondContact O-N 2.98Å; Q320-S324 PolarHBondContact O-OG 3.42Å
321Y66.9Low66.1Low13 Ų1382.7 Ų82.75%0.05143%0.427CS..Hα-helixtrans-67.5-31.9174.6-68.6-60.9000113.1F181 A184 D185 T188 F310 T318 F319 S324 G325F181-Y321 HydrophobicContact CD1-CD1 4.32Å; F181-Y321 HydrophobicContact CD1-CE1 4.35Å; F181-Y321 AromaticContact CD2-CD1 3.91Å; F181-Y321 HydrophobicContact CD2-CD1 3.91Å; F181-Y321 AromaticContact CE1-CD1 3.93Å; F181-Y321 HydrophobicContact CE1-CD1 3.93Å; F181-Y321 AromaticContact CE1-CE1 3.9Å; F181-Y321 HydrophobicContact CE1-CE1 3.9Å; F181-Y321 AromaticContact CE2-CD1 3.47Å; F181-Y321 HydrophobicContact CE2-CD1 3.47Å; F181-Y321 VanDerWaalsContact CE2-CD1 3.47Å; F181-Y321 HydrophobicContact CE2-CE1 4.28Å; F181-Y321 HydrophobicContact CE2-CG 4.27Å; F181-Y321 HydrophobicContact CG-CD1 4.3Å; F181-Y321 AromaticContact CZ-CD1 3.46Å; F181-Y321 HydrophobicContact CZ-CD1 3.46Å; F181-Y321 VanDerWaalsContact CZ-CD1 3.46Å; F181-Y321 AromaticContact CZ-CE1 3.85Å; F181-Y321 HydrophobicContact CZ-CE1 3.85Å; F181-Y321 HydrophobicContact CZ-CG 4.44Å; A184-Y321 HydrophobicContact CB-CD1 4.17Å; A184-Y321 HydrophobicContact CB-CE1 4.04Å; D185-Y321 VanDerWaalsContact CA-OH 3.26Å; D185-Y321 WeakPolarHBondContact CA-OH 3.27Å; D185-Y321 HydrophobicContact CB-CE1 4.25Å; D185-Y321 PolarHBondContact OD1-OH 3.34Å; T188-Y321 PolarHBondContact OG1-OH 3.37Å; F310-Y321 HydrophobicContact CE1-CE2 4.04Å; F310-Y321 HydrophobicContact CE2-CE1 4.46Å; F310-Y321 HydrophobicContact CZ-CD1 4.44Å; F310-Y321 AromaticContact CZ-CE1 3.91Å; F310-Y321 HydrophobicContact CZ-CE1 3.91Å; F310-Y321 HydrophobicContact CZ-CE2 4.15Å; F310-Y321 AromaticContact CZ-CZ 3.74Å; T318-Y321 WeakPolarHBondContact O-CD2 3.3Å; T318-Y321 PolarHBondContact O-N 3.38Å; T318-Y321 VanDerWaalsContact O-N 3.12Å; T318-Y321 WeakPolarHBondContact OG1-CD2 3.38Å; T318-Y321 WeakPolarHBondContact OG1-CE2 3.3Å; F319-Y321 VanDerWaalsContact C-N 3.26Å; F319-Y321 PolarHBondContact O-N 2.95Å; Y321-S324 VanDerWaalsContact CA-OG 3.32Å; Y321-S324 WeakPolarHBondContact CA-OG 3.13Å; Y321-S324 PolarHBondContact O-OG 2.98Å; Y321-S324 VanDerWaalsContact O-OG 3.07Å; Y321-G325 PolarHBondContact O-N 3.4Å
322V70.3Confident66.3Low70 Ų7078.9 Ų78.942%0.42441%0.408SS..Hα-helixtrans-69.8-47.7180-178.70000110.7F317 F319 Q320 G325 L326F317-V322 HydrophobicContact CE1-CG2 4.02Å; F317-V322 HydrophobicContact CE2-CG2 4.36Å; F317-V322 HydrophobicContact CZ-CG2 3.41Å; F317-V322 VanDerWaalsContact CZ-CG2 3.41Å; F319-V322 PolarHBondContact O-N 3.34Å; Q320-V322 VanDerWaalsContact C-N 3.33Å; Q320-V322 PolarHBondContact O-N 3.49Å; V322-G325 PolarHBondContact O-N 3.33Å; V322-L326 WeakPolarHBondContact O-CB 3.4Å; V322-L326 PolarHBondContact O-N 2.85Å
