A0A5K4FEN9_SCHMA Loading...

Mitochondrial inner membrane protein OXA1L

AlphaFold DB , UniProt , Accession A0A5K4FEN9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 390 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
1M46.1Very low48.9Very low213 Ų213132.5 Ų132.5100%1.04963%0.63SS**  0-37.60-87.2176.2169.800113.9R3 L4M1-R3 VanDerWaalsContact C-N 3.34Å; M1-R3 PolarHBondContact O-N 2.85Å; M1-L4 PolarHBondContact O-N 3.06Å
2I44.6Very low49.1Very low151 Ų151128.1 Ų128.177%0.77462%0.623SS**Hα-helixtrans-65.6-27.3-177.3-61.9167.3000114.1
3R51.2Low49.4Very low223 Ų223125.8 Ų125.884%0.84261%0.611SS**Hα-helixtrans-82.1-23.6177.5-78.2-174.7176.1-176.8-1.6115.5M1M1-R3 VanDerWaalsContact C-N 3.34Å; M1-R3 PolarHBondContact O-N 2.85Å
4L42.6Very low49.7Very low124 Ų124120.1 Ų120.165%0.64959%0.588SS**Hα-helixtrans-77.4-28.8176.1-88.4145.7000112.1M1 R6 I7 T8M1-L4 PolarHBondContact O-N 3.06Å; L4-R6 VanDerWaalsContact C-N 3.33Å; L4-R6 PolarHBondContact O-N 3.31Å; L4-I7 PolarHBondContact O-N 3.04Å; L4-T8 PolarHBondContact O-N 3.11Å; L4-T8 PolarHBondContact O-OG1 3.42Å
5S44.8Very low49.8Very low73 Ų73118.5 Ų118.551%0.5159%0.587SS.*Hα-helixtrans-63.2-34.7175.41680000113I7 T8 K9S5-I7 VanDerWaalsContact C-N 3.35Å; S5-I7 PolarHBondContact O-N 2.54Å; S5-T8 WeakPolarHBondContact CA-OG1 3.32Å; S5-T8 PolarHBondContact O-N 3.03Å; S5-T8 PolarHBondContact O-OG1 3.37Å; S5-K9 WeakPolarHBondContact O-CB 3.14Å; S5-K9 PolarHBondContact O-N 3.45Å
6R50.6Low49.7Very low192 Ų192118.6 Ų118.673%0.72559%0.589SS**Hα-helixtrans-64.2-38.9174.9-76.7-169-173.6-172.60.8112.1L4 K9 I10L4-R6 VanDerWaalsContact C-N 3.33Å; L4-R6 PolarHBondContact O-N 3.31Å; R6-K9 PolarHBondContact O-N 3.18Å; R6-I10 WeakPolarHBondContact O-CD1 3.4Å; R6-I10 VanDerWaalsContact O-CG1 3.23Å; R6-I10 WeakPolarHBondContact O-CG1 3.39Å; R6-I10 PolarHBondContact O-N 3.08Å
7I51.5Low49.8Very low77 Ų77118.8 Ų118.840%0.39559%0.592SS.*Hα-helixtrans-67.7-41.3-179.1-59.8173.6000110.9L4 S5 F11L4-I7 PolarHBondContact O-N 3.04Å; S5-I7 VanDerWaalsContact C-N 3.35Å; S5-I7 PolarHBondContact O-N 2.54Å; I7-F11 PolarHBondContact O-N 3.31Å; I7-F11 VanDerWaalsContact O-N 3.13Å
8T49.2Very low49.5Very low91 Ų91115.8 Ų115.856%0.55858%0.576SS**Hα-helixtrans-67.8-34.7174.643.20000112.7L4 S5 F11 S12L4-T8 PolarHBondContact O-N 3.11Å; L4-T8 PolarHBondContact O-OG1 3.42Å; S5-T8 WeakPolarHBondContact CA-OG1 3.32Å; S5-T8 PolarHBondContact O-N 3.03Å; S5-T8 PolarHBondContact O-OG1 3.37Å; T8-F11 PolarHBondContact O-N 3.24Å; T8-S12 PolarHBondContact O-N 2.8Å; T8-S12 VanDerWaalsContact O-N 3.12Å
9K50.2Low49.2Very low130 Ų130118.9 Ų118.957%0.56559%0.586SS**Hα-helixtrans-68.3-40.8178.3-161.7179.7179.7-169.30111.6S5 R6 S12 E13S5-K9 WeakPolarHBondContact O-CB 3.14Å; S5-K9 PolarHBondContact O-N 3.45Å; R6-K9 PolarHBondContact O-N 3.18Å; K9-S12 PolarHBondContact O-N 2.75Å; K9-E13 WeakPolarHBondContact CE-OE1 3.42Å; K9-E13 PolarHBondContact O-N 2.82Å
10I58.7Low48.8Very low73 Ų73118.9 Ų118.937%0.37459%0.592SS.*Hα-helixtrans-61.3-44.8173.7-66.3162.2000110.3R6 S12 E13 T14 T84R6-I10 WeakPolarHBondContact O-CD1 3.4Å; R6-I10 VanDerWaalsContact O-CG1 3.23Å; R6-I10 WeakPolarHBondContact O-CG1 3.39Å; R6-I10 PolarHBondContact O-N 3.08Å; I10-S12 VanDerWaalsContact C-N 3.31Å; I10-S12 PolarHBondContact O-N 3.28Å; I10-E13 PolarHBondContact O-N 3.43Å; I10-T14 PolarHBondContact O-N 2.75Å; I10-T14 PolarHBondContact O-OG1 2.91Å; I10-T84 HydrophobicContact CG2-CG2 4.03Å
11F48.5Very low48.5Very low111 Ų111117.8 Ų117.849%0.48760%0.596SS.*Hα-helixtrans-60.7-36.3177.2-115.8-89000113.3I7 T8 V15 L81I7-F11 PolarHBondContact O-N 3.31Å; I7-F11 VanDerWaalsContact O-N 3.13Å; T8-F11 PolarHBondContact O-N 3.24Å; F11-V15 WeakPolarHBondContact O-CG2 3.47Å; F11-V15 PolarHBondContact O-N 3.29Å; F11-L81 HydrophobicContact CE2-CD1 4.19Å
12S51Low48.1Very low79 Ų79112.5 Ų112.555%0.55258%0.58SS**Hα-helixtrans-72.5-37.8174.4-80.80000113.2T8 K9 I10 L16T8-S12 PolarHBondContact O-N 2.8Å; T8-S12 VanDerWaalsContact O-N 3.12Å; K9-S12 PolarHBondContact O-N 2.75Å; I10-S12 VanDerWaalsContact C-N 3.31Å; I10-S12 PolarHBondContact O-N 3.28Å; S12-L16 PolarHBondContact O-N 3.4Å
13E53.5Low48Very low99 Ų99112 Ų11246%0.46358%0.583SS.*Hα-helixtrans-70.5-39.5179.1-76.9172.5-176.200111.7K9 I10 V15 L16 I17K9-E13 WeakPolarHBondContact CE-OE1 3.42Å; K9-E13 PolarHBondContact O-N 2.82Å; I10-E13 PolarHBondContact O-N 3.43Å; E13-V15 PolarHBondContact O-N 2.99Å; E13-L16 PolarHBondContact O-N 3.29Å; E13-I17 WeakPolarHBondContact O-CG1 3.31Å; E13-I17 PolarHBondContact O-N 2.79Å; E13-I17 VanDerWaalsContact O-N 3.14Å
14T53.6Low47.5Very low46 Ų46107.2 Ų107.228%0.28258%0.581SS.*Hα-helixtrans-65-36.7175.7-47.30000112.5I10 L16 Q18I10-T14 PolarHBondContact O-N 2.75Å; I10-T14 PolarHBondContact O-OG1 2.91Å; T14-L16 VanDerWaalsContact C-N 3.35Å; T14-Q18 PolarHBondContact O-N 3.3Å
15V51.5Low47.1Very low95 Ų95107 Ų10758%0.57659%0.59SS**Hα-helixtrans-69.5-32.1176.5170.80000111.9F11 E13F11-V15 WeakPolarHBondContact O-CG2 3.47Å; F11-V15 PolarHBondContact O-N 3.29Å; E13-V15 PolarHBondContact O-N 2.99Å
16L47.4Very low46.6Very low120 Ų120112.1 Ų112.163%0.62861%0.608SS**Hα-helixtrans-74.1-37.1178.8-107.6151.5000112.6S12 E13 T14 Q18 K19S12-L16 PolarHBondContact O-N 3.4Å; E13-L16 PolarHBondContact O-N 3.29Å; T14-L16 VanDerWaalsContact C-N 3.35Å; L16-Q18 VanDerWaalsContact C-N 3.31Å; L16-Q18 PolarHBondContact O-N 2.88Å; L16-K19 WeakPolarHBondContact O-CB 3.38Å; L16-K19 PolarHBondContact O-N 3.41Å; L16-K19 VanDerWaalsContact O-N 3.13Å
17I50.9Low46Very low123 Ų123112.1 Ų112.163%0.63162%0.619SS**Hα-helixtrans-67.5-31.2178.1-65.5165.7000111.5E13 K19 T20E13-I17 WeakPolarHBondContact O-CG1 3.31Å; E13-I17 PolarHBondContact O-N 2.79Å; E13-I17 VanDerWaalsContact O-N 3.14Å; I17-K19 VanDerWaalsContact C-N 3.25Å; I17-K19 PolarHBondContact O-N 3.29Å; I17-T20 PolarHBondContact O-OG1 2.81Å; I17-T20 VanDerWaalsContact O-OG1 3.09Å
18Q44.6Very low45.1Very low64 Ų64119.3 Ų119.330%0.29964%0.641SS.*G310 helixtrans-69.4-19173.4-88.6-161.8-37.900114T14 L16 T20T14-Q18 PolarHBondContact O-N 3.3Å; L16-Q18 VanDerWaalsContact C-N 3.31Å; L16-Q18 PolarHBondContact O-N 2.88Å; Q18-T20 VanDerWaalsContact C-N 3.26Å; Q18-T20 PolarHBondContact O-N 3.07Å
19K44.3Very low44.3Very low176 Ų176123.7 Ų123.777%0.76565%0.652SS**G310 helixtrans-76.9-12.3-178.4-152.9176.6-178.8-175.20113L16 I17L16-K19 WeakPolarHBondContact O-CB 3.38Å; L16-K19 PolarHBondContact O-N 3.41Å; L16-K19 VanDerWaalsContact O-N 3.13Å; I17-K19 VanDerWaalsContact C-N 3.25Å; I17-K19 PolarHBondContact O-N 3.29Å
20T42.1Very low43.5Very low117 Ų117125.8 Ų125.872%0.71867%0.669SS**G310 helixtrans-105.8-5.6-175.351.50000115I17 Q18I17-T20 PolarHBondContact O-OG1 2.81Å; I17-T20 VanDerWaalsContact O-OG1 3.09Å; Q18-T20 VanDerWaalsContact C-N 3.26Å; Q18-T20 PolarHBondContact O-N 3.07Å
21S42.1Very low42.6Very low96 Ų96127.2 Ų127.267%0.67169%0.686SS**  trans-103.657.9178.271.30000112.4
22S37.2Very low42Very low102 Ų102127.4 Ų127.471%0.71370%0.696SS**  trans-90.8107.4176.8580000111.4
23V42.4Very low41.3Very low140 Ų140129.9 Ų129.985%0.84870%0.703SS**  trans-127.3113.8158.7-176.80000108.4
24P40.3Very low40.6Very low123 Ų123131.4 Ų131.480%0.79972%0.719SS**  trans-86.4122.5175.35.911.5000110.9
25S34.8Very low39.8Very low119 Ų119138.6 Ų138.683%0.83274%0.742SS**  trans-89.995.1170.159.10000110.9
26M34.4Very low39.4Very low181 Ų181142.3 Ų142.389%0.89276%0.758SS**  trans-166.4102.6162.4-152.7170.3-175.700112.6
27M37.1Very low38.9Very low193 Ų193142.4 Ų142.495%0.95177%0.769SS**  -178.5118.2128.1-102-167.9-176.800111.1
28R32.8Very low38.7Very low227 Ų227140.8 Ų140.886%0.85777%0.774SS**  trans-103.9138.7172.9-160.6-169.8-71-175.7-2.8107.1
29K33.2Very low38.8Very low183 Ų183143.4 Ų143.480%0.79680%0.797SS**  trans84.2115.4164.6-54.2-173.9176.2-170.90117.4
30L32.3Very low39Very low175 Ų175140.4 Ų140.492%0.91680%0.798SS**  -177.7143.4119.8-99.6142.5000111.7
31S40.6Very low39.3Very low103 Ų103142 Ų14272%0.7280%0.802SS**  trans91.483.1154.4-161.30000120.4
32T35.2Very low39.3Very low115 Ų115143.1 Ų143.171%0.70681%0.808SS**  12131.9123.6-0.40000121.3
33N36.3Very low40.1Very low131 Ų131146 Ų14670%0.70181%0.814SS**  trans58.5118.8143.7-67.6-6.6000120.9
34T39.7Very low40.9Very low131 Ų131146.6 Ų146.680%0.80481%0.811SS**  -170.8121.5115.7-72.80000111.3
35Y37Very low42.2Very low196 Ų196146 Ų14677%0.76981%0.808SS**  trans-19.7131.3167.9-51-91.9000119
36L42.3Very low43.7Very low173 Ų173149 Ų14991%0.90681%0.808SS**  -156.1124.1128.6-121.2112.7000109.3
37S36.7Very low45.3Very low122 Ų122145.5 Ų145.585%0.85380%0.799SS**  trans-62.8125.3-178.6460000112.8
38A48.4Very low46.4Very low89 Ų89142 Ų14274%0.73679%0.791SS**  trans-129.6148.4165.800000110
39P46.2Very low47.5Very low120 Ų120138.7 Ų138.778%0.77979%0.789SS**  trans-72.9147.2-166.26.57.5000112.7D41P39-D41 VanDerWaalsContact C-N 3.28Å; P39-D41 PolarHBondContact O-N 3.1Å
40S47.5Very low48.6Very low112 Ų112135.2 Ų135.278%0.78379%0.786SS**THydrogen-bonded Turntrans-71.217.2-163.2-53.80000118.4
41D48.3Very low49.8Very low151 Ų151131.4 Ų131.481%0.80777%0.772SS**THydrogen-bonded Turntrans-121.621.9-169.3-68.3-36.3000115.6P39P39-D41 VanDerWaalsContact C-N 3.28Å; P39-D41 PolarHBondContact O-N 3.1Å
42C41.7Very low50.6Low119 Ų119133.3 Ų133.380%0.80477%0.774SS**  trans-134.370.4173.1-82.90000111.4L44C42-L44 VanDerWaalsContact C-N 3.28Å; C42-L44 PolarHBondContact O-N 3.27Å
43I55.3Low52Low164 Ų164135.2 Ų135.284%0.84177%0.774SS**  trans-76.189.6161.2-55.7172.5000106.1
44L58.7Low53.9Low151 Ų151133 Ų13379%0.79177%0.766SS**PPolyproline II helixtrans-56.7128.4163.8-84.3162.7000107.3C42 E46C42-L44 VanDerWaalsContact C-N 3.28Å; C42-L44 PolarHBondContact O-N 3.27Å; L44-E46 PolarHBondContact O-N 2.94Å
45P67.9Low55.9Low111 Ų111130.8 Ų130.872%0.72175%0.752SS**PPolyproline II helixtrans-55.9132.9172.323-30.6000108
46E65.6Low58.2Low181 Ų181126.4 Ų126.485%0.84674%0.741SS**PPolyproline II helixtrans-49.6131.2170.3-105.6-177.3155.800107.9L44L44-E46 PolarHBondContact O-N 2.94Å