323W75.3Confident67Low178 Ų17878.1 Ų78.167%0.67441%0.405SS*.Hα-helixtrans-63.4-43.1179.1-73.9105.3000112.3L326 L327W323-L326 PolarHBondContact O-N 3.26Å; W323-L327 PolarHBondContact O-N 2.97Å; W323-L327 VanDerWaalsContact O-N 3.1Å
324S67.8Low67.8Low1 Ų176.3 Ų76.31%0.00740%0.399CS..Hα-helixtrans-67.7-40.2176.952.60000112.3F181 Q320 Y321 L327 V328F181-S324 VanDerWaalsContact CD2-OG 3.25Å; F181-S324 WeakPolarHBondContact CD2-OG 3.49Å; Q320-S324 WeakPolarHBondContact O-CB 3.44Å; Q320-S324 PolarHBondContact O-N 2.98Å; Q320-S324 PolarHBondContact O-OG 3.42Å; Y321-S324 VanDerWaalsContact CA-OG 3.32Å; Y321-S324 WeakPolarHBondContact CA-OG 3.13Å; Y321-S324 PolarHBondContact O-OG 2.98Å; Y321-S324 VanDerWaalsContact O-OG 3.07Å; S324-L327 PolarHBondContact O-N 3.3Å; S324-V328 WeakPolarHBondContact O-CG2 3.29Å; S324-V328 PolarHBondContact O-N 3.5Å
325G67.7Low68.7Low24 Ų2471.1 Ų71.125%0.24736%0.356CS..Hα-helixtrans-60-44.9172.900000113Y321 V322 L327 V328 V329Y321-G325 PolarHBondContact O-N 3.4Å; V322-G325 PolarHBondContact O-N 3.33Å; G325-L327 VanDerWaalsContact C-N 3.3Å; G325-L327 PolarHBondContact O-N 3.42Å; G325-V328 PolarHBondContact O-N 3.42Å; G325-V329 WeakPolarHBondContact O-CG2 3.48Å; G325-V329 PolarHBondContact O-N 3.2Å
326L74.1Confident69.1Low109 Ų10970.2 Ų70.257%0.57136%0.357SS*.Hα-helixtrans-61.6-38.8176.9-167.9127.2000111.8V322 W323 V329 L330V322-L326 WeakPolarHBondContact O-CB 3.4Å; V322-L326 PolarHBondContact O-N 2.85Å; W323-L326 PolarHBondContact O-N 3.26Å; L326-V329 PolarHBondContact O-N 2.91Å; L326-L330 WeakPolarHBondContact O-CB 3.34Å; L326-L330 PolarHBondContact O-N 2.94Å
327L75.3Confident69.9Low48 Ų4871.8 Ų71.825%0.25135%0.351SS..Hα-helixtrans-68.6-35.4177.9-155.1136.8000112.5C173 L176 W323 S324 G325 L330 G331C173-L327 WeakPolarHBondContact O-CD2 3.45Å; L176-L327 HydrophobicContact CB-CD2 4.25Å; W323-L327 PolarHBondContact O-N 2.97Å; W323-L327 VanDerWaalsContact O-N 3.1Å; S324-L327 PolarHBondContact O-N 3.3Å; G325-L327 VanDerWaalsContact C-N 3.3Å; G325-L327 PolarHBondContact O-N 3.42Å; L327-L330 PolarHBondContact O-N 2.78Å; L327-G331 PolarHBondContact O-N 2.89Å
328V68.4Low70.4Confident6 Ų665.5 Ų65.54%0.03632%0.324CS..Hα-helixtrans-65.8-44.8172.1173.80000111.3L178 A303 S324 G325 L330 G331 I332L178-V328 HydrophobicContact CD2-CG2 3.96Å; L178-V328 HydrophobicContact CG-CG2 4Å; A303-V328 HydrophobicContact CB-CG1 4.26Å; S324-V328 WeakPolarHBondContact O-CG2 3.29Å; S324-V328 PolarHBondContact O-N 3.5Å; G325-V328 PolarHBondContact O-N 3.42Å; V328-L330 VanDerWaalsContact C-N 3.32Å; V328-L330 PolarHBondContact O-N 3.15Å; V328-G331 PolarHBondContact O-N 2.91Å; V328-I332 HydrophobicContact CG1-CD1 4.05Å; V328-I332 WeakPolarHBondContact O-CG1 3.35Å; V328-I332 PolarHBondContact O-N 2.89Å
329V69.9Low70.1Confident98 Ų9866.1 Ų66.159%0.59432%0.323SS*.Hα-helixtrans-61-43.7176.6173.20000110.7G325 L326 G331 I332 F333G325-V329 WeakPolarHBondContact O-CG2 3.48Å; G325-V329 PolarHBondContact O-N 3.2Å; L326-V329 PolarHBondContact O-N 2.91Å; V329-G331 VanDerWaalsContact C-N 3.35Å; V329-G331 PolarHBondContact O-N 2.94Å; V329-I332 PolarHBondContact O-N 3.2Å; V329-F333 WeakPolarHBondContact O-CB 3.48Å; V329-F333 PolarHBondContact O-N 2.77Å
330L76.6Confident69.8Low90 Ų9062.4 Ų62.447%0.47131%0.311SS..Hα-helixtrans-59.5-44.7174.8-169.7109.6000111.5L326 L327 V328 I332 F333 L334L326-L330 WeakPolarHBondContact O-CB 3.34Å; L326-L330 PolarHBondContact O-N 2.94Å; L327-L330 PolarHBondContact O-N 2.78Å; V328-L330 VanDerWaalsContact C-N 3.32Å; V328-L330 PolarHBondContact O-N 3.15Å; L330-I332 PolarHBondContact O-N 3.47Å; L330-F333 WeakPolarHBondContact O-CB 3.44Å; L330-F333 PolarHBondContact O-N 3.41Å; L330-L334 HydrophobicContact CD2-CD1 3.71Å; L330-L334 HydrophobicContact CG-CD1 4.07Å; L330-L334 WeakPolarHBondContact O-CB 3.44Å; L330-L334 PolarHBondContact O-N 2.98Å
331G72.5Confident69.2Low0 Ų062.3 Ų62.30%031%0.312CS..Hα-helixtrans-60.4-44.5176.100000112.7M174 L327 V328 V329 F333 L334 N335M174-G331 VanDerWaalsContact CE-O 3.31Å; M174-G331 WeakPolarHBondContact CE-O 3.08Å; M174-G331 VanDerWaalsContact CG-C 3.43Å; L327-G331 PolarHBondContact O-N 2.89Å; V328-G331 PolarHBondContact O-N 2.91Å; V329-G331 VanDerWaalsContact C-N 3.35Å; V329-G331 PolarHBondContact O-N 2.94Å; G331-F333 VanDerWaalsContact C-N 3.35Å; G331-F333 PolarHBondContact O-N 3.3Å; G331-L334 WeakPolarHBondContact O-CB 3.44Å; G331-L334 PolarHBondContact O-N 3.4Å; G331-N335 PolarHBondContact O-N 3.47Å
332I69.4Low68.5Low43 Ų4365.2 Ų65.222%0.22133%0.328CS..Hα-helixtrans-60.2-46.1175.2-66166.5000110.5M174 V328 V329 L330 L334 N335 V336M174-I332 HydrophobicContact CE-CG1 4.33Å; M174-I332 HydrophobicContact CG-CG1 4.4Å; M174-I332 HydrophobicContact SD-CG1 3.68Å; V328-I332 HydrophobicContact CG1-CD1 4.05Å; V328-I332 WeakPolarHBondContact O-CG1 3.35Å; V328-I332 PolarHBondContact O-N 2.89Å; V329-I332 PolarHBondContact O-N 3.2Å; L330-I332 PolarHBondContact O-N 3.47Å; I332-L334 PolarHBondContact O-N 2.71Å; I332-N335 PolarHBondContact O-N 3.34Å; I332-V336 WeakPolarHBondContact O-CG2 3.32Å; I332-V336 PolarHBondContact O-N 3.45Å
333F73.5Confident67.4Low141 Ų14169.8 Ų69.862%0.61834%0.342SS*.Hα-helixtrans-59.9-45.4177.2-174.7-96.6000111.6V329 L330 G331 N335 V336 Y337V329-F333 WeakPolarHBondContact O-CB 3.48Å; V329-F333 PolarHBondContact O-N 2.77Å; L330-F333 WeakPolarHBondContact O-CB 3.44Å; L330-F333 PolarHBondContact O-N 3.41Å; G331-F333 VanDerWaalsContact C-N 3.35Å; G331-F333 PolarHBondContact O-N 3.3Å; F333-N335 PolarHBondContact O-N 3.47Å; F333-V336 PolarHBondContact O-N 2.95Å; F333-Y337 VanDerWaalsContact O-CB 3.24Å; F333-Y337 WeakPolarHBondContact O-CB 3.3Å; F333-Y337 PolarHBondContact O-N 3.16Å