47P68Low60.2Low108 Ų108119.3 Ų119.370%0.70170%0.704SS**PPolyproline II helixtrans-54.8136.8175.723.4-31.9000108L49P47-L49 PolarHBondContact O-N 3.3Å; P47-L49 VanDerWaalsContact O-N 3.1Å
48P60.6Low62.5Low119 Ų119119.3 Ų119.377%0.77370%0.699SS**PPolyproline II helixtrans-53.8127.1176.822-31000107.8
49L56.9Low64.2Low158 Ų158118.6 Ų118.683%0.82768%0.683SS**  trans-44.6131.4166.1-75.5159.5000106.7P47P47-L49 PolarHBondContact O-N 3.3Å; P47-L49 VanDerWaalsContact O-N 3.1Å
50P56Low65.9Low110 Ų110115.3 Ų115.371%0.71467%0.67SS**  trans-50.7124.3-179.421.3-31.5000106.8N52P50-N52 PolarHBondContact O-N 3.39Å
51P56Low67.7Low96 Ų96112 Ų11262%0.62364%0.642SS**  trans-54141.5175.723.4-30.7000105.9E53P51-E53 PolarHBondContact O-N 3.04Å
52N58.3Low69.5Low143 Ų143106.2 Ų106.277%0.76561%0.613SS**  trans-55.495162.6-73.4-27.6000105.1P50 V54P50-N52 PolarHBondContact O-N 3.39Å; N52-V54 PolarHBondContact O-N 3.5Å
53E65.1Low71.7Confident154 Ų154101.6 Ų101.672%0.7258%0.581SS**  trans-60112.1-176.8-84.3-17317000105P51 V55P51-E53 PolarHBondContact O-N 3.04Å; E53-V55 PolarHBondContact O-N 2.91Å
54V75.1Confident73.3Confident86 Ų8693.9 Ų93.952%0.52154%0.542SS..  trans-70.688.7178.9-1800000106N52 L56 P62N52-V54 PolarHBondContact O-N 3.5Å; V54-L56 HydrophobicContact CG1-CD2 4.21Å; V54-L56 PolarHBondContact O-N 3.31Å; V54-P62 HydrophobicContact CG1-CB 3.53Å
55V81.9Confident74.6Confident84 Ų8489.5 Ų89.551%0.50953%0.527SS..  trans-67.1118.7176.3-1790000107.4E53 T63E53-V55 PolarHBondContact O-N 2.91Å; V55-T63 HydrophobicContact CB-CG2 4.44Å; V55-T63 HydrophobicContact CG1-CG2 4.11Å; V55-T63 WeakPolarHBondContact O-CB 3.31Å; V55-T63 VanDerWaalsContact O-CG2 3.26Å; V55-T63 WeakPolarHBondContact O-CG2 3.43Å; V55-T63 PolarHBondContact O-N 3.42Å; V55-T63 PolarHBondContact O-OG1 2.76Å
56L84.7Confident75.4Confident103 Ų10385.3 Ų85.354%0.53950%0.5SS..BIsolated β-bridgetrans-84.2143.5177.6-59.1177000110.9V54 E61V54-L56 HydrophobicContact CG1-CD2 4.21Å; V54-L56 PolarHBondContact O-N 3.31Å; L56-E61 CarbonylContact C-O 3.49Å; L56-E61 VanDerWaalsContact CA-O 3.28Å; L56-E61 WeakPolarHBondContact CA-O 3.37Å
57N85.9Confident76.2Confident24 Ų2478.6 Ų78.613%0.12847%0.47CS..  trans-81.1179.7170.568.522.9000110.8L59 G60 E61 T63 V87N57-L59 PolarHBondContact O-N 3.37Å; N57-L59 VanDerWaalsContact O-N 3.13Å; N57-L59 WeakPolarHBondContact OD1-CA 3.34Å; N57-L59 WeakPolarHBondContact OD1-CB 3.44Å; N57-L59 PolarHBondContact OD1-N 3.49Å; N57-G60 PolarHBondContact O-N 3.36Å; N57-G60 PolarHBondContact OD1-N 2.87Å; N57-E61 VanDerWaalsContact CG-O 3.23Å; N57-E61 PolarHBondContact N-O 2.87Å; N57-E61 PolarHBondContact OD1-N 3.45Å; N57-E61 PolarHBondContact OD1-O 3.01Å; N57-T63 HydrophobicContact CB-CG2 3.95Å; N57-V87 HydrophobicContact CB-CG1 4.26Å; N57-V87 HydrophobicContact CB-CG2 4.11Å; N57-V87 WeakPolarHBondContact ND2-CG2 3.3Å
58T83.6Confident76.9Confident123 Ų12376.8 Ų76.876%0.75547%0.471SS*.THydrogen-bonded Turntrans-66.4-14-177.957.90000114.1V87T58-V87 WeakPolarHBondContact OG1-CG1 3.31Å
59L84.4Confident78Confident74 Ų7472.1 Ų72.139%0.38744%0.439SS..THydrogen-bonded Turntrans-90.9-0174.8-59.1177.5000112.5N57 E61 V87N57-L59 PolarHBondContact O-N 3.37Å; N57-L59 VanDerWaalsContact O-N 3.13Å; N57-L59 WeakPolarHBondContact OD1-CA 3.34Å; N57-L59 WeakPolarHBondContact OD1-CB 3.44Å; N57-L59 PolarHBondContact OD1-N 3.49Å; L59-E61 VanDerWaalsContact C-N 3.31Å; L59-E61 HydrophobicContact CB-CG 4.37Å; L59-V87 HydrophobicContact CD1-CG2 4.32Å
60G83Confident79.2Confident50 Ų5066.2 Ų66.252%0.51541%0.409SS..SBendtrans78.213.4-176.400000114N57N57-G60 PolarHBondContact O-N 3.36Å; N57-G60 PolarHBondContact OD1-N 2.87Å
61E85.1Confident80.6Confident42 Ų4263.2 Ų63.220%0.19639%0.39CS..SBendtrans-97.3150.7177.4-57.5-175.8177.200110.9L56 N57 L59 T63 H86 S197L56-E61 CarbonylContact C-O 3.49Å; L56-E61 VanDerWaalsContact CA-O 3.28Å; L56-E61 WeakPolarHBondContact CA-O 3.37Å; N57-E61 VanDerWaalsContact CG-O 3.23Å; N57-E61 PolarHBondContact N-O 2.87Å; N57-E61 PolarHBondContact OD1-N 3.45Å; N57-E61 PolarHBondContact OD1-O 3.01Å; L59-E61 VanDerWaalsContact C-N 3.31Å; L59-E61 HydrophobicContact CB-CG 4.37Å; E61-T63 PolarHBondContact O-N 3.33Å; E61-H86 IonicContact OE1-NE2 3.89Å; E61-H86 IonicContact OE2-CD2 3.89Å; E61-H86 IonicContact OE2-NE2 3.78Å; E61-H86 PolarHBondContact OE2-NE2 3.32Å; E61-S197 WeakPolarHBondContact OE1-CB 3.46Å; E61-S197 PolarHBondContact OE1-OG 2.96Å; E61-S197 VanDerWaalsContact OE2-CB 3.26Å; E61-S197 WeakPolarHBondContact OE2-CB 3.23Å; E61-S197 PolarHBondContact OE2-OG 3.37Å
62P86Confident82Confident31 Ų3167.1 Ų67.120%0.20139%0.394CS..BIsolated β-bridgetrans-57.5128173.626.2-36.1000110.9V54 L67V54-P62 HydrophobicContact CG1-CB 3.53Å; P62-L67 HydrophobicContact CB-CD1 4.22Å; P62-L67 HydrophobicContact CB-CD2 4.06Å; P62-L67 HydrophobicContact CB-CG 4.06Å; P62-L67 HydrophobicContact CG-CD1 4.06Å; P62-L67 HydrophobicContact CG-CD2 4.32Å; P62-L67 HydrophobicContact CG-CG 4.39Å
63T88.2Confident83.4Confident22 Ų2269.3 Ų69.314%0.13539%0.391CS..PPolyproline II helixtrans-59.7146.1173.155.90000109.9V55 N57 E61 A65 S66 L67 E83V55-T63 HydrophobicContact CB-CG2 4.44Å; V55-T63 HydrophobicContact CG1-CG2 4.11Å; V55-T63 WeakPolarHBondContact O-CB 3.31Å; V55-T63 VanDerWaalsContact O-CG2 3.26Å; V55-T63 WeakPolarHBondContact O-CG2 3.43Å; V55-T63 PolarHBondContact O-N 3.42Å; V55-T63 PolarHBondContact O-OG1 2.76Å; N57-T63 HydrophobicContact CB-CG2 3.95Å; E61-T63 PolarHBondContact O-N 3.33Å; T63-A65 PolarHBondContact O-N 3.42Å; T63-S66 PolarHBondContact N-OG 3.25Å; T63-S66 PolarHBondContact O-N 3.23Å; T63-S66 PolarHBondContact O-OG 3.48Å; T63-S66 VanDerWaalsContact OG1-CB 3.31Å; T63-S66 WeakPolarHBondContact OG1-CB 3.5Å; T63-S66 PolarHBondContact OG1-N 3.25Å; T63-S66 PolarHBondContact OG1-OG 3.26Å; T63-L67 PolarHBondContact O-N 2.95Å; T63-E83 WeakPolarHBondContact CA-OE1 3.47Å; T63-E83 WeakPolarHBondContact CB-OE1 3.3Å
64L88.5Confident84.7Confident2 Ų264.8 Ų64.81%0.0138%0.375CS..THydrogen-bonded Turntrans-60.8-35.5179.9-62.7-173.1000111S66 L67 G68 L69 Q79 E83 W93 L190 V195L64-S66 VanDerWaalsContact C-N 3.33Å; L64-S66 PolarHBondContact O-N 3.07Å; L64-L67 PolarHBondContact O-N 3.25Å; L64-L67 VanDerWaalsContact O-N 3.15Å; L64-G68 PolarHBondContact O-N 3.49Å; L64-L69 HydrophobicContact CB-CB 3.96Å; L64-L69 HydrophobicContact CB-CD1 4.38Å; L64-L69 HydrophobicContact CD2-CD1 3.91Å; L64-L69 WeakPolarHBondContact O-CA 3.47Å; L64-L69 VanDerWaalsContact O-CB 3.24Å; L64-L69 WeakPolarHBondContact O-CB 3.5Å; L64-L69 PolarHBondContact O-N 2.9Å; L64-Q79 HydrophobicContact CD1-CB 3.94Å; L64-Q79 WeakPolarHBondContact CD1-O 3.4Å; L64-E83 WeakPolarHBondContact CB-OE2 3.46Å; L64-E83 HydrophobicContact CD1-CB 3.78Å; L64-E83 HydrophobicContact CG-CB 4.12Å; L64-E83 HydrophobicContact CG-CG 4.33Å; L64-E83 PolarHBondContact N-OE1 2.92Å; L64-W93 HydrophobicContact CD2-CH2 4.46Å; L64-L190 HydrophobicContact CD1-CD1 4.17Å; L64-L190 HydrophobicContact CD2-CG 4.41Å; L64-V195 HydrophobicContact CD2-CG2 4.36Å
65A86.7Confident85.6Confident58 Ų5861.6 Ų61.648%0.47936%0.357SS..THydrogen-bonded Turntrans-58.4-42.417400000112.7T63 L67 G68 N70T63-A65 PolarHBondContact O-N 3.42Å; A65-L67 PolarHBondContact O-N 2.84Å; A65-G68 PolarHBondContact O-N 3.46Å; A65-N70 HydrophobicContact CB-CB 4.42Å
66S84.1Confident86.1Confident23 Ų2357.6 Ų57.616%0.16133%0.333CS..THydrogen-bonded Turntrans-65.6-26177.773.70000113.6T63 L64 G68T63-S66 PolarHBondContact N-OG 3.25Å; T63-S66 PolarHBondContact O-N 3.23Å; T63-S66 PolarHBondContact O-OG 3.48Å; T63-S66 VanDerWaalsContact OG1-CB 3.31Å; T63-S66 WeakPolarHBondContact OG1-CB 3.5Å; T63-S66 PolarHBondContact OG1-N 3.25Å; T63-S66 PolarHBondContact OG1-OG 3.26Å; L64-S66 VanDerWaalsContact C-N 3.33Å; L64-S66 PolarHBondContact O-N 3.07Å; S66-G68 PolarHBondContact O-N 3.32Å
67L83.3Confident86.5Confident41 Ų4159 Ų5922%0.21533%0.331CS..THydrogen-bonded Turntrans-83.35.3175-63.1175.9000113.3P62 T63 L64 A65 L69 L193 V195P62-L67 HydrophobicContact CB-CD1 4.22Å; P62-L67 HydrophobicContact CB-CD2 4.06Å; P62-L67 HydrophobicContact CB-CG 4.06Å; P62-L67 HydrophobicContact CG-CD1 4.06Å; P62-L67 HydrophobicContact CG-CD2 4.32Å; P62-L67 HydrophobicContact CG-CG 4.39Å; T63-L67 PolarHBondContact O-N 2.95Å; L64-L67 PolarHBondContact O-N 3.25Å; L64-L67 VanDerWaalsContact O-N 3.15Å; A65-L67 PolarHBondContact O-N 2.84Å; L67-L69 VanDerWaalsContact C-N 3.25Å; L67-L69 HydrophobicContact CB-CD1 4.49Å; L67-L69 PolarHBondContact O-N 3.45Å; L67-L193 HydrophobicContact CB-CD1 4.41Å; L67-L193 WeakPolarHBondContact O-CD1 3.39Å; L67-V195 HydrophobicContact CD1-CG2 3.74Å
68G82.6Confident86.9Confident69 Ų6958.3 Ų58.371%0.71133%0.326SS*.THydrogen-bonded Turntrans74.913.5-17500000114L64 A65 S66L64-G68 PolarHBondContact O-N 3.49Å; A65-G68 PolarHBondContact O-N 3.46Å; S66-G68 PolarHBondContact O-N 3.32Å
69L82.2Confident87.4Confident21 Ų2152.7 Ų52.711%0.1129%0.292CS..  trans-87.6-175.8167.7-64.1164.9000109.6L64 L67 L190 L193L64-L69 HydrophobicContact CB-CB 3.96Å; L64-L69 HydrophobicContact CB-CD1 4.38Å; L64-L69 HydrophobicContact CD2-CD1 3.91Å; L64-L69 WeakPolarHBondContact O-CA 3.47Å; L64-L69 VanDerWaalsContact O-CB 3.24Å; L64-L69 WeakPolarHBondContact O-CB 3.5Å; L64-L69 PolarHBondContact O-N 2.9Å; L67-L69 VanDerWaalsContact C-N 3.25Å; L67-L69 HydrophobicContact CB-CD1 4.49Å; L67-L69 PolarHBondContact O-N 3.45Å; L69-L190 HydrophobicContact CD1-CD1 4.01Å; L69-L190 HydrophobicContact CD1-CG 4.35Å; L69-L193 HydrophobicContact CD1-CD1 3.61Å; L69-L193 HydrophobicContact CD2-CD1 3.58Å; L69-L193 HydrophobicContact CG-CD1 3.36Å
70N83.3Confident87.8Confident35 Ų3550 Ų5019%0.18728%0.279CS..  trans67.444.4-179.2-158.3-3.8000114.1A65 G76A65-N70 HydrophobicContact CB-CB 4.42Å; N70-G76 PolarHBondContact OD1-O 3.01Å