334L73.3Confident65.8Low63 Ų6367 Ų6733%0.3334%0.339SS..Hα-helixtrans-58.6-41.4175.2-89.9151.5000112.7A170 L330 G331 I332 Y337 S338A170-L334 HydrophobicContact CB-CB 3.84Å; L330-L334 HydrophobicContact CD2-CD1 3.71Å; L330-L334 HydrophobicContact CG-CD1 4.07Å; L330-L334 WeakPolarHBondContact O-CB 3.44Å; L330-L334 PolarHBondContact O-N 2.98Å; G331-L334 WeakPolarHBondContact O-CB 3.44Å; G331-L334 PolarHBondContact O-N 3.4Å; I332-L334 PolarHBondContact O-N 2.71Å; L334-Y337 PolarHBondContact O-N 2.83Å; L334-S338 VanDerWaalsContact O-CB 3.24Å; L334-S338 WeakPolarHBondContact O-CB 3.28Å; L334-S338 PolarHBondContact O-N 3.49Å
335N69.3Low64.4Low2 Ų277.9 Ų77.91%0.01138%0.38CS..Hα-helixtrans-68.3-42.4178.7-172.2-21.5000111.5A170 M174 T296 G331 I332 F333 Y337 K339A170-N335 HydrophobicContact CB-CB 3.77Å; M174-N335 HydrophobicContact CE-CB 3.35Å; M174-N335 VanDerWaalsContact CE-ND2 3.26Å; M174-N335 WeakPolarHBondContact CE-ND2 3.45Å; T296-N335 PolarHBondContact OG1-ND2 3.22Å; G331-N335 PolarHBondContact O-N 3.47Å; I332-N335 PolarHBondContact O-N 3.34Å; F333-N335 PolarHBondContact O-N 3.47Å; N335-Y337 VanDerWaalsContact C-N 3.34Å; N335-K339 WeakPolarHBondContact O-CG 3.42Å; N335-K339 PolarHBondContact O-N 3.41Å; N335-K339 VanDerWaalsContact O-N 3.15Å; N335-K339 WeakPolarHBondContact OD1-CD 3.48Å; N335-K339 WeakPolarHBondContact OD1-CE 3.3Å
336V66.6Low63.2Low65 Ų6583.2 Ų83.239%0.39440%0.402SS..Hα-helixtrans-64.1-41.9174.8174.60000110.8I332 F333 K339 N340I332-V336 WeakPolarHBondContact O-CG2 3.32Å; I332-V336 PolarHBondContact O-N 3.45Å; F333-V336 PolarHBondContact O-N 2.95Å; V336-K339 PolarHBondContact O-N 2.68Å; V336-N340 PolarHBondContact O-N 3.38Å; V336-N340 VanDerWaalsContact O-N 3.14Å; V336-N340 PolarHBondContact O-ND2 3.32Å
337Y69.3Low61.6Low131 Ų13181.6 Ų81.651%0.51440%0.398SS..Hα-helixtrans-65.3-46.7177.9-175.4-102.3000112.1F333 L334 N335 K339 N340 M341F333-Y337 VanDerWaalsContact O-CB 3.24Å; F333-Y337 WeakPolarHBondContact O-CB 3.3Å; F333-Y337 PolarHBondContact O-N 3.16Å; L334-Y337 PolarHBondContact O-N 2.83Å; N335-Y337 VanDerWaalsContact C-N 3.34Å; Y337-K339 VanDerWaalsContact C-N 3.28Å; Y337-K339 PolarHBondContact O-N 3.46Å; Y337-N340 CarbonylContact O-C 3.02Å; Y337-N340 PolarHBondContact O-N 3.31Å; Y337-M341 HydrophobicContact CD1-CG 4.5Å; Y337-M341 HydrophobicContact CD1-SD 3.92Å; Y337-M341 HydrophobicContact CE1-CG 4Å; Y337-M341 HydrophobicContact CE1-SD 3.25Å; Y337-M341 WeakPolarHBondContact CE1-SD 3.11Å; Y337-M341 PolarHBondContact O-N 2.97Å