71S84.9Confident88.4Confident46 Ų4648.6 Ų48.632%0.32226%0.259SS..  trans-65.1166173.772.20000113.7W73 S75 G76S71-W73 PolarHBondContact O-N 3.41Å; S71-W73 VanDerWaalsContact O-N 3.14Å; S71-W73 PolarHBondContact OG-N 3.47Å; S71-S75 PolarHBondContact OG-OG 2.84Å; S71-G76 VanDerWaalsContact O-CA 3.25Å; S71-G76 WeakPolarHBondContact O-CA 3.29Å
72Y85.3Confident88.9Confident179 Ų17946.6 Ų46.670%0.70225%0.25SS*.SBendtrans-70.7-3.2173.7-168.4-103000113.8
73W88.7Confident89.3Confident189 Ų18946.4 Ų46.472%0.71625%0.247SC*.SBendtrans-80.1159.9176.1-68.495.6000111.1S71 S75 G76 W77S71-W73 PolarHBondContact O-N 3.41Å; S71-W73 VanDerWaalsContact O-N 3.14Å; S71-W73 PolarHBondContact OG-N 3.47Å; W73-S75 PolarHBondContact O-N 3.39Å; W73-G76 PolarHBondContact O-N 2.77Å; W73-W77 PolarHBondContact O-N 3.4Å
74P91.5Very high89.5Confident58 Ų5846.7 Ų46.738%0.37725%0.248SC..Hα-helixtrans-51.3-26.9178.3-29.836.2000114.7Y78P74-Y78 PolarHBondContact O-N 3.3Å; P74-Y78 VanDerWaalsContact O-N 3.15Å
75S93.2Very high89.9Confident20 Ų2047.5 Ų47.514%0.1425%0.252CS..Hα-helixtrans-61.9-47171.757.20000112.7S71 W73 Y78 Q79 G182 T185S71-S75 PolarHBondContact OG-OG 2.84Å; W73-S75 PolarHBondContact O-N 3.39Å; S75-Y78 WeakPolarHBondContact O-CB 3.32Å; S75-Y78 PolarHBondContact O-N 2.74Å; S75-Q79 WeakPolarHBondContact O-CG 3.39Å; S75-Q79 PolarHBondContact O-N 3.05Å; S75-G182 WeakPolarHBondContact CA-O 3.25Å; S75-T185 VanDerWaalsContact CB-OG1 3.28Å; S75-T185 WeakPolarHBondContact CB-OG1 3.42Å
76G93Very high90.3Very high0 Ų045.4 Ų45.40%023%0.233CC..Hα-helixtrans-68.8-37.2179.700000113N70 S71 W73 Y78 Q79 S80N70-G76 PolarHBondContact OD1-O 3.01Å; S71-G76 VanDerWaalsContact O-CA 3.25Å; S71-G76 WeakPolarHBondContact O-CA 3.29Å; W73-G76 PolarHBondContact O-N 2.77Å; G76-Y78 VanDerWaalsContact C-N 3.29Å; G76-Y78 PolarHBondContact O-N 3.21Å; G76-Q79 WeakPolarHBondContact O-CB 3.48Å; G76-Q79 PolarHBondContact O-N 3.01Å; G76-Q79 VanDerWaalsContact O-N 3.13Å; G76-S80 WeakPolarHBondContact O-CB 3.48Å; G76-S80 PolarHBondContact O-N 3.09Å
77W92.5Very high90.7Very high133 Ų13344.9 Ų44.950%0.50423%0.228SC..Hα-helixtrans-59.7-40.3170.7-65.6-18.1000112.5W73 L81W73-W77 PolarHBondContact O-N 3.4Å; W77-L81 WeakPolarHBondContact O-CB 3.29Å; W77-L81 PolarHBondContact O-N 2.92Å
78Y95.4Very high91.1Very high8 Ų849.4 Ų49.43%0.03125%0.248CC..Hα-helixtrans-66.6-39.1174.8179.9-100.4000112.1P74 S75 G76 L81 L82 S100 I104 V183 I187P74-Y78 PolarHBondContact O-N 3.3Å; P74-Y78 VanDerWaalsContact O-N 3.15Å; S75-Y78 WeakPolarHBondContact O-CB 3.32Å; S75-Y78 PolarHBondContact O-N 2.74Å; G76-Y78 VanDerWaalsContact C-N 3.29Å; G76-Y78 PolarHBondContact O-N 3.21Å; Y78-L81 WeakPolarHBondContact O-CB 3.4Å; Y78-L81 PolarHBondContact O-N 3.25Å; Y78-L82 HydrophobicContact CD1-CD1 4.03Å; Y78-L82 HydrophobicContact CD1-CG 4.29Å; Y78-L82 HydrophobicContact CE1-CD1 3.37Å; Y78-L82 HydrophobicContact CE1-CD2 4.32Å; Y78-L82 HydrophobicContact CE1-CG 3.76Å; Y78-L82 PolarHBondContact O-N 2.91Å; Y78-S100 PolarHBondContact OH-OG 3.07Å; Y78-I104 HydrophobicContact CD2-CD1 3.7Å; Y78-I104 HydrophobicContact CE2-CD1 3.74Å; Y78-V183 HydrophobicContact CD1-CG1 4.36Å; Y78-V183 HydrophobicContact CD2-CB 4.33Å; Y78-V183 HydrophobicContact CD2-CG1 4.34Å; Y78-V183 HydrophobicContact CD2-CG2 3.68Å; Y78-V183 HydrophobicContact CE1-CG1 3.86Å; Y78-V183 HydrophobicContact CE2-CB 4.28Å; Y78-V183 HydrophobicContact CE2-CG1 3.81Å; Y78-V183 HydrophobicContact CE2-CG2 3.78Å; Y78-V183 HydrophobicContact CG-CB 4.44Å; Y78-V183 HydrophobicContact CG-CG2 4.14Å; Y78-I187 HydrophobicContact CD1-CG1 4.46Å; Y78-I187 HydrophobicContact CE1-CD1 4.14Å; Y78-I187 HydrophobicContact CE1-CG1 3.5Å
79Q94.7Very high91.6Very high6 Ų651.2 Ų51.23%0.02824%0.241CC..Hα-helixtrans-63.7-44.7175.6-67.2170.7-19.600111.6L64 S75 G76 L81 L82 E83 G186 L190L64-Q79 HydrophobicContact CD1-CB 3.94Å; L64-Q79 WeakPolarHBondContact CD1-O 3.4Å; S75-Q79 WeakPolarHBondContact O-CG 3.39Å; S75-Q79 PolarHBondContact O-N 3.05Å; G76-Q79 WeakPolarHBondContact O-CB 3.48Å; G76-Q79 PolarHBondContact O-N 3.01Å; G76-Q79 VanDerWaalsContact O-N 3.13Å; Q79-L81 VanDerWaalsContact C-N 3.3Å; Q79-L81 PolarHBondContact O-N 3.49Å; Q79-L82 WeakPolarHBondContact O-CB 3.29Å; Q79-L82 PolarHBondContact O-N 2.92Å; Q79-L82 VanDerWaalsContact O-N 3.13Å; Q79-E83 PolarHBondContact O-N 3.33Å; Q79-G186 PolarHBondContact NE2-O 3Å; Q79-L190 HydrophobicContact CB-CD1 4.14Å; Q79-L190 HydrophobicContact CG-CD1 3.45Å; Q79-L190 VanDerWaalsContact CG-CD1 3.45Å
80S92.8Very high92.1Very high16 Ų1656 Ų5611%0.11227%0.267CS..Hα-helixtrans-60.1-39.9173.5-177.50000111.9G76 E83 T84G76-S80 WeakPolarHBondContact O-CB 3.48Å; G76-S80 PolarHBondContact O-N 3.09Å; S80-E83 PolarHBondContact O-N 3.44Å; S80-T84 WeakPolarHBondContact O-CB 3.48Å; S80-T84 PolarHBondContact O-N 2.94Å; S80-T84 PolarHBondContact O-OG1 2.98Å
81L95.1Very high92.6Very high21 Ų2156.7 Ų56.711%0.1127%0.27CS..Hα-helixtrans-61.5-45.6173.2175.862.7000111.3F11 W77 Y78 Q79 T84 L85 L103 I104F11-L81 HydrophobicContact CE2-CD1 4.19Å; W77-L81 WeakPolarHBondContact O-CB 3.29Å; W77-L81 PolarHBondContact O-N 2.92Å; Y78-L81 WeakPolarHBondContact O-CB 3.4Å; Y78-L81 PolarHBondContact O-N 3.25Å; Q79-L81 VanDerWaalsContact C-N 3.3Å; Q79-L81 PolarHBondContact O-N 3.49Å; L81-T84 PolarHBondContact O-N 3.37Å; L81-L85 HydrophobicContact CD1-CD1 4.14Å; L81-L85 HydrophobicContact CD1-CG 4.15Å; L81-L85 HydrophobicContact CG-CD1 4.11Å; L81-L85 WeakPolarHBondContact O-CB 3.43Å; L81-L85 VanDerWaalsContact O-CG 3.23Å; L81-L85 WeakPolarHBondContact O-CG 3.39Å; L81-L85 PolarHBondContact O-N 3.2Å; L81-L103 HydrophobicContact CD1-CD2 4.15Å; L81-L103 HydrophobicContact CD2-CD2 4.45Å; L81-I104 HydrophobicContact CD2-CD1 4.44Å
82L95.8Very high93.1Very high1 Ų157 Ų571%0.00527%0.271CS..Hα-helixtrans-61.9-46.8177.3-74.3-178.7000112.2Y78 Q79 T84 L85 H86 W93 A96 I97 S100 L190Y78-L82 HydrophobicContact CD1-CD1 4.03Å; Y78-L82 HydrophobicContact CD1-CG 4.29Å; Y78-L82 HydrophobicContact CE1-CD1 3.37Å; Y78-L82 HydrophobicContact CE1-CD2 4.32Å; Y78-L82 HydrophobicContact CE1-CG 3.76Å; Y78-L82 PolarHBondContact O-N 2.91Å; Q79-L82 WeakPolarHBondContact O-CB 3.29Å; Q79-L82 PolarHBondContact O-N 2.92Å; Q79-L82 VanDerWaalsContact O-N 3.13Å; L82-T84 VanDerWaalsContact C-N 3.32Å; L82-T84 PolarHBondContact O-N 3.5Å; L82-L85 PolarHBondContact O-N 3.23Å; L82-H86 WeakPolarHBondContact O-CB 3.26Å; L82-H86 PolarHBondContact O-N 3.23Å; L82-W93 HydrophobicContact CB-CZ3 4.12Å; L82-A96 HydrophobicContact CD2-CB 4.22Å; L82-I97 HydrophobicContact CD2-CG1 4.03Å; L82-S100 WeakPolarHBondContact CD2-OG 3.38Å; L82-L190 HydrophobicContact CD1-CD2 3.85Å
83E93.3Very high93.7Very high27 Ų2748.8 Ų48.813%0.12624%0.239CC..Hα-helixtrans-60.6-42.6176.5-176.3170.7-153.300111.1T63 L64 Q79 S80 L85 H86 V87T63-E83 WeakPolarHBondContact CA-OE1 3.47Å; T63-E83 WeakPolarHBondContact CB-OE1 3.3Å; L64-E83 WeakPolarHBondContact CB-OE2 3.46Å; L64-E83 HydrophobicContact CD1-CB 3.78Å; L64-E83 HydrophobicContact CG-CB 4.12Å; L64-E83 HydrophobicContact CG-CG 4.33Å; L64-E83 PolarHBondContact N-OE1 2.92Å; Q79-E83 PolarHBondContact O-N 3.33Å; S80-E83 PolarHBondContact O-N 3.44Å; E83-L85 PolarHBondContact O-N 3.39Å; E83-H86 PolarHBondContact O-N 3.28Å; E83-V87 HydrophobicContact CG-CG2 4.03Å; E83-V87 VanDerWaalsContact O-CB 3.22Å; E83-V87 WeakPolarHBondContact O-CB 3.31Å; E83-V87 VanDerWaalsContact O-CG2 3.25Å; E83-V87 WeakPolarHBondContact O-CG2 3.27Å; E83-V87 PolarHBondContact O-N 2.68Å
84T93.6Very high94Very high27 Ų2743.8 Ų43.817%0.16622%0.22CC..Hα-helixtrans-60.5-46.7175.8-55.70000111.1I10 S80 L81 L82 H88I10-T84 HydrophobicContact CG2-CG2 4.03Å; S80-T84 WeakPolarHBondContact O-CB 3.48Å; S80-T84 PolarHBondContact O-N 2.94Å; S80-T84 PolarHBondContact O-OG1 2.98Å; L81-T84 PolarHBondContact O-N 3.37Å; L82-T84 VanDerWaalsContact C-N 3.32Å; L82-T84 PolarHBondContact O-N 3.5Å; T84-H88 HydrophobicContact CG2-CB 4.48Å; T84-H88 WeakPolarHBondContact O-CA 3.3Å; T84-H88 VanDerWaalsContact O-CB 3.24Å; T84-H88 WeakPolarHBondContact O-CB 3.4Å; T84-H88 PolarHBondContact O-N 2.99Å; T84-H88 PolarHBondContact O-ND1 2.93Å
85L95.9Very high94.3Very high19 Ų1941.4 Ų41.410%0.09921%0.206CC..Hα-helixtrans-65.9-37.3178.4-68.1173.6000112.2L81 L82 E83 L89 L91 A96 A99L81-L85 HydrophobicContact CD1-CD1 4.14Å; L81-L85 HydrophobicContact CD1-CG 4.15Å; L81-L85 HydrophobicContact CG-CD1 4.11Å; L81-L85 WeakPolarHBondContact O-CB 3.43Å; L81-L85 VanDerWaalsContact O-CG 3.23Å; L81-L85 WeakPolarHBondContact O-CG 3.39Å; L81-L85 PolarHBondContact O-N 3.2Å; L82-L85 PolarHBondContact O-N 3.23Å; E83-L85 PolarHBondContact O-N 3.39Å; L85-L89 HydrophobicContact CD2-CD1 3.45Å; L85-L89 VanDerWaalsContact CD2-CD1 3.45Å; L85-L89 WeakPolarHBondContact O-CB 3.39Å; L85-L89 PolarHBondContact O-N 2.63Å; L85-L91 HydrophobicContact CB-CD1 4.37Å; L85-L91 WeakPolarHBondContact O-CB 3.39Å; L85-A96 HydrophobicContact CB-CB 3.94Å; L85-A96 WeakPolarHBondContact CD1-O 3.5Å; L85-A99 HydrophobicContact CD1-CB 4.23Å
86H95.1Very high94.5Very high15 Ų1540.4 Ų40.47%0.06920%0.199CC..Hα-helixtrans-71.2-48.6179.6-177.951.7000111.7E61 L82 E83 D90 L91 W93 A96E61-H86 IonicContact OE1-NE2 3.89Å; E61-H86 IonicContact OE2-CD2 3.89Å; E61-H86 IonicContact OE2-NE2 3.78Å; E61-H86 PolarHBondContact OE2-NE2 3.32Å; L82-H86 WeakPolarHBondContact O-CB 3.26Å; L82-H86 PolarHBondContact O-N 3.23Å; E83-H86 PolarHBondContact O-N 3.28Å; H86-D90 WeakPolarHBondContact O-CA 3.5Å; H86-D90 PolarHBondContact O-N 3.49Å; H86-L91 WeakPolarHBondContact CA-O 3.43Å; H86-L91 PolarHBondContact ND1-O 3.01Å; H86-L91 PolarHBondContact O-N 3.04Å; H86-W93 HydrophobicContact CB-CE3 4.41Å; H86-W93 HydrophobicContact CB-CH2 4.29Å; H86-W93 HydrophobicContact CB-CZ2 4.48Å; H86-W93 HydrophobicContact CB-CZ3 4.26Å; H86-W93 AromaticContact CD2-CE2 3.49Å; H86-W93 VanDerWaalsContact CD2-CE2 3.49Å; H86-W93 AromaticContact CD2-CH2 3.93Å; H86-W93 AromaticContact CD2-CZ2 3.34Å; H86-W93 WeakPolarHBondContact CD2-CZ2 3.33Å; H86-W93 AromaticContact CD2-NE1 3.79Å; H86-W93 AromaticContact CE1-CD1 3.87Å; H86-W93 AromaticContact CE1-CE2 3.97Å; H86-W93 AromaticContact CE1-NE1 3.62Å; H86-W93 AromaticContact CG-CE2 3.84Å; H86-W93 AromaticContact CG-CZ2 3.93Å; H86-W93 AromaticContact NE2-CE2 3.58Å; H86-W93 AromaticContact NE2-CZ2 3.81Å; H86-W93 AromaticContact NE2-NE1 3.35Å; H86-W93 PolarHBondContact NE2-NE1 2.74Å; H86-A96 HydrophobicContact CB-CB 4.4Å
87V93.1Very high94.7Very high11 Ų1140.6 Ų40.67%0.06720%0.2CC..Hα-helixtrans-84.4-39.8-171.5178.80000112.9N57 T58 L59 E83N57-V87 HydrophobicContact CB-CG1 4.26Å; N57-V87 HydrophobicContact CB-CG2 4.11Å; N57-V87 WeakPolarHBondContact ND2-CG2 3.3Å; T58-V87 WeakPolarHBondContact OG1-CG1 3.31Å; L59-V87 HydrophobicContact CD1-CG2 4.32Å; E83-V87 HydrophobicContact CG-CG2 4.03Å; E83-V87 VanDerWaalsContact O-CB 3.22Å; E83-V87 WeakPolarHBondContact O-CB 3.31Å; E83-V87 VanDerWaalsContact O-CG2 3.25Å; E83-V87 WeakPolarHBondContact O-CG2 3.27Å; E83-V87 PolarHBondContact O-N 2.68Å
88H91.9Very high95Very high136 Ų13634.9 Ų34.963%0.6318%0.181SC*.Hα-helixtrans-95.4-21.4-174.3-62.875000113.9T84T84-H88 HydrophobicContact CG2-CB 4.48Å; T84-H88 WeakPolarHBondContact O-CA 3.3Å; T84-H88 VanDerWaalsContact O-CB 3.24Å; T84-H88 WeakPolarHBondContact O-CB 3.4Å; T84-H88 PolarHBondContact O-N 2.99Å; T84-H88 PolarHBondContact O-ND1 2.93Å
89L93.2Very high95.1Very high108 Ų10836 Ų3657%0.56519%0.192SC*.SBendtrans-108.25.9175.8-59.9175.8000112.5L85 L91L85-L89 HydrophobicContact CD2-CD1 3.45Å; L85-L89 VanDerWaalsContact CD2-CD1 3.45Å; L85-L89 WeakPolarHBondContact O-CB 3.39Å; L85-L89 PolarHBondContact O-N 2.63Å; L89-L91 HydrophobicContact CB-CD1 4.18Å; L89-L91 HydrophobicContact CB-CG 3.95Å; L89-L91 HydrophobicContact CD1-CD1 4.24Å; L89-L91 PolarHBondContact O-N 3.47Å; L89-L91 VanDerWaalsContact O-N 3.08Å
90D92.4Very high95.2Very high121 Ų12135.8 Ų35.865%0.64719%0.191SC*.  trans49.134.5-177.4-60.8-46.1000112.9H86H86-D90 WeakPolarHBondContact O-CA 3.5Å; H86-D90 PolarHBondContact O-N 3.49Å
91L94.3Very high95.4Very high50 Ų5035.1 Ų35.126%0.26219%0.186SC..  trans-83133.1179.3-69.1176.1000109.6L85 H86 L89 A96 A99L85-L91 HydrophobicContact CB-CD1 4.37Å; L85-L91 WeakPolarHBondContact O-CB 3.39Å; H86-L91 WeakPolarHBondContact CA-O 3.43Å; H86-L91 PolarHBondContact ND1-O 3.01Å; H86-L91 PolarHBondContact O-N 3.04Å; L89-L91 HydrophobicContact CB-CD1 4.18Å; L89-L91 HydrophobicContact CB-CG 3.95Å; L89-L91 HydrophobicContact CD1-CD1 4.24Å; L89-L91 PolarHBondContact O-N 3.47Å; L89-L91 VanDerWaalsContact O-N 3.08Å; L91-A96 HydrophobicContact CB-CB 4.44Å; L91-A99 HydrophobicContact CD1-CB 4.01Å
92P95.2Very high95.5Very high53 Ų5337.5 Ų37.534%0.34420%0.199SC..  trans-59.6155.716828.2-35.7000110.2W94 G95 A96P92-W94 VanDerWaalsContact C-N 3.28Å; P92-W94 HydrophobicContact CG-CD2 4.44Å; P92-W94 HydrophobicContact CG-CG 4.41Å; P92-W94 HydrophobicContact CG-CZ2 4.19Å; P92-W94 PolarHBondContact O-N 3.18Å; P92-W94 VanDerWaalsContact O-N 3.17Å; P92-G95 CarbonylContact O-C 3.54Å; P92-G95 VanDerWaalsContact O-CA 3.28Å; P92-G95 WeakPolarHBondContact O-CA 3.38Å; P92-G95 PolarHBondContact O-N 2.91Å; P92-A96 PolarHBondContact O-N 3.47Å
93W96.1Very high95.6Very high6 Ų639.7 Ų39.72%0.02321%0.21CC..Hα-helixtrans-54.4-39.8-174.7-75.1107.9000113.8L64 L82 H86 G95 A96 I97 L190 V195 S197 L198 G201 L209L64-W93 HydrophobicContact CD2-CH2 4.46Å; L82-W93 HydrophobicContact CB-CZ3 4.12Å; H86-W93 HydrophobicContact CB-CE3 4.41Å; H86-W93 HydrophobicContact CB-CH2 4.29Å; H86-W93 HydrophobicContact CB-CZ2 4.48Å; H86-W93 HydrophobicContact CB-CZ3 4.26Å; H86-W93 AromaticContact CD2-CE2 3.49Å; H86-W93 VanDerWaalsContact CD2-CE2 3.49Å; H86-W93 AromaticContact CD2-CH2 3.93Å; H86-W93 AromaticContact CD2-CZ2 3.34Å; H86-W93 WeakPolarHBondContact CD2-CZ2 3.33Å; H86-W93 AromaticContact CD2-NE1 3.79Å; H86-W93 AromaticContact CE1-CD1 3.87Å; H86-W93 AromaticContact CE1-CE2 3.97Å; H86-W93 AromaticContact CE1-NE1 3.62Å; H86-W93 AromaticContact CG-CE2 3.84Å; H86-W93 AromaticContact CG-CZ2 3.93Å; H86-W93 AromaticContact NE2-CE2 3.58Å; H86-W93 AromaticContact NE2-CZ2 3.81Å; H86-W93 AromaticContact NE2-NE1 3.35Å; H86-W93 PolarHBondContact NE2-NE1 2.74Å; W93-G95 VanDerWaalsContact C-N 3.26Å; W93-G95 PolarHBondContact O-N 2.83Å; W93-A96 PolarHBondContact O-N 3.36Å; W93-I97 VanDerWaalsContact O-CG1 3.29Å; W93-I97 WeakPolarHBondContact O-CG1 3.35Å; W93-I97 PolarHBondContact O-N 2.93Å; W93-L190 HydrophobicContact CE3-CD2 4.28Å; W93-L190 HydrophobicContact CH2-CD2 4.22Å; W93-L190 HydrophobicContact CZ3-CD2 3.72Å; W93-V195 HydrophobicContact CZ2-CG1 4.15Å; W93-S197 VanDerWaalsContact CD1-O 3.23Å; W93-S197 PolarHBondContact NE1-OG 3.21Å; W93-L198 HydrophobicContact CB-CG 4.49Å; W93-L198 HydrophobicContact CD2-CD1 3.75Å; W93-L198 HydrophobicContact CD2-CG 4.14Å; W93-L198 HydrophobicContact CE3-CD1 4.13Å; W93-L198 HydrophobicContact CG-CD1 4.15Å; W93-L198 HydrophobicContact CG-CG 4.06Å; W93-L198 HydrophobicContact CH2-CD1 4.35Å; W93-L198 HydrophobicContact CZ2-CD1 3.99Å; W93-L198 HydrophobicContact CZ3-CD1 4.41Å; W93-G201 PolarHBondContact N-O 3.23Å; W93-L209 HydrophobicContact CB-CD1 3.46Å; W93-L209 VanDerWaalsContact CB-CD1 3.46Å
94W96.8Very high95.7Very high84 Ų8440.2 Ų40.232%0.31821%0.213SC..Hα-helixtrans-59.4-38.7173.774.6-95.7000111.9P92 A98 G201 G202 T203 W269P92-W94 VanDerWaalsContact C-N 3.28Å; P92-W94 HydrophobicContact CG-CD2 4.44Å; P92-W94 HydrophobicContact CG-CG 4.41Å; P92-W94 HydrophobicContact CG-CZ2 4.19Å; P92-W94 PolarHBondContact O-N 3.18Å; P92-W94 VanDerWaalsContact O-N 3.17Å; W94-A98 WeakPolarHBondContact O-CB 3.45Å; W94-A98 PolarHBondContact O-N 3.25Å; W94-G201 VanDerWaalsContact CD1-O 3.29Å; W94-G201 PolarHBondContact N-O 2.91Å; W94-G202 VanDerWaalsContact CD1-O 3.23Å; W94-T203 HydrophobicContact CB-CG2 4.39Å; W94-T203 HydrophobicContact CD2-CG2 3.77Å; W94-T203 HydrophobicContact CE3-CG2 4.18Å; W94-T203 HydrophobicContact CG-CG2 3.86Å; W94-W269 AromaticContact CE3-CZ2 3.78Å; W94-W269 HydrophobicContact CE3-CZ2 3.78Å; W94-W269 HydrophobicContact CZ3-CZ2 4.24Å; W94-W269 PolarHBondContact O-NE1 3.4Å
95G97.4Very high95.7Very high7 Ų740.2 Ų40.27%0.07221%0.21CC..Hα-helixtrans-70.9-42177.300000112.2P92 W93 A98 A99P92-G95 CarbonylContact O-C 3.54Å; P92-G95 VanDerWaalsContact O-CA 3.28Å; P92-G95 WeakPolarHBondContact O-CA 3.38Å; P92-G95 PolarHBondContact O-N 2.91Å; W93-G95 VanDerWaalsContact C-N 3.26Å; W93-G95 PolarHBondContact O-N 2.83Å; G95-A98 PolarHBondContact O-N 3.46Å; G95-A99 VanDerWaalsContact O-CB 3.23Å; G95-A99 WeakPolarHBondContact O-CB 3.49Å; G95-A99 PolarHBondContact O-N 2.9Å
96A97.3Very high95.6Very high0 Ų044.7 Ų44.70%023%0.232CC..Hα-helixtrans-61.9-42.6174.900000111.8L82 L85 H86 L91 P92 W93 S100L82-A96 HydrophobicContact CD2-CB 4.22Å; L85-A96 HydrophobicContact CB-CB 3.94Å; L85-A96 WeakPolarHBondContact CD1-O 3.5Å; H86-A96 HydrophobicContact CB-CB 4.4Å; L91-A96 HydrophobicContact CB-CB 4.44Å; P92-A96 PolarHBondContact O-N 3.47Å; W93-A96 PolarHBondContact O-N 3.36Å; A96-S100 VanDerWaalsContact O-CB 3.31Å; A96-S100 WeakPolarHBondContact O-CB 3.42Å; A96-S100 PolarHBondContact O-N 3.24Å; A96-S100 PolarHBondContact O-OG 3.34Å
97I97.4Very high95.6Very high3 Ų348.2 Ų48.22%0.01526%0.257CS..Hα-helixtrans-62.9-45.6173.7-66.3166.3000110.6L82 W93 S100 T101 I187 L209 A266L82-I97 HydrophobicContact CD2-CG1 4.03Å; W93-I97 VanDerWaalsContact O-CG1 3.29Å; W93-I97 WeakPolarHBondContact O-CG1 3.35Å; W93-I97 PolarHBondContact O-N 2.93Å; I97-S100 PolarHBondContact O-OG 3.42Å; I97-T101 WeakPolarHBondContact O-CB 3.49Å; I97-T101 PolarHBondContact O-N 3.41Å; I97-T101 PolarHBondContact O-OG1 3.08Å; I97-I187 HydrophobicContact CG2-CD1 4.48Å; I97-L209 HydrophobicContact CD1-CD1 4.28Å; I97-A266 HydrophobicContact CD1-CB 4.03Å
98A97.9Very high95.6Very high13 Ų1348.8 Ų48.811%0.10726%0.259CS..Hα-helixtrans-64.1-47.1179.100000112.1W94 G95 T101 I102 W269 V273W94-A98 WeakPolarHBondContact O-CB 3.45Å; W94-A98 PolarHBondContact O-N 3.25Å; G95-A98 PolarHBondContact O-N 3.46Å; A98-T101 WeakPolarHBondContact O-CB 3.06Å; A98-T101 PolarHBondContact O-N 3.33Å; A98-I102 VanDerWaalsContact O-CG1 3.29Å; A98-I102 WeakPolarHBondContact O-CG1 3.27Å; A98-I102 PolarHBondContact O-N 3.45Å; A98-W269 HydrophobicContact CB-CZ2 4.23Å; A98-V273 HydrophobicContact CB-CG1 4.32Å; A98-V273 HydrophobicContact CB-CG2 3.93Å
99A97.8Very high95.6Very high33 Ų3345.2 Ų45.227%0.27324%0.242SC..Hα-helixtrans-65-45.6-178.800000112.2L85 L91 G95 T101 I102 L103L85-A99 HydrophobicContact CD1-CB 4.23Å; L91-A99 HydrophobicContact CD1-CB 4.01Å; G95-A99 VanDerWaalsContact O-CB 3.23Å; G95-A99 WeakPolarHBondContact O-CB 3.49Å; G95-A99 PolarHBondContact O-N 2.9Å; A99-T101 VanDerWaalsContact C-N 3.32Å; A99-T101 PolarHBondContact O-N 3.5Å; A99-I102 PolarHBondContact O-N 2.96Å; A99-L103 WeakPolarHBondContact O-CB 3.44Å; A99-L103 PolarHBondContact O-N 3.44Å
100S97.4Very high95.5Very high0 Ų043.6 Ų43.60%024%0.238CC..Hα-helixtrans-61.2-41.4175550000111.7Y78 L82 A96 I97 L103 I104Y78-S100 PolarHBondContact OH-OG 3.07Å; L82-S100 WeakPolarHBondContact CD2-OG 3.38Å; A96-S100 VanDerWaalsContact O-CB 3.31Å; A96-S100 WeakPolarHBondContact O-CB 3.42Å; A96-S100 PolarHBondContact O-N 3.24Å; A96-S100 PolarHBondContact O-OG 3.34Å; I97-S100 PolarHBondContact O-OG 3.42Å; S100-L103 PolarHBondContact O-N 2.99Å; S100-I104 WeakPolarHBondContact O-CB 3.17Å; S100-I104 VanDerWaalsContact O-CG1 3.3Å; S100-I104 WeakPolarHBondContact O-CG1 3.3Å; S100-I104 PolarHBondContact O-N 2.81Å
101T97.1Very high95.5Very high2 Ų239.4 Ų39.41%0.01222%0.217CC..Hα-helixtrans-60-49176-56.80000111.2I97 A98 A99 L103 I104 R105 Y270 V273I97-T101 WeakPolarHBondContact O-CB 3.49Å; I97-T101 PolarHBondContact O-N 3.41Å; I97-T101 PolarHBondContact O-OG1 3.08Å; A98-T101 WeakPolarHBondContact O-CB 3.06Å; A98-T101 PolarHBondContact O-N 3.33Å; A99-T101 VanDerWaalsContact C-N 3.32Å; A99-T101 PolarHBondContact O-N 3.5Å; T101-L103 VanDerWaalsContact C-N 3.34Å; T101-L103 PolarHBondContact O-N 2.93Å; T101-I104 PolarHBondContact O-N 3.18Å; T101-R105 HydrophobicContact CG2-CG 4.39Å; T101-R105 WeakPolarHBondContact O-CB 3.42Å; T101-R105 WeakPolarHBondContact O-CG 3.37Å; T101-R105 PolarHBondContact O-N 3.37Å; T101-Y270 HydrophobicContact CG2-CD2 4.04Å; T101-Y270 HydrophobicContact CG2-CE2 3.97Å; T101-Y270 VanDerWaalsContact OG1-CD2 3.27Å; T101-Y270 WeakPolarHBondContact OG1-CD2 3.23Å; T101-V273 HydrophobicContact CG2-CB 4.25Å; T101-V273 HydrophobicContact CG2-CG1 3.95Å