338S66.8Low60.1Low3 Ų381.9 Ų81.92%0.02140%0.404CS..Hα-helixtrans-52.8-46175.1176.80000111.7A166 D167 L334 N340 M341 D342A166-S338 WeakPolarHBondContact CB-OG 3.46Å; D167-S338 PolarHBondContact N-OG 3.35Å; D167-S338 WeakPolarHBondContact OD1-CB 3.23Å; D167-S338 PolarHBondContact OD1-OG 2.67Å; L334-S338 VanDerWaalsContact O-CB 3.24Å; L334-S338 WeakPolarHBondContact O-CB 3.28Å; L334-S338 PolarHBondContact O-N 3.49Å; S338-N340 VanDerWaalsContact C-N 3.34Å; S338-N340 PolarHBondContact O-N 3.05Å; S338-M341 WeakPolarHBondContact O-CB 3.19Å; S338-M341 PolarHBondContact O-N 2.98Å; S338-M341 VanDerWaalsContact O-N 3.15Å; S338-D342 PolarHBondContact O-N 2.91Å
339K61.4Low59.3Low53 Ų5388.1 Ų88.123%0.2344%0.437CS..Hα-helixtrans-69.1-29.6179-74.9173.5172.3-650114.3I293 N335 V336 Y337I293-K339 HydrophobicContact CD1-CD 3.7Å; I293-K339 HydrophobicContact CG1-CD 3.6Å; N335-K339 WeakPolarHBondContact O-CG 3.42Å; N335-K339 PolarHBondContact O-N 3.41Å; N335-K339 VanDerWaalsContact O-N 3.15Å; N335-K339 WeakPolarHBondContact OD1-CD 3.48Å; N335-K339 WeakPolarHBondContact OD1-CE 3.3Å; V336-K339 PolarHBondContact O-N 2.68Å; Y337-K339 VanDerWaalsContact C-N 3.28Å; Y337-K339 PolarHBondContact O-N 3.46Å
340N63.6Low58.6Low82 Ų8291.9 Ų91.944%0.43944%0.441SS..Hα-helixtrans-76.7-32.5171.9-76.5-27000111.5V336 Y337 S338 K343 I344V336-N340 PolarHBondContact O-N 3.38Å; V336-N340 VanDerWaalsContact O-N 3.14Å; V336-N340 PolarHBondContact O-ND2 3.32Å; Y337-N340 CarbonylContact O-C 3.02Å; Y337-N340 PolarHBondContact O-N 3.31Å; S338-N340 VanDerWaalsContact C-N 3.34Å; S338-N340 PolarHBondContact O-N 3.05Å; N340-K343 PolarHBondContact O-N 2.92Å; N340-I344 PolarHBondContact O-N 2.96Å
341M55.7Low57.6Low89 Ų8992.2 Ų92.244%0.43844%0.444SS..Hα-helixtrans-65.5-36.6171.3-97.4179.677.900112.7Y337 S338 K343 I344Y337-M341 HydrophobicContact CD1-CG 4.5Å; Y337-M341 HydrophobicContact CD1-SD 3.92Å; Y337-M341 HydrophobicContact CE1-CG 4Å; Y337-M341 HydrophobicContact CE1-SD 3.25Å; Y337-M341 WeakPolarHBondContact CE1-SD 3.11Å; Y337-M341 PolarHBondContact O-N 2.97Å; S338-M341 WeakPolarHBondContact O-CB 3.19Å; S338-M341 PolarHBondContact O-N 2.98Å; S338-M341 VanDerWaalsContact O-N 3.15Å; M341-K343 PolarHBondContact O-N 3.39Å; M341-I344 CarbonylContact O-C 3.59Å; M341-I344 WeakPolarHBondContact O-CA 3.41Å; M341-I344 PolarHBondContact O-N 3.48Å
342D52Low56.8Low74 Ų7496.6 Ų96.640%0.39647%0.467SS..THydrogen-bonded Turntrans-64-22.1175.7-80-21.3000113.1N164 S338N164-D342 PolarHBondContact ND2-OD1 3.37Å; S338-D342 PolarHBondContact O-N 2.91Å
343K47.5Very low56.6Low165 Ų16599.2 Ų99.272%0.71748%0.48SS*.THydrogen-bonded Turntrans-81.9-23.9169.7-87-177.2178.8177.20113.4N340 M341N340-K343 PolarHBondContact O-N 2.92Å; M341-K343 PolarHBondContact O-N 3.39Å
344I41.8Very low56.1Low119 Ų11996.6 Ų96.661%0.6147%0.473SS*.SBendtrans-101.167.9172.5-52.5171.2000106.3N340 M341 L346N340-I344 PolarHBondContact O-N 2.96Å; M341-I344 CarbonylContact O-C 3.59Å; M341-I344 WeakPolarHBondContact O-CA 3.41Å; M341-I344 PolarHBondContact O-N 3.48Å; I344-L346 PolarHBondContact O-N 3.43Å