102I97.3Very high95.3Very high72 Ų7238.3 Ų38.337%0.36921%0.211SC..Hα-helixtrans-61.2-45.4178.1-67.4163.9000110A98 A99 R105 M106 V273 V277A98-I102 VanDerWaalsContact O-CG1 3.29Å; A98-I102 WeakPolarHBondContact O-CG1 3.27Å; A98-I102 PolarHBondContact O-N 3.45Å; A99-I102 PolarHBondContact O-N 2.96Å; I102-R105 PolarHBondContact O-N 3.11Å; I102-M106 HydrophobicContact CG2-CE 4.23Å; I102-M106 HydrophobicContact CG2-CG 4.27Å; I102-M106 VanDerWaalsContact O-CG 3.26Å; I102-M106 WeakPolarHBondContact O-CG 3.3Å; I102-M106 PolarHBondContact O-N 3.17Å; I102-V273 HydrophobicContact CD1-CG1 4.43Å; I102-V273 HydrophobicContact CG1-CG1 4.05Å; I102-V277 HydrophobicContact CG1-CG2 3.91Å
103L96.4Very high95.1Very high47 Ų4736.4 Ų36.425%0.24620%0.198CC..Hα-helixtrans-58.6-51.2179.1-179.262.9000111.7L81 A99 S100 T101 R105 M106 C107L81-L103 HydrophobicContact CD1-CD2 4.15Å; L81-L103 HydrophobicContact CD2-CD2 4.45Å; A99-L103 WeakPolarHBondContact O-CB 3.44Å; A99-L103 PolarHBondContact O-N 3.44Å; S100-L103 PolarHBondContact O-N 2.99Å; T101-L103 VanDerWaalsContact C-N 3.34Å; T101-L103 PolarHBondContact O-N 2.93Å; L103-R105 VanDerWaalsContact C-N 3.31Å; L103-R105 PolarHBondContact O-N 2.97Å; L103-M106 PolarHBondContact O-N 3.45Å; L103-C107 PolarHBondContact O-N 3.14Å; L103-C107 PolarHBondContact O-SG 2.86Å; L103-C107 VanDerWaalsContact O-SG 3.34Å
104I95.5Very high94.7Very high37 Ų3743.4 Ų43.419%0.1922%0.224CC..Hα-helixtrans-59.4-45177.7-68.5168.4000110.1Y78 L81 S100 T101 M106 C107 M108 I179 V183Y78-I104 HydrophobicContact CD2-CD1 3.7Å; Y78-I104 HydrophobicContact CE2-CD1 3.74Å; L81-I104 HydrophobicContact CD2-CD1 4.44Å; S100-I104 WeakPolarHBondContact O-CB 3.17Å; S100-I104 VanDerWaalsContact O-CG1 3.3Å; S100-I104 WeakPolarHBondContact O-CG1 3.3Å; S100-I104 PolarHBondContact O-N 2.81Å; T101-I104 PolarHBondContact O-N 3.18Å; I104-M106 VanDerWaalsContact C-N 3.32Å; I104-M106 PolarHBondContact O-N 2.75Å; I104-C107 PolarHBondContact O-N 3.21Å; I104-M108 HydrophobicContact CG2-CG 4.29Å; I104-M108 HydrophobicContact CG2-SD 3.9Å; I104-M108 WeakPolarHBondContact O-CB 3.23Å; I104-M108 VanDerWaalsContact O-CG 3.26Å; I104-M108 WeakPolarHBondContact O-CG 3.19Å; I104-M108 PolarHBondContact O-N 2.96Å; I104-I179 HydrophobicContact CG2-CG2 3.71Å; I104-V183 HydrophobicContact CD1-CG2 3.85Å
105R94.4Very high94.3Very high28 Ų2841 Ų4111%0.10622%0.217CC..Hα-helixtrans-63.9-34.2178.9-72.7-64.6-164.9137.5-0.1113.1T101 I102 L103 F109 S274 V277 S278 Q281T101-R105 HydrophobicContact CG2-CG 4.39Å; T101-R105 WeakPolarHBondContact O-CB 3.42Å; T101-R105 WeakPolarHBondContact O-CG 3.37Å; T101-R105 PolarHBondContact O-N 3.37Å; I102-R105 PolarHBondContact O-N 3.11Å; L103-R105 VanDerWaalsContact C-N 3.31Å; L103-R105 PolarHBondContact O-N 2.97Å; R105-F109 PolarHBondContact O-N 2.81Å; R105-F109 VanDerWaalsContact O-N 3.12Å; R105-S274 VanDerWaalsContact CZ-OG 3.28Å; R105-S274 PolarHBondContact NE-OG 3.25Å; R105-S274 PolarHBondContact NH2-O 2.94Å; R105-S274 PolarHBondContact NH2-OG 2.78Å; R105-V277 HydrophobicContact CB-CB 4.49Å; R105-V277 HydrophobicContact CB-CG1 3.64Å; R105-V277 HydrophobicContact CG-CB 4.35Å; R105-V277 HydrophobicContact CG-CG1 3.97Å; R105-S278 PolarHBondContact NH1-OG 3.3Å; R105-S278 PolarHBondContact NH2-OG 3.12Å; R105-Q281 PolarHBondContact O-NE2 3.41Å
106M94.4Very high93.8Very high112 Ų11242.4 Ų42.455%0.55222%0.22SC*.Hα-helixtrans-70-43.2173.9-68.6-58.7173.800111.4I102 L103 I104 M108 F109I102-M106 HydrophobicContact CG2-CE 4.23Å; I102-M106 HydrophobicContact CG2-CG 4.27Å; I102-M106 VanDerWaalsContact O-CG 3.26Å; I102-M106 WeakPolarHBondContact O-CG 3.3Å; I102-M106 PolarHBondContact O-N 3.17Å; L103-M106 PolarHBondContact O-N 3.45Å; I104-M106 VanDerWaalsContact C-N 3.32Å; I104-M106 PolarHBondContact O-N 2.75Å; M106-M108 VanDerWaalsContact C-N 3.26Å; M106-M108 PolarHBondContact O-N 3.22Å; M106-F109 WeakPolarHBondContact O-CB 3.31Å; M106-F109 PolarHBondContact O-N 3.39Å; M106-F109 VanDerWaalsContact O-N 3.17Å
107C94.3Very high93.3Very high90 Ų9046.6 Ų46.661%0.60824%0.236SC*.Hα-helixtrans-61.5-35.2174-67.20000112.4L103 I104 P110L103-C107 PolarHBondContact O-N 3.14Å; L103-C107 PolarHBondContact O-SG 2.86Å; L103-C107 VanDerWaalsContact O-SG 3.34Å; I104-C107 PolarHBondContact O-N 3.21Å; C107-P110 WeakPolarHBondContact O-CD 3.35Å
108M92.3Very high92.7Very high22 Ų2249.2 Ų49.211%0.10825%0.248CC..THydrogen-bonded Turntrans-82.3-8.2177.9-68.4-173.273.500114.4I104 M106 P110 V111 M112 Q176 I179I104-M108 HydrophobicContact CG2-CG 4.29Å; I104-M108 HydrophobicContact CG2-SD 3.9Å; I104-M108 WeakPolarHBondContact O-CB 3.23Å; I104-M108 VanDerWaalsContact O-CG 3.26Å; I104-M108 WeakPolarHBondContact O-CG 3.19Å; I104-M108 PolarHBondContact O-N 2.96Å; M106-M108 VanDerWaalsContact C-N 3.26Å; M106-M108 PolarHBondContact O-N 3.22Å; M108-P110 VanDerWaalsContact C-CD 3.5Å; M108-V111 WeakPolarHBondContact O-CB 3.27Å; M108-V111 PolarHBondContact O-N 3.33Å; M108-M112 PolarHBondContact O-N 3.42Å; M108-Q176 HydrophobicContact CE-CB 3.87Å; M108-Q176 HydrophobicContact CE-CG 3.72Å; M108-I179 HydrophobicContact CE-CD1 3.55Å; M108-I179 HydrophobicContact CG-CD1 4.04Å; M108-I179 HydrophobicContact SD-CB 4.3Å; M108-I179 HydrophobicContact SD-CD1 3.55Å; M108-I179 VanDerWaalsContact SD-CD1 3.55Å; M108-I179 HydrophobicContact SD-CG2 3.87Å
109F92.6Very high92.1Very high62 Ų6251 Ų5127%0.27226%0.256SS..Hα-helixtrans-50.4-45.8-178.7-174.3-107000114.6R105 M106 V111 M112 V113 Q281 L285R105-F109 PolarHBondContact O-N 2.81Å; R105-F109 VanDerWaalsContact O-N 3.12Å; M106-F109 WeakPolarHBondContact O-CB 3.31Å; M106-F109 PolarHBondContact O-N 3.39Å; M106-F109 VanDerWaalsContact O-N 3.17Å; F109-V111 VanDerWaalsContact C-N 3.3Å; F109-V111 PolarHBondContact O-N 3.44Å; F109-M112 WeakPolarHBondContact O-CB 3.31Å; F109-M112 PolarHBondContact O-N 3.02Å; F109-M112 VanDerWaalsContact O-N 3.14Å; F109-V113 HydrophobicContact CD1-CG2 4.18Å; F109-V113 HydrophobicContact CE1-CG2 3.78Å; F109-V113 HydrophobicContact CE2-CG2 4.29Å; F109-V113 HydrophobicContact CZ-CG2 3.85Å; F109-V113 WeakPolarHBondContact O-CG2 3.4Å; F109-V113 PolarHBondContact O-N 3.48Å; F109-Q281 HydrophobicContact CD2-CG 4.26Å; F109-Q281 HydrophobicContact CE2-CG 4.36Å; F109-L285 HydrophobicContact CE2-CD1 4.38Å; F109-L285 HydrophobicContact CE2-CD2 4.33Å; F109-L285 HydrophobicContact CE2-CG 4.45Å; F109-L285 HydrophobicContact CZ-CD2 4.02Å
110P92Very high91.5Very high73 Ų7349.5 Ų49.547%0.47424%0.243SC..Hα-helixtrans-62.1-34.617723.1-34.9000113.4C107 M108 V113 R114C107-P110 WeakPolarHBondContact O-CD 3.35Å; M108-P110 VanDerWaalsContact C-CD 3.5Å; P110-V113 PolarHBondContact O-N 2.69Å; P110-R114 WeakPolarHBondContact O-CG 3.48Å; P110-R114 PolarHBondContact O-N 3.2Å; P110-R114 VanDerWaalsContact O-N 3.12Å
111V91.7Very high90.9Very high33 Ų3352.9 Ų52.920%0.226%0.258CS..Hα-helixtrans-65.7-43.5174.7177.80000110.1M108 F109 V113 R114 Q115 Y172 L175M108-V111 WeakPolarHBondContact O-CB 3.27Å; M108-V111 PolarHBondContact O-N 3.33Å; F109-V111 VanDerWaalsContact C-N 3.3Å; F109-V111 PolarHBondContact O-N 3.44Å; V111-V113 VanDerWaalsContact C-N 3.34Å; V111-V113 PolarHBondContact O-N 3.1Å; V111-R114 PolarHBondContact O-N 3.45Å; V111-Q115 PolarHBondContact O-N 2.81Å; V111-Y172 HydrophobicContact CG1-CD1 4.27Å; V111-L175 HydrophobicContact CG1-CD2 3.76Å; V111-L175 HydrophobicContact CG1-CG 4.45Å; V111-L175 HydrophobicContact CG2-CD2 4.17Å
112M89.2Confident90.2Very high27 Ų2756 Ų5613%0.13327%0.27CS..Hα-helixtrans-60.9-40.9176.4-172.366.5-174.400112.1M108 F109 Q115 R116M108-M112 PolarHBondContact O-N 3.42Å; F109-M112 WeakPolarHBondContact O-CB 3.31Å; F109-M112 PolarHBondContact O-N 3.02Å; F109-M112 VanDerWaalsContact O-N 3.14Å; M112-Q115 WeakPolarHBondContact O-CB 3.37Å; M112-Q115 PolarHBondContact O-N 3.1Å; M112-R116 HydrophobicContact CE-CG 4.41Å; M112-R116 WeakPolarHBondContact O-CG 3.4Å; M112-R116 PolarHBondContact O-N 3.43Å
113V91Very high89.5Confident13 Ų1353 Ų538%0.07926%0.255CS..Hα-helixtrans-62.3-43.4175.6173.50000111.2F109 P110 V111 R116 R117 L285 L294 L296F109-V113 HydrophobicContact CD1-CG2 4.18Å; F109-V113 HydrophobicContact CE1-CG2 3.78Å; F109-V113 HydrophobicContact CE2-CG2 4.29Å; F109-V113 HydrophobicContact CZ-CG2 3.85Å; F109-V113 WeakPolarHBondContact O-CG2 3.4Å; F109-V113 PolarHBondContact O-N 3.48Å; P110-V113 PolarHBondContact O-N 2.69Å; V111-V113 VanDerWaalsContact C-N 3.34Å; V111-V113 PolarHBondContact O-N 3.1Å; V113-R116 PolarHBondContact O-N 3.35Å; V113-R117 PolarHBondContact O-N 2.9Å; V113-L285 HydrophobicContact CG2-CD2 4.06Å; V113-L294 HydrophobicContact CG1-CB 4.37Å; V113-L294 HydrophobicContact CG1-CD1 4.01Å; V113-L294 HydrophobicContact CG1-CD2 4.47Å; V113-L294 HydrophobicContact CG2-CD1 3.9Å; V113-L296 HydrophobicContact CG1-CD2 4.18Å
114R89.2Confident88.9Confident153 Ų15352.1 Ų52.158%0.57725%0.251SS*.Hα-helixtrans-61.9-45.1174.6-68.8177.1-177.3-179.20.7111.3P110 V111 R116 R117 H118 Y172P110-R114 WeakPolarHBondContact O-CG 3.48Å; P110-R114 PolarHBondContact O-N 3.2Å; P110-R114 VanDerWaalsContact O-N 3.12Å; V111-R114 PolarHBondContact O-N 3.45Å; R114-R116 VanDerWaalsContact C-N 3.33Å; R114-R116 PolarHBondContact O-N 3.48Å; R114-R117 WeakPolarHBondContact O-CB 3.45Å; R114-R117 PolarHBondContact O-N 2.85Å; R114-H118 PolarHBondContact O-CD2 3.02Å; R114-H118 VanDerWaalsContact O-CD2 3.3Å; R114-H118 PolarHBondContact O-N 3.13Å; R114-H118 VanDerWaalsContact O-N 3.11Å; R114-Y172 HydrophobicContact CB-CD1 4.16Å; R114-Y172 HydrophobicContact CB-CE1 3.63Å
115Q87.8Confident88.4Confident35 Ų3551 Ų5116%0.16425%0.245CC..Hα-helixtrans-55.9-46.4175.7-176.4-179.6-4.100111.9V111 M112 R117 H118 L119 Y172V111-Q115 PolarHBondContact O-N 2.81Å; M112-Q115 WeakPolarHBondContact O-CB 3.37Å; M112-Q115 PolarHBondContact O-N 3.1Å; Q115-R117 PolarHBondContact O-N 2.77Å; Q115-H118 PolarHBondContact O-N 3.03Å; Q115-L119 WeakPolarHBondContact O-CB 3.35Å; Q115-L119 PolarHBondContact O-N 3.34Å; Q115-Y172 HydrophobicContact CB-CD2 4.49Å; Q115-Y172 HydrophobicContact CB-CG 4.12Å
116R86.5Confident88Confident35 Ų3551 Ų5113%0.13225%0.247CC..Hα-helixtrans-64.1-37.6177.7-70.1-68.4-166.5171.42112.9M112 V113 R114 L119 A120 E235 S282 L285M112-R116 HydrophobicContact CE-CG 4.41Å; M112-R116 WeakPolarHBondContact O-CG 3.4Å; M112-R116 PolarHBondContact O-N 3.43Å; V113-R116 PolarHBondContact O-N 3.35Å; R114-R116 VanDerWaalsContact C-N 3.33Å; R114-R116 PolarHBondContact O-N 3.48Å; R116-L119 PolarHBondContact O-N 2.89Å; R116-A120 WeakPolarHBondContact O-CB 3.28Å; R116-A120 PolarHBondContact O-N 3.3Å; R116-E235 IonicContact CZ-OE2 3.24Å; R116-E235 IonicContact NH1-OE2 3.21Å; R116-E235 PolarHBondContact NH1-OE2 3.48Å; R116-S282 PolarHBondContact NH2-OG 3.21Å; R116-L285 HydrophobicContact CG-CD1 4.17Å
117R87.6Confident87.5Confident88 Ų8846.4 Ų46.433%0.33223%0.226SC..Hα-helixtrans-59.6-51.8175.1-179.6174.9-66162.31.2111.1V113 R114 Q115 L119 A120 E121 L294 L296 P297V113-R117 PolarHBondContact O-N 2.9Å; R114-R117 WeakPolarHBondContact O-CB 3.45Å; R114-R117 PolarHBondContact O-N 2.85Å; Q115-R117 PolarHBondContact O-N 2.77Å; R117-L119 VanDerWaalsContact C-N 3.33Å; R117-L119 PolarHBondContact O-N 3.28Å; R117-A120 PolarHBondContact O-N 3.44Å; R117-E121 WeakPolarHBondContact CG-OE1 3.26Å; R117-E121 PolarHBondContact O-N 2.9Å; R117-E121 VanDerWaalsContact O-N 3.08Å; R117-L294 PolarHBondContact NH2-O 3.21Å; R117-L296 HydrophobicContact CB-CD2 3.96Å; R117-P297 HydrophobicContact CG-CG 4.12Å
118H85.1Confident87.1Confident58 Ų5846.6 Ų46.627%0.26922%0.218SC..Hα-helixtrans-64.1-37.3178.6-80.8-94.6000112.6R114 Q115 E121 Y122 Y172R114-H118 PolarHBondContact O-CD2 3.02Å; R114-H118 VanDerWaalsContact O-CD2 3.3Å; R114-H118 PolarHBondContact O-N 3.13Å; R114-H118 VanDerWaalsContact O-N 3.11Å; Q115-H118 PolarHBondContact O-N 3.03Å; H118-E121 PolarHBondContact O-N 3.46Å; H118-Y122 WeakPolarHBondContact O-CB 3.38Å; H118-Y122 PolarHBondContact O-N 2.91Å; H118-Y172 HydrophobicContact CB-CD2 4.48Å; H118-Y172 HydrophobicContact CB-CE2 4.16Å; H118-Y172 AromaticContact CD2-CE2 3.17Å; H118-Y172 WeakPolarHBondContact CD2-CE2 3.33Å; H118-Y172 AromaticContact CD2-CZ 3.58Å; H118-Y172 PolarHBondContact CD2-OH 2.96Å; H118-Y172 AromaticContact CG-CE2 3.57Å; H118-Y172 AromaticContact NE2-CE2 3.47Å; H118-Y172 WeakPolarHBondContact NE2-CE2 3.47Å; H118-Y172 AromaticContact NE2-CZ 3.58Å; H118-Y172 PolarHBondContact NE2-OH 3.24Å
119L85Confident86.9Confident52 Ų5246.2 Ų46.227%0.27222%0.217SC..Hα-helixtrans-65.5-41.4177.1-174.952.2000111.6Q115 R116 R117 Y122 T123 E235Q115-L119 WeakPolarHBondContact O-CB 3.35Å; Q115-L119 PolarHBondContact O-N 3.34Å; R116-L119 PolarHBondContact O-N 2.89Å; R117-L119 VanDerWaalsContact C-N 3.33Å; R117-L119 PolarHBondContact O-N 3.28Å; L119-Y122 HydrophobicContact CD1-CD1 4.46Å; L119-Y122 PolarHBondContact O-N 3.26Å; L119-T123 WeakPolarHBondContact O-CB 3.36Å; L119-T123 PolarHBondContact O-N 3.32Å; L119-T123 PolarHBondContact O-OG1 3.41Å; L119-E235 HydrophobicContact CD2-CB 4.26Å; L119-E235 VanDerWaalsContact CD2-CD 3.5Å; L119-E235 HydrophobicContact CD2-CG 4.28Å; L119-E235 WeakPolarHBondContact CD2-OE2 3.18Å; L119-E235 HydrophobicContact CG-CB 4.16Å; L119-E235 HydrophobicContact CG-CG 3.98Å
120A84.7Confident86.5Confident0 Ų044.5 Ų44.50%021%0.211CC..Hα-helixtrans-65.5-38.3175.600000113.2R116 R117 N124 P297 V299R116-A120 WeakPolarHBondContact O-CB 3.28Å; R116-A120 PolarHBondContact O-N 3.3Å; R117-A120 PolarHBondContact O-N 3.44Å; A120-N124 VanDerWaalsContact O-CG 3.26Å; A120-N124 PolarHBondContact O-N 3.5Å; A120-N124 PolarHBondContact O-ND2 3.02Å; A120-P297 HydrophobicContact CB-CG 3.88Å; A120-V299 HydrophobicContact CB-CG2 3.89Å
121E83.8Confident86.3Confident71 Ų7145.1 Ų45.133%0.33221%0.214SC..Hα-helixtrans-61.1-49.2171.2-71.9164.3-165.200111.1R117 H118 T123 N124 I125 P297R117-E121 WeakPolarHBondContact CG-OE1 3.26Å; R117-E121 PolarHBondContact O-N 2.9Å; R117-E121 VanDerWaalsContact O-N 3.08Å; H118-E121 PolarHBondContact O-N 3.46Å; E121-T123 PolarHBondContact O-N 3.45Å; E121-N124 WeakPolarHBondContact O-CB 3.29Å; E121-N124 PolarHBondContact O-N 2.77Å; E121-N124 VanDerWaalsContact O-N 3.11Å; E121-I125 WeakPolarHBondContact O-CD1 3.3Å; E121-I125 PolarHBondContact O-N 3.09Å; E121-P297 HydrophobicContact CG-CG 3.97Å
122Y84.1Confident86.3Confident67 Ų6745.1 Ų45.126%0.26321%0.212SC..Hα-helixtrans-57.8-47.2177.1180-94.9000112.3H118 L119 N124 I125 I126 L164 T169H118-Y122 WeakPolarHBondContact O-CB 3.38Å; H118-Y122 PolarHBondContact O-N 2.91Å; L119-Y122 HydrophobicContact CD1-CD1 4.46Å; L119-Y122 PolarHBondContact O-N 3.26Å; Y122-N124 PolarHBondContact O-N 3.35Å; Y122-I125 PolarHBondContact O-N 3.31Å; Y122-I125 VanDerWaalsContact O-N 3.14Å; Y122-I126 HydrophobicContact CE1-CB 4.3Å; Y122-I126 HydrophobicContact CE1-CD1 4.08Å; Y122-I126 HydrophobicContact CE1-CG1 4.12Å; Y122-I126 HydrophobicContact CE2-CD1 4.17Å; Y122-I126 WeakPolarHBondContact O-CB 3.36Å; Y122-I126 PolarHBondContact O-N 3.42Å; Y122-I126 VanDerWaalsContact OH-CD1 3.27Å; Y122-I126 WeakPolarHBondContact OH-CD1 3.47Å; Y122-L164 HydrophobicContact CD2-CD1 4.09Å; Y122-L164 HydrophobicContact CD2-CD2 4.33Å; Y122-T169 HydrophobicContact CD2-CG2 4.25Å; Y122-T169 HydrophobicContact CG-CG2 4.14Å
123T82.4Confident86.3Confident9 Ų948.4 Ų48.46%0.05523%0.227CC..Hα-helixtrans-59.8-28.9177.4-58.70000112.6L119 E121 P127 V299L119-T123 WeakPolarHBondContact O-CB 3.36Å; L119-T123 PolarHBondContact O-N 3.32Å; L119-T123 PolarHBondContact O-OG1 3.41Å; E121-T123 PolarHBondContact O-N 3.45Å; T123-P127 WeakPolarHBondContact O-CD 3.44Å; T123-V299 HydrophobicContact CG2-CG1 3.66Å
124N83.8Confident86.1Confident29 Ų2952.6 Ų52.616%0.15525%0.246CC..Hα-helixtrans-74.9-25.8178.8-74.3-26000113.8A120 E121 Y122 S298 V299 R300A120-N124 VanDerWaalsContact O-CG 3.26Å; A120-N124 PolarHBondContact O-N 3.5Å; A120-N124 PolarHBondContact O-ND2 3.02Å; E121-N124 WeakPolarHBondContact O-CB 3.29Å; E121-N124 PolarHBondContact O-N 2.77Å; E121-N124 VanDerWaalsContact O-N 3.11Å; Y122-N124 PolarHBondContact O-N 3.35Å; N124-S298 PolarHBondContact ND2-O 3.36Å; N124-S298 PolarHBondContact OD1-O 2.88Å; N124-V299 WeakPolarHBondContact OD1-CA 3.48Å; N124-R300 PolarHBondContact OD1-N 2.94Å
125I85.2Confident86.2Confident13 Ų1346.8 Ų46.87%0.06723%0.229CC..Hα-helixtrans-103.9-29.9-173.4-61.9149.6000111.5E121 Y122 P127 Q128 V129 L158 N162 L164E121-I125 WeakPolarHBondContact O-CD1 3.3Å; E121-I125 PolarHBondContact O-N 3.09Å; Y122-I125 PolarHBondContact O-N 3.31Å; Y122-I125 VanDerWaalsContact O-N 3.14Å; I125-P127 VanDerWaalsContact C-N 3.25Å; I125-P127 VanDerWaalsContact O-N 3.09Å; I125-Q128 WeakPolarHBondContact O-CB 3.39Å; I125-Q128 PolarHBondContact O-N 3.49Å; I125-V129 HydrophobicContact CG2-CG2 4.2Å; I125-V129 PolarHBondContact O-N 3.11Å; I125-L158 HydrophobicContact CG2-CD2 4.38Å; I125-L158 HydrophobicContact CG2-CG 4.26Å; I125-N162 HydrophobicContact CD1-CB 3.31Å; I125-N162 VanDerWaalsContact CD1-CG 3.46Å; I125-N162 WeakPolarHBondContact CD1-OD1 3.35Å; I125-N162 HydrophobicContact CG1-CB 4.16Å; I125-N162 HydrophobicContact CG2-CB 4.47Å; I125-L164 HydrophobicContact CB-CD1 3.6Å; I125-L164 HydrophobicContact CD1-CD1 3.52Å; I125-L164 HydrophobicContact CD1-CD2 4.05Å; I125-L164 HydrophobicContact CD1-CG 3.79Å; I125-L164 HydrophobicContact CG1-CD1 4.2Å; I125-L164 HydrophobicContact CG2-CD1 3.54Å
126I85Confident86.3Confident28 Ų2846.8 Ų46.814%0.14423%0.23CC..Hα-helixtrans-48.4-35.8178.7-157.359.2000114.6Y122 Q128 V129 T130Y122-I126 HydrophobicContact CE1-CB 4.3Å; Y122-I126 HydrophobicContact CE1-CD1 4.08Å; Y122-I126 HydrophobicContact CE1-CG1 4.12Å; Y122-I126 HydrophobicContact CE2-CD1 4.17Å; Y122-I126 WeakPolarHBondContact O-CB 3.36Å; Y122-I126 PolarHBondContact O-N 3.42Å; Y122-I126 VanDerWaalsContact OH-CD1 3.27Å; Y122-I126 WeakPolarHBondContact OH-CD1 3.47Å; I126-Q128 PolarHBondContact O-N 2.93Å; I126-V129 HydrophobicContact CD1-CB 4.16Å; I126-V129 HydrophobicContact CD1-CG1 4.06Å; I126-V129 CarbonylContact O-C 3.55Å; I126-V129 WeakPolarHBondContact O-CB 3.32Å; I126-V129 PolarHBondContact O-N 3.29Å; I126-T130 WeakPolarHBondContact O-CG2 3.38Å; I126-T130 PolarHBondContact O-N 3.31Å; I126-T130 PolarHBondContact O-OG1 2.91Å
127P83.2Confident86.4Confident17 Ų1747.6 Ų47.611%0.1124%0.239CC..Hα-helixtrans-55.7-43.6170.111.1-28.4000116.7T123 I125 V129 T130 V131 Q240T123-P127 WeakPolarHBondContact O-CD 3.44Å; I125-P127 VanDerWaalsContact C-N 3.25Å; I125-P127 VanDerWaalsContact O-N 3.09Å; P127-V129 VanDerWaalsContact C-N 3.25Å; P127-V129 PolarHBondContact O-N 3.44Å; P127-T130 VanDerWaalsContact CA-OG1 3.3Å; P127-T130 WeakPolarHBondContact CA-OG1 3.45Å; P127-T130 PolarHBondContact O-N 3.18Å; P127-T130 PolarHBondContact O-OG1 2.93Å; P127-V131 WeakPolarHBondContact O-CG2 3.25Å; P127-V131 PolarHBondContact O-N 3.02Å; P127-Q240 HydrophobicContact CB-CG 4.39Å; P127-Q240 VanDerWaalsContact CB-NE2 3.32Å
128Q87Confident86.5Confident93 Ų9350.4 Ų50.444%0.43525%0.249SC..Hα-helixtrans-68.2-37.1-178.9-64.417845.900109.4I125 I126 V131 L132 L158I125-Q128 WeakPolarHBondContact O-CB 3.39Å; I125-Q128 PolarHBondContact O-N 3.49Å; I126-Q128 PolarHBondContact O-N 2.93Å; Q128-V131 PolarHBondContact O-N 3.4Å; Q128-L132 WeakPolarHBondContact O-CG 3.28Å; Q128-L132 PolarHBondContact O-N 3.44Å; Q128-L158 HydrophobicContact CB-CD2 3.56Å