345R37.4Very low55.5Low230 Ų230101.3 Ų101.387%0.86849%0.49SS*.  trans-60.995.1164.2-88.6-167.4-178.2-176.81.2107.5
346L42.7Very low55Low136 Ų136104.5 Ų104.571%0.71251%0.513SS*.PPolyproline II helixtrans-52.3132.6148-91.3132000106.6I344 S348I344-L346 PolarHBondContact O-N 3.43Å; L346-S348 PolarHBondContact O-N 3.49Å
347P39.7Very low55Low76 Ų76105.3 Ų105.349%0.49452%0.518SS..PPolyproline II helixtrans-52.8134.6175.122.4-30.9000107.8L349 L352P347-L349 PolarHBondContact O-N 3.35Å; P347-L352 HydrophobicContact CB-CD1 4.45Å; P347-L352 HydrophobicContact CG-CD1 3.83Å; P347-L352 HydrophobicContact CG-CG 4.4Å
348S44.1Very low54.7Low54 Ų54105.3 Ų105.338%0.37852%0.522SS..PPolyproline II helixtrans-52.9138.5-179.380.30000108.3L346 Y350 D351 L352L346-S348 PolarHBondContact O-N 3.49Å; S348-Y350 PolarHBondContact O-N 3.39Å; S348-D351 WeakPolarHBondContact O-CA 3.25Å; S348-D351 WeakPolarHBondContact O-CB 3.28Å; S348-D351 PolarHBondContact O-N 3.03Å; S348-D351 VanDerWaalsContact OG-CG 3.26Å; S348-D351 PolarHBondContact OG-N 3.39Å; S348-D351 PolarHBondContact OG-OD2 2.83Å; S348-L352 PolarHBondContact O-N 2.82Å
349L51.3Low54.5Low136 Ų136107.8 Ų107.871%0.71254%0.543SS*.Hα-helixtrans-53.6-27175.4-81.9166.6000110.9P347 L352 I353P347-L349 PolarHBondContact O-N 3.35Å; L349-L352 PolarHBondContact O-N 3.27Å; L349-I353 WeakPolarHBondContact O-CB 3.18Å; L349-I353 WeakPolarHBondContact O-CD1 3.3Å; L349-I353 WeakPolarHBondContact O-CG1 3.3Å; L349-I353 PolarHBondContact O-N 3Å
350Y55.6Low54.5Low178 Ų178114.8 Ų114.870%0.69857%0.568SS**Hα-helixtrans-65.4-41.4173.1-143.1-93.8000113.3S348 N354S348-Y350 PolarHBondContact O-N 3.39Å; Y350-N354 WeakPolarHBondContact O-CB 3.35Å; Y350-N354 PolarHBondContact O-N 3.39Å
351D55.8Low54.3Low97 Ų97117.7 Ų117.752%0.51958%0.577SS.*Hα-helixtrans-69.5-35.6174.1-71.1-48.2000112.1S348 K355S348-D351 WeakPolarHBondContact O-CA 3.25Å; S348-D351 WeakPolarHBondContact O-CB 3.28Å; S348-D351 PolarHBondContact O-N 3.03Å; S348-D351 VanDerWaalsContact OG-CG 3.26Å; S348-D351 PolarHBondContact OG-N 3.39Å; S348-D351 PolarHBondContact OG-OD2 2.83Å; D351-K355 WeakPolarHBondContact O-CB 3.05Å; D351-K355 PolarHBondContact O-N 3.21Å
352L56.9Low54.4Low92 Ų92117.1 Ų117.148%0.48258%0.582SS.*Hα-helixtrans-67.6-42.3174.9-103.1153.4000111.7P347 S348 L349 K355 S356P347-L352 HydrophobicContact CB-CD1 4.45Å; P347-L352 HydrophobicContact CG-CD1 3.83Å; P347-L352 HydrophobicContact CG-CG 4.4Å; S348-L352 PolarHBondContact O-N 2.82Å; L349-L352 PolarHBondContact O-N 3.27Å; L352-K355 PolarHBondContact O-N 3.46Å; L352-S356 WeakPolarHBondContact O-CB 3.43Å; L352-S356 PolarHBondContact O-N 3.02Å