129V87.5Confident86.7Confident15 Ų1547.7 Ų47.79%0.09124%0.237CC..Hα-helixtrans-61.7-44.3170.3173.30000110.7I125 I126 P127 V131 L132 Q133 M155 L158 M159I125-V129 HydrophobicContact CG2-CG2 4.2Å; I125-V129 PolarHBondContact O-N 3.11Å; I126-V129 HydrophobicContact CD1-CB 4.16Å; I126-V129 HydrophobicContact CD1-CG1 4.06Å; I126-V129 CarbonylContact O-C 3.55Å; I126-V129 WeakPolarHBondContact O-CB 3.32Å; I126-V129 PolarHBondContact O-N 3.29Å; P127-V129 VanDerWaalsContact C-N 3.25Å; P127-V129 PolarHBondContact O-N 3.44Å; V129-V131 PolarHBondContact O-N 2.96Å; V129-L132 PolarHBondContact O-N 3.26Å; V129-Q133 VanDerWaalsContact O-CB 3.3Å; V129-Q133 WeakPolarHBondContact O-CB 3.38Å; V129-Q133 PolarHBondContact O-N 2.98Å; V129-M155 HydrophobicContact CB-SD 3.93Å; V129-M155 HydrophobicContact CG1-CE 4Å; V129-M155 HydrophobicContact CG1-SD 3.63Å; V129-M155 HydrophobicContact CG2-SD 4.01Å; V129-M155 WeakPolarHBondContact O-CE 3.1Å; V129-L158 HydrophobicContact CG2-CD2 3.86Å; V129-M159 HydrophobicContact CG2-CG 4.48Å; V129-M159 HydrophobicContact CG2-SD 3.62Å
130T85Confident86.8Confident25 Ų2551.4 Ų51.415%0.15325%0.247CC..Hα-helixtrans-63.9-38.6179.151.40000112.8I126 P127 Q133 E134I126-T130 WeakPolarHBondContact O-CG2 3.38Å; I126-T130 PolarHBondContact O-N 3.31Å; I126-T130 PolarHBondContact O-OG1 2.91Å; P127-T130 VanDerWaalsContact CA-OG1 3.3Å; P127-T130 WeakPolarHBondContact CA-OG1 3.45Å; P127-T130 PolarHBondContact O-N 3.18Å; P127-T130 PolarHBondContact O-OG1 2.93Å; T130-Q133 PolarHBondContact O-N 3.42Å; T130-E134 PolarHBondContact O-N 2.8Å
131V88.1Confident87Confident87 Ų8754.1 Ų54.153%0.52726%0.262SS..Hα-helixtrans-65.6-43.8176.7172.30000111.4P127 Q128 V129 Q133 E134 S135P127-V131 WeakPolarHBondContact O-CG2 3.25Å; P127-V131 PolarHBondContact O-N 3.02Å; Q128-V131 PolarHBondContact O-N 3.4Å; V129-V131 PolarHBondContact O-N 2.96Å; V131-Q133 VanDerWaalsContact C-N 3.28Å; V131-Q133 PolarHBondContact O-N 2.96Å; V131-E134 PolarHBondContact O-N 3.25Å; V131-S135 WeakPolarHBondContact O-CB 3.43Å; V131-S135 PolarHBondContact O-N 2.84Å; V131-S135 PolarHBondContact O-OG 3.05Å
132L91.1Very high87.2Confident32 Ų3254.4 Ų54.417%0.16827%0.271CS..Hα-helixtrans-65.5-33.3174.8-72.3174.1000111.5Q128 V129 S135 L136 T151 K154 M155 L158Q128-L132 WeakPolarHBondContact O-CG 3.28Å; Q128-L132 PolarHBondContact O-N 3.44Å; V129-L132 PolarHBondContact O-N 3.26Å; L132-S135 PolarHBondContact O-N 3.42Å; L132-L136 VanDerWaalsContact O-CB 3.3Å; L132-L136 WeakPolarHBondContact O-CB 3.47Å; L132-L136 PolarHBondContact O-N 2.99Å; L132-T151 HydrophobicContact CB-CG2 4.49Å; L132-T151 HydrophobicContact CD2-CG2 4.18Å; L132-T151 VanDerWaalsContact O-CG2 3.29Å; L132-T151 WeakPolarHBondContact O-CG2 3.5Å; L132-K154 HydrophobicContact CD1-CB 4.44Å; L132-K154 HydrophobicContact CD2-CB 4.15Å; L132-K154 HydrophobicContact CD2-CD 4.49Å; L132-M155 HydrophobicContact CB-CE 3.38Å; L132-M155 HydrophobicContact CB-SD 3.77Å; L132-M155 HydrophobicContact CD1-CB 4.34Å; L132-M155 HydrophobicContact CD1-SD 3.99Å; L132-L158 HydrophobicContact CD1-CB 4.36Å; L132-L158 HydrophobicContact CD1-CD2 3.74Å
133Q88.2Confident87.2Confident96 Ų9653.8 Ų53.845%0.44929%0.285SS..Hα-helixtrans-69.6-41.5178-175.6173.9-1.300111.3V129 T130 V131 L136 T137 M155V129-Q133 VanDerWaalsContact O-CB 3.3Å; V129-Q133 WeakPolarHBondContact O-CB 3.38Å; V129-Q133 PolarHBondContact O-N 2.98Å; T130-Q133 PolarHBondContact O-N 3.42Å; V131-Q133 VanDerWaalsContact C-N 3.28Å; V131-Q133 PolarHBondContact O-N 2.96Å; Q133-L136 PolarHBondContact O-N 3.04Å; Q133-T137 PolarHBondContact O-N 2.95Å; Q133-T137 PolarHBondContact O-OG1 2.78Å; Q133-T137 VanDerWaalsContact O-OG1 3.1Å; Q133-M155 HydrophobicContact CB-CE 3.93Å; Q133-M155 VanDerWaalsContact N-CE 3.34Å
134E88.1Confident87.5Confident102 Ų10256.5 Ų56.548%0.47730%0.299SS..Hα-helixtrans-62.3-43.7171.6-73.4-178.4-162.600111.9T130 V131 L136 T137 R138T130-E134 PolarHBondContact O-N 2.8Å; V131-E134 PolarHBondContact O-N 3.25Å; E134-L136 VanDerWaalsContact C-N 3.32Å; E134-L136 PolarHBondContact O-N 3.31Å; E134-T137 PolarHBondContact O-N 2.93Å; E134-R138 WeakPolarHBondContact O-CG 3.32Å; E134-R138 PolarHBondContact O-N 3.17Å; E134-R138 IonicContact OE2-NH2 2.99Å; E134-R138 PolarHBondContact OE2-NH2 3.15Å
135S90.5Very high87.7Confident30 Ų3061.7 Ų61.721%0.2132%0.318CS..Hα-helixtrans-62.7-41.1177.9-54.90000111.1V131 L132 T137 R138 A139V131-S135 WeakPolarHBondContact O-CB 3.43Å; V131-S135 PolarHBondContact O-N 2.84Å; V131-S135 PolarHBondContact O-OG 3.05Å; L132-S135 PolarHBondContact O-N 3.42Å; S135-T137 PolarHBondContact O-N 2.86Å; S135-R138 PolarHBondContact O-N 3.42Å; S135-A139 WeakPolarHBondContact O-CB 3.37Å; S135-A139 PolarHBondContact O-N 3.21Å
136L91.1Very high88.1Confident35 Ų3566.3 Ų66.318%0.18335%0.347CS..Hα-helixtrans-62.4-43.4175.4-17469.4000111.2L132 Q133 E134 A139 R140 M148 T151L132-L136 VanDerWaalsContact O-CB 3.3Å; L132-L136 WeakPolarHBondContact O-CB 3.47Å; L132-L136 PolarHBondContact O-N 2.99Å; Q133-L136 PolarHBondContact O-N 3.04Å; E134-L136 VanDerWaalsContact C-N 3.32Å; E134-L136 PolarHBondContact O-N 3.31Å; L136-A139 PolarHBondContact O-N 3.28Å; L136-R140 VanDerWaalsContact O-CB 3.31Å; L136-R140 WeakPolarHBondContact O-CB 3.48Å; L136-R140 PolarHBondContact O-N 3.41Å; L136-M148 HydrophobicContact CD1-CB 4.47Å; L136-M148 HydrophobicContact CD1-CG 3.68Å; L136-M148 VanDerWaalsContact CD1-O 3.32Å; L136-M148 WeakPolarHBondContact CD1-O 3.39Å; L136-T151 HydrophobicContact CB-CG2 3.97Å; L136-T151 HydrophobicContact CD1-CG2 4.45Å
137T87.5Confident88.5Confident52 Ų5268.8 Ų68.832%0.31936%0.358SS..Hα-helixtrans-63.2-41.9175.6-61.50000111.7Q133 E134 S135 R140 L141Q133-T137 PolarHBondContact O-N 2.95Å; Q133-T137 PolarHBondContact O-OG1 2.78Å; Q133-T137 VanDerWaalsContact O-OG1 3.1Å; E134-T137 PolarHBondContact O-N 2.93Å; S135-T137 PolarHBondContact O-N 2.86Å; T137-R140 WeakPolarHBondContact O-CB 3.48Å; T137-R140 PolarHBondContact O-N 3.44Å; T137-L141 HydrophobicContact CG2-CD1 4.03Å; T137-L141 HydrophobicContact CG2-CG 4.4Å; T137-L141 VanDerWaalsContact O-CG 3.31Å; T137-L141 WeakPolarHBondContact O-CG 3.31Å; T137-L141 PolarHBondContact O-N 3.2Å
138R89.4Confident89Confident148 Ų14869.8 Ų69.856%0.55836%0.361SS*.Hα-helixtrans-63.4-47.9176.4-70.3177.6-159.8151.110.5111.9E134 S135 R140 L141 S142E134-R138 WeakPolarHBondContact O-CG 3.32Å; E134-R138 PolarHBondContact O-N 3.17Å; E134-R138 IonicContact OE2-NH2 2.99Å; E134-R138 PolarHBondContact OE2-NH2 3.15Å; S135-R138 PolarHBondContact O-N 3.42Å; R138-R140 VanDerWaalsContact C-N 3.25Å; R138-R140 PolarHBondContact O-N 3.26Å; R138-L141 PolarHBondContact O-N 2.85Å; R138-S142 WeakPolarHBondContact O-CB 3.42Å; R138-S142 PolarHBondContact O-N 3.07Å; R138-S142 PolarHBondContact O-OG 3.12Å
139A91.1Very high89.3Confident1 Ų169.8 Ų69.81%0.00836%0.362CS..Hα-helixtrans-57-42.9176.600000111.1S135 L136 S142 G143 N144 E147 M148S135-A139 WeakPolarHBondContact O-CB 3.37Å; S135-A139 PolarHBondContact O-N 3.21Å; L136-A139 PolarHBondContact O-N 3.28Å; A139-S142 WeakPolarHBondContact CA-OG 3.48Å; A139-S142 PolarHBondContact O-N 2.91Å; A139-S142 PolarHBondContact O-OG 3.1Å; A139-G143 PolarHBondContact O-N 3.33Å; A139-N144 PolarHBondContact O-N 2.88Å; A139-N144 VanDerWaalsContact O-N 3.09Å; A139-E147 HydrophobicContact CB-CB 3.98Å; A139-E147 HydrophobicContact CB-CG 3.82Å; A139-M148 HydrophobicContact CB-CB 4.12Å
140R87.1Confident89.7Confident129 Ų12977 Ų7749%0.48739%0.388SS..Hα-helixtrans-63.2-47.3176.8-160.9173.4-143.315112.8113L136 T137 R138 S142 G143 M148 L326 L329L136-R140 VanDerWaalsContact O-CB 3.31Å; L136-R140 WeakPolarHBondContact O-CB 3.48Å; L136-R140 PolarHBondContact O-N 3.41Å; T137-R140 WeakPolarHBondContact O-CB 3.48Å; T137-R140 PolarHBondContact O-N 3.44Å; R138-R140 VanDerWaalsContact C-N 3.25Å; R138-R140 PolarHBondContact O-N 3.26Å; R140-S142 VanDerWaalsContact C-N 3.26Å; R140-S142 PolarHBondContact O-N 2.8Å; R140-G143 PolarHBondContact O-N 2.96Å; R140-M148 HydrophobicContact CG-SD 4.42Å; R140-L326 HydrophobicContact CB-CD2 4.15Å; R140-L326 HydrophobicContact CG-CD2 3.42Å; R140-L326 VanDerWaalsContact CG-CD2 3.42Å; R140-L329 VanDerWaalsContact O-CD1 3.3Å; R140-L329 WeakPolarHBondContact O-CD1 3.36Å
141L87.1Confident90.2Very high58 Ų5876.3 Ų76.330%0.30438%0.384SS..Hα-helixtrans-65-30.4177.4-70.3173.3000112.5T137 R138 G143 L325 L326T137-L141 HydrophobicContact CG2-CD1 4.03Å; T137-L141 HydrophobicContact CG2-CG 4.4Å; T137-L141 VanDerWaalsContact O-CG 3.31Å; T137-L141 WeakPolarHBondContact O-CG 3.31Å; T137-L141 PolarHBondContact O-N 3.2Å; R138-L141 PolarHBondContact O-N 2.85Å; L141-G143 VanDerWaalsContact C-N 3.32Å; L141-L325 HydrophobicContact CD2-CB 3.88Å; L141-L325 HydrophobicContact CD2-CD1 4.19Å; L141-L326 HydrophobicContact CD2-CD2 4.16Å; L141-L326 HydrophobicContact CD2-CG 4.28Å
142S87.9Confident90.4Very high77 Ų7774.9 Ų74.954%0.53838%0.378SS..THydrogen-bonded Turntrans-79.9-7.7176.470.10000114.6R138 A139 R140 N144R138-S142 WeakPolarHBondContact O-CB 3.42Å; R138-S142 PolarHBondContact O-N 3.07Å; R138-S142 PolarHBondContact O-OG 3.12Å; A139-S142 WeakPolarHBondContact CA-OG 3.48Å; A139-S142 PolarHBondContact O-N 2.91Å; A139-S142 PolarHBondContact O-OG 3.1Å; R140-S142 VanDerWaalsContact C-N 3.26Å; R140-S142 PolarHBondContact O-N 2.8Å; S142-N144 PolarHBondContact O-N 3.46Å; S142-N144 WeakPolarHBondContact OG-CB 3.34Å; S142-N144 PolarHBondContact OG-N 2.94Å
143G84.6Confident90.6Very high54 Ų5478.9 Ų78.956%0.55740%0.395SS*.THydrogen-bonded Turntrans69.89.4-172.400000114.4A139 R140 L141 Y145A139-G143 PolarHBondContact O-N 3.33Å; R140-G143 PolarHBondContact O-N 2.96Å; L141-G143 VanDerWaalsContact C-N 3.32Å; G143-Y145 PolarHBondContact O-N 3.34Å
144N89.8Confident90.9Very high65 Ų6579 Ų7935%0.34839%0.394SS..  trans-7987.5-179.7-171-11.5000111.2A139 S142 V146 E147 M148A139-N144 PolarHBondContact O-N 2.88Å; A139-N144 VanDerWaalsContact O-N 3.09Å; S142-N144 PolarHBondContact O-N 3.46Å; S142-N144 WeakPolarHBondContact OG-CB 3.34Å; S142-N144 PolarHBondContact OG-N 2.94Å; N144-V146 VanDerWaalsContact C-N 3.32Å; N144-V146 PolarHBondContact O-N 3.09Å; N144-V146 PolarHBondContact OD1-N 3.43Å; N144-E147 HydrophobicContact CB-CB 4.12Å; N144-E147 VanDerWaalsContact CG-CB 3.48Å; N144-E147 WeakPolarHBondContact ND2-CB 3.41Å; N144-E147 PolarHBondContact ND2-OE2 3.22Å; N144-E147 VanDerWaalsContact ND2-OE2 3.08Å; N144-E147 PolarHBondContact O-N 3.1Å; N144-E147 PolarHBondContact OD1-N 3.18Å; N144-M148 WeakPolarHBondContact O-CB 3.48Å; N144-M148 PolarHBondContact O-N 2.85Å