353I65Low54.6Low97 Ų97123.1 Ų123.150%0.49760%0.599SS.*Hα-helixtrans-65.1-48175.4-69.7164.4000109.8L349 K355 S356 V357L349-I353 WeakPolarHBondContact O-CB 3.18Å; L349-I353 WeakPolarHBondContact O-CD1 3.3Å; L349-I353 WeakPolarHBondContact O-CG1 3.3Å; L349-I353 PolarHBondContact O-N 3Å; I353-K355 PolarHBondContact O-N 3.07Å; I353-S356 PolarHBondContact O-N 2.98Å; I353-S356 VanDerWaalsContact O-N 3.15Å; I353-S356 PolarHBondContact O-OG 2.96Å; I353-V357 HydrophobicContact CG2-CG2 4.33Å; I353-V357 VanDerWaalsContact O-CG2 3.31Å; I353-V357 WeakPolarHBondContact O-CG2 3.18Å; I353-V357 PolarHBondContact O-N 3.32Å
354N61.5Low55Low87 Ų87119.2 Ų119.247%0.46559%0.589SS.*Hα-helixtrans-61.1-42.7177-101.33.7000112.3Y350 S356 V357 E358Y350-N354 WeakPolarHBondContact O-CB 3.35Å; Y350-N354 PolarHBondContact O-N 3.39Å; N354-S356 VanDerWaalsContact C-N 3.28Å; N354-S356 PolarHBondContact O-N 3.45Å; N354-V357 PolarHBondContact O-N 3.36Å; N354-E358 VanDerWaalsContact O-CB 3.24Å; N354-E358 WeakPolarHBondContact O-CB 3.46Å; N354-E358 PolarHBondContact O-N 2.89Å
355K61.6Low55.6Low161 Ų161118.9 Ų118.970%0.759%0.587SS**Hα-helixtrans-64.9-33.2177.2-157.6174.6-170.3-179.30112.1D351 L352 I353 A359D351-K355 WeakPolarHBondContact O-CB 3.05Å; D351-K355 PolarHBondContact O-N 3.21Å; L352-K355 PolarHBondContact O-N 3.46Å; I353-K355 PolarHBondContact O-N 3.07Å; K355-A359 WeakPolarHBondContact O-CB 3.5Å; K355-A359 PolarHBondContact O-N 2.9Å
356S58.9Low56.4Low69 Ų69111.5 Ų111.548%0.48358%0.576SS.*Hα-helixtrans-71-38.8173.179.20000112.9L352 I353 N354 R360L352-S356 WeakPolarHBondContact O-CB 3.43Å; L352-S356 PolarHBondContact O-N 3.02Å; I353-S356 PolarHBondContact O-N 2.98Å; I353-S356 VanDerWaalsContact O-N 3.15Å; I353-S356 PolarHBondContact O-OG 2.96Å; N354-S356 VanDerWaalsContact C-N 3.28Å; N354-S356 PolarHBondContact O-N 3.45Å; S356-R360 WeakPolarHBondContact O-CB 3.49Å; S356-R360 PolarHBondContact O-N 3.45Å
357V65.8Low56.9Low82 Ų82112.9 Ų112.950%0.49758%0.579SS.*Hα-helixtrans-68.6-41.6177.5169.40000110.4I353 N354 R360 K361I353-V357 HydrophobicContact CG2-CG2 4.33Å; I353-V357 VanDerWaalsContact O-CG2 3.31Å; I353-V357 WeakPolarHBondContact O-CG2 3.18Å; I353-V357 PolarHBondContact O-N 3.32Å; N354-V357 PolarHBondContact O-N 3.36Å; V357-R360 PolarHBondContact O-N 3.37Å; V357-K361 WeakPolarHBondContact O-CB 3.46Å; V357-K361 PolarHBondContact O-N 3.02Å
358E63.3Low57.4Low132 Ų132114.5 Ų114.562%0.61759%0.587SS**Hα-helixtrans-69.6-39.5178.1-156.8161.8-148.200111.4N354 R360 K361 S362N354-E358 VanDerWaalsContact O-CB 3.24Å; N354-E358 WeakPolarHBondContact O-CB 3.46Å; N354-E358 PolarHBondContact O-N 2.89Å; E358-R360 VanDerWaalsContact C-N 3.32Å; E358-R360 PolarHBondContact O-N 3.14Å; E358-K361 PolarHBondContact O-N 3.11Å; E358-S362 PolarHBondContact O-N 3.35Å; E358-S362 PolarHBondContact O-OG 3.45Å; E358-S362 VanDerWaalsContact O-OG 3.08Å
359A62.4Low57.3Low55 Ų55121 Ų12146%0.45563%0.625SS.*Hα-helixtrans-63.5-35170.500000113K355 R363K355-A359 WeakPolarHBondContact O-CB 3.5Å; K355-A359 PolarHBondContact O-N 2.9Å; A359-R363 PolarHBondContact O-N 2.87Å
360R61.3Low57.6Low200 Ų200120.3 Ų120.376%0.75562%0.62SS**Hα-helixtrans-69.4-40.4175.6-142175-163.8-179.33.5111.4S356 V357 E358 R363 T364S356-R360 WeakPolarHBondContact O-CB 3.49Å; S356-R360 PolarHBondContact O-N 3.45Å; V357-R360 PolarHBondContact O-N 3.37Å; E358-R360 VanDerWaalsContact C-N 3.32Å; E358-R360 PolarHBondContact O-N 3.14Å; R360-R363 PolarHBondContact O-N 2.9Å; R360-T364 PolarHBondContact O-N 3.39Å; R360-T364 PolarHBondContact O-OG1 3.47Å
361K60.3Low57.8Low143 Ų143117.3 Ų117.362%0.62262%0.616SS**Hα-helixtrans-66-38.9177.5-164.2176.3-177.4-177.60112.6V357 E358 T364 L365V357-K361 WeakPolarHBondContact O-CB 3.46Å; V357-K361 PolarHBondContact O-N 3.02Å; E358-K361 PolarHBondContact O-N 3.11Å; K361-T364 WeakPolarHBondContact CA-OG1 3.21Å; K361-T364 PolarHBondContact O-N 3.25Å; K361-T364 PolarHBondContact O-OG1 3.45Å; K361-L365 PolarHBondContact O-N 3.31Å
362S56.6Low57.9Low77 Ų77118.4 Ų118.454%0.53862%0.621SS.*Hα-helixtrans-68-35.4175.6-60.10000112.9E358 A366E358-S362 PolarHBondContact O-N 3.35Å; E358-S362 PolarHBondContact O-OG 3.45Å; E358-S362 VanDerWaalsContact O-OG 3.08Å; S362-A366 PolarHBondContact O-N 2.85Å
363R57.4Low57.9Low200 Ų200119.9 Ų119.976%0.75563%0.63SS**Hα-helixtrans-68.5-36.7175.1-80.7-177176.1178.6-0.8113A359 R360 A366A359-R363 PolarHBondContact O-N 2.87Å; R360-R363 PolarHBondContact O-N 2.9Å; R363-A366 PolarHBondContact O-N 3.4Å
364T56.2Low57.5Low83 Ų83121.4 Ų121.451%0.50964%0.638SS.*Hα-helixtrans-69.5-32.1176.539.20000113.3R360 K361 T368R360-T364 PolarHBondContact O-N 3.39Å; R360-T364 PolarHBondContact O-OG1 3.47Å; K361-T364 WeakPolarHBondContact CA-OG1 3.21Å; K361-T364 PolarHBondContact O-N 3.25Å; K361-T364 PolarHBondContact O-OG1 3.45Å; T364-T368 PolarHBondContact O-OG1 3.47Å
365L54.3Low57.2Low111 Ų111123.7 Ų123.758%0.58165%0.649SS**Hα-helixtrans-74.8-26.9176.8-79.4165.4000113.2K361 Q367 T368K361-L365 PolarHBondContact O-N 3.31Å; L365-Q367 VanDerWaalsContact C-N 3.31Å; L365-T368 PolarHBondContact O-OG1 3.02Å; L365-T368 VanDerWaalsContact O-OG1 3.13Å
366A53.3Low56.9Low76 Ų76121 Ų12163%0.62865%0.646SS**THydrogen-bonded Turntrans-79-10177.100000114S362 R363S362-A366 PolarHBondContact O-N 2.85Å; R363-A366 PolarHBondContact O-N 3.4Å
367Q53Low56.7Low165 Ų165125 Ų12577%0.77166%0.658SS**THydrogen-bonded Turntrans-981.5175.9-74.3-176-48.600113.3L365L365-Q367 VanDerWaalsContact C-N 3.31Å
368T51.2Low56Low110 Ų110128.6 Ų128.668%0.67567%0.672SS**  trans-115.320.2-179.144.30000113.7T364 L365T364-T368 PolarHBondContact O-OG1 3.47Å; L365-T368 PolarHBondContact O-OG1 3.02Å; L365-T368 VanDerWaalsContact O-OG1 3.13Å
369V42.4Very low55.3Low191 Ų191128.3 Ų128.3100%1.15868%0.677SS**  trans-124.30166.2-1740000106.8

Retrieved 369 of 369 residues in 246.6 ms (Link to these results)