145Y88.5Confident91.1Very high138 Ų13875.5 Ų75.554%0.54138%0.379SS..Hα-helixtrans-59.5-39.2-178.4-173-94.8000113.2G143 M148 M149G143-Y145 PolarHBondContact O-N 3.34Å; Y145-M148 HydrophobicContact CD2-CE 3.48Å; Y145-M148 VanDerWaalsContact CD2-CE 3.48Å; Y145-M148 HydrophobicContact CE2-CE 3.56Å; Y145-M148 HydrophobicContact CG-CE 4.34Å; Y145-M148 PolarHBondContact O-N 3.07Å; Y145-M149 HydrophobicContact CD1-CG 4.01Å; Y145-M149 HydrophobicContact CE1-CG 3.56Å; Y145-M149 HydrophobicContact CE1-SD 4.42Å; Y145-M149 HydrophobicContact CE2-CG 4.39Å; Y145-M149 WeakPolarHBondContact O-CG 3.33Å; Y145-M149 PolarHBondContact O-N 3.45Å
146V93.1Very high91.2Very high111 Ų11176.5 Ų76.567%0.67339%0.386SS*.Hα-helixtrans-65.4-44.3-178.5179.90000110.8N144 M149 R150N144-V146 VanDerWaalsContact C-N 3.32Å; N144-V146 PolarHBondContact O-N 3.09Å; N144-V146 PolarHBondContact OD1-N 3.43Å; V146-M149 PolarHBondContact O-N 3.29Å; V146-R150 WeakPolarHBondContact O-CB 3.43Å; V146-R150 PolarHBondContact O-N 3.24Å
147E93.9Very high91.3Very high80 Ų8079 Ų7937%0.37440%0.397SS..Hα-helixtrans-68.2-38.1176.8-173.4-179.5179.400112A139 N144 R150 T151A139-E147 HydrophobicContact CB-CB 3.98Å; A139-E147 HydrophobicContact CB-CG 3.82Å; N144-E147 HydrophobicContact CB-CB 4.12Å; N144-E147 VanDerWaalsContact CG-CB 3.48Å; N144-E147 WeakPolarHBondContact ND2-CB 3.41Å; N144-E147 PolarHBondContact ND2-OE2 3.22Å; N144-E147 VanDerWaalsContact ND2-OE2 3.08Å; N144-E147 PolarHBondContact O-N 3.1Å; N144-E147 PolarHBondContact OD1-N 3.18Å; E147-R150 PolarHBondContact O-N 3.26Å; E147-T151 VanDerWaalsContact O-CB 3.26Å; E147-T151 WeakPolarHBondContact O-CB 3.47Å; E147-T151 PolarHBondContact O-N 2.82Å; E147-T151 PolarHBondContact O-OG1 2.89Å
148M92.1Very high91.5Very high37 Ų3777.7 Ų77.718%0.18239%0.387CS..Hα-helixtrans-59.1-49.7175.1-178.1-171.468.400110.8L136 A139 R140 N144 Y145 T151 S152L136-M148 HydrophobicContact CD1-CB 4.47Å; L136-M148 HydrophobicContact CD1-CG 3.68Å; L136-M148 VanDerWaalsContact CD1-O 3.32Å; L136-M148 WeakPolarHBondContact CD1-O 3.39Å; A139-M148 HydrophobicContact CB-CB 4.12Å; R140-M148 HydrophobicContact CG-SD 4.42Å; N144-M148 WeakPolarHBondContact O-CB 3.48Å; N144-M148 PolarHBondContact O-N 2.85Å; Y145-M148 HydrophobicContact CD2-CE 3.48Å; Y145-M148 VanDerWaalsContact CD2-CE 3.48Å; Y145-M148 HydrophobicContact CE2-CE 3.56Å; Y145-M148 HydrophobicContact CG-CE 4.34Å; Y145-M148 PolarHBondContact O-N 3.07Å; M148-T151 PolarHBondContact O-N 3.44Å; M148-S152 VanDerWaalsContact O-CB 3.29Å; M148-S152 WeakPolarHBondContact O-CB 3.4Å; M148-S152 PolarHBondContact O-N 3.33Å
149M93.9Very high91.5Very high94 Ų9472.2 Ų72.246%0.46337%0.368SS..Hα-helixtrans-63.1-46.5179-71.9-63.3-8300111.7Y145 V146 T151 S152 E153Y145-M149 HydrophobicContact CD1-CG 4.01Å; Y145-M149 HydrophobicContact CE1-CG 3.56Å; Y145-M149 HydrophobicContact CE1-SD 4.42Å; Y145-M149 HydrophobicContact CE2-CG 4.39Å; Y145-M149 WeakPolarHBondContact O-CG 3.33Å; Y145-M149 PolarHBondContact O-N 3.45Å; V146-M149 PolarHBondContact O-N 3.29Å; M149-T151 VanDerWaalsContact C-N 3.31Å; M149-T151 PolarHBondContact O-N 3.03Å; M149-S152 PolarHBondContact O-N 3.45Å; M149-E153 WeakPolarHBondContact O-CB 3.42Å; M149-E153 PolarHBondContact O-N 2.94Å
150R95.3Very high91.3Very high165 Ų16579.1 Ų79.162%0.62340%0.398SS*.Hα-helixtrans-60.5-40.1177.4-171.4-179.5-176.689.5-1.8112.2V146 E147 K154V146-R150 WeakPolarHBondContact O-CB 3.43Å; V146-R150 PolarHBondContact O-N 3.24Å; E147-R150 PolarHBondContact O-N 3.26Å; R150-K154 VanDerWaalsContact O-CG 3.31Å; R150-K154 WeakPolarHBondContact O-CG 3.36Å; R150-K154 PolarHBondContact O-N 2.87Å
151T95Very high91.5Very high11 Ų1179 Ų797%0.06741%0.407CS..Hα-helixtrans-72.8-40.3179.6-56.60000111.6L132 L136 E147 M148 M149 E153 K154 M155L132-T151 HydrophobicContact CB-CG2 4.49Å; L132-T151 HydrophobicContact CD2-CG2 4.18Å; L132-T151 VanDerWaalsContact O-CG2 3.29Å; L132-T151 WeakPolarHBondContact O-CG2 3.5Å; L136-T151 HydrophobicContact CB-CG2 3.97Å; L136-T151 HydrophobicContact CD1-CG2 4.45Å; E147-T151 VanDerWaalsContact O-CB 3.26Å; E147-T151 WeakPolarHBondContact O-CB 3.47Å; E147-T151 PolarHBondContact O-N 2.82Å; E147-T151 PolarHBondContact O-OG1 2.89Å; M148-T151 PolarHBondContact O-N 3.44Å; M149-T151 VanDerWaalsContact C-N 3.31Å; M149-T151 PolarHBondContact O-N 3.03Å; T151-E153 VanDerWaalsContact C-N 3.33Å; T151-E153 PolarHBondContact O-N 3.29Å; T151-K154 PolarHBondContact O-N 3.47Å; T151-M155 WeakPolarHBondContact O-CB 3.37Å; T151-M155 PolarHBondContact O-N 2.85Å
152S93.6Very high91.5Very high58 Ų5879.3 Ų79.341%0.40641%0.409SS..Hα-helixtrans-60.3-43.2173.8-174.50000111.5M148 M149 M155 S156M148-S152 VanDerWaalsContact O-CB 3.29Å; M148-S152 WeakPolarHBondContact O-CB 3.4Å; M148-S152 PolarHBondContact O-N 3.33Å; M149-S152 PolarHBondContact O-N 3.45Å; S152-M155 WeakPolarHBondContact O-CB 3.45Å; S152-M155 PolarHBondContact O-N 2.91Å; S152-S156 PolarHBondContact O-N 3.46Å
153E95.3Very high91.2Very high115 Ų11582 Ų8254%0.53742%0.418SS..Hα-helixtrans-65.7-46.5176.5-179.7161.9-168.800112.1M149 T151 M155 S156 Q157M149-E153 WeakPolarHBondContact O-CB 3.42Å; M149-E153 PolarHBondContact O-N 2.94Å; T151-E153 VanDerWaalsContact C-N 3.33Å; T151-E153 PolarHBondContact O-N 3.29Å; E153-M155 PolarHBondContact O-N 2.86Å; E153-S156 WeakPolarHBondContact O-CB 3.17Å; E153-S156 PolarHBondContact O-N 3.49Å; E153-S156 VanDerWaalsContact O-N 3.1Å; E153-Q157 HydrophobicContact CG-CG 4.2Å; E153-Q157 WeakPolarHBondContact O-CB 3.24Å; E153-Q157 VanDerWaalsContact O-CG 3.31Å; E153-Q157 WeakPolarHBondContact O-CG 3.36Å; E153-Q157 PolarHBondContact O-N 3.37Å; E153-Q157 PolarHBondContact OE1-NE2 2.89Å; E153-Q157 VanDerWaalsContact OE1-NE2 3.07Å
154K95.1Very high90.7Very high98 Ų9880.1 Ų80.143%0.42640%0.395SS..Hα-helixtrans-55.4-40.8173.3-76.6175.3178.6-176.80112.1L132 R150 T151 L158L132-K154 HydrophobicContact CD1-CB 4.44Å; L132-K154 HydrophobicContact CD2-CB 4.15Å; L132-K154 HydrophobicContact CD2-CD 4.49Å; R150-K154 VanDerWaalsContact O-CG 3.31Å; R150-K154 WeakPolarHBondContact O-CG 3.36Å; R150-K154 PolarHBondContact O-N 2.87Å; T151-K154 PolarHBondContact O-N 3.47Å; K154-L158 VanDerWaalsContact O-CB 3.29Å; K154-L158 WeakPolarHBondContact O-CB 3.43Å; K154-L158 PolarHBondContact O-N 2.89Å
155M92.3Very high90.1Very high30 Ų3080.5 Ų80.515%0.14840%0.397CS..Hα-helixtrans-62.2-49.1175-174.873.987.600111.6V129 L132 Q133 T151 S152 E153 Q157 L158 M159V129-M155 HydrophobicContact CB-SD 3.93Å; V129-M155 HydrophobicContact CG1-CE 4Å; V129-M155 HydrophobicContact CG1-SD 3.63Å; V129-M155 HydrophobicContact CG2-SD 4.01Å; V129-M155 WeakPolarHBondContact O-CE 3.1Å; L132-M155 HydrophobicContact CB-CE 3.38Å; L132-M155 HydrophobicContact CB-SD 3.77Å; L132-M155 HydrophobicContact CD1-CB 4.34Å; L132-M155 HydrophobicContact CD1-SD 3.99Å; Q133-M155 HydrophobicContact CB-CE 3.93Å; Q133-M155 VanDerWaalsContact N-CE 3.34Å; T151-M155 WeakPolarHBondContact O-CB 3.37Å; T151-M155 PolarHBondContact O-N 2.85Å; S152-M155 WeakPolarHBondContact O-CB 3.45Å; S152-M155 PolarHBondContact O-N 2.91Å; E153-M155 PolarHBondContact O-N 2.86Å; M155-Q157 VanDerWaalsContact C-N 3.34Å; M155-Q157 PolarHBondContact O-N 2.87Å; M155-L158 PolarHBondContact O-N 3.39Å; M155-M159 WeakPolarHBondContact O-CG 3.03Å; M155-M159 PolarHBondContact O-N 3.21Å
156S91.8Very high89.2Confident51 Ų5177.4 Ų77.436%0.35739%0.394SS..Hα-helixtrans-60.4-45.1178.9-1700000111.3S152 E153 M159 K160S152-S156 PolarHBondContact O-N 3.46Å; E153-S156 WeakPolarHBondContact O-CB 3.17Å; E153-S156 PolarHBondContact O-N 3.49Å; E153-S156 VanDerWaalsContact O-N 3.1Å; S156-M159 PolarHBondContact O-N 3.45Å; S156-K160 WeakPolarHBondContact O-CB 3.2Å; S156-K160 VanDerWaalsContact O-CG 3.27Å; S156-K160 WeakPolarHBondContact O-CG 3.43Å; S156-K160 PolarHBondContact O-N 2.88Å
157Q93.6Very high88.6Confident88 Ų8877.7 Ų77.741%0.41139%0.391SS..Hα-helixtrans-62.7-44.3176.3-70.81771.500111.4E153 M155 M159 K160 N161E153-Q157 HydrophobicContact CG-CG 4.2Å; E153-Q157 WeakPolarHBondContact O-CB 3.24Å; E153-Q157 VanDerWaalsContact O-CG 3.31Å; E153-Q157 WeakPolarHBondContact O-CG 3.36Å; E153-Q157 PolarHBondContact O-N 3.37Å; E153-Q157 PolarHBondContact OE1-NE2 2.89Å; E153-Q157 VanDerWaalsContact OE1-NE2 3.07Å; M155-Q157 VanDerWaalsContact C-N 3.34Å; M155-Q157 PolarHBondContact O-N 2.87Å; Q157-M159 VanDerWaalsContact C-N 3.33Å; Q157-M159 PolarHBondContact O-N 2.77Å; Q157-K160 PolarHBondContact O-N 2.88Å; Q157-N161 VanDerWaalsContact O-CB 3.23Å; Q157-N161 WeakPolarHBondContact O-CB 3.24Å; Q157-N161 PolarHBondContact O-N 3.5Å; Q157-N161 PolarHBondContact O-ND2 2.9Å; Q157-N161 PolarHBondContact O-OD1 3.44Å
158L91.6Very high87.8Confident23 Ų2377.2 Ų77.212%0.1239%0.391CS..Hα-helixtrans-58.7-45.5176.5179.568.9000111.6I125 Q128 V129 L132 K154 M155 N162I125-L158 HydrophobicContact CG2-CD2 4.38Å; I125-L158 HydrophobicContact CG2-CG 4.26Å; Q128-L158 HydrophobicContact CB-CD2 3.56Å; V129-L158 HydrophobicContact CG2-CD2 3.86Å; L132-L158 HydrophobicContact CD1-CB 4.36Å; L132-L158 HydrophobicContact CD1-CD2 3.74Å; K154-L158 VanDerWaalsContact O-CB 3.29Å; K154-L158 WeakPolarHBondContact O-CB 3.43Å; K154-L158 PolarHBondContact O-N 2.89Å; M155-L158 PolarHBondContact O-N 3.39Å; L158-N162 WeakPolarHBondContact CD1-ND2 3.47Å; L158-N162 PolarHBondContact O-N 2.87Å; L158-N162 PolarHBondContact O-ND2 2.91Å
159M88.4Confident86.9Confident34 Ų3476.2 Ų76.217%0.16739%0.387CS..Hα-helixtrans-65.8-42.8178.6-68.3-66.2-80.400111.8V129 M155 S156 Q157 N163 L164 P166V129-M159 HydrophobicContact CG2-CG 4.48Å; V129-M159 HydrophobicContact CG2-SD 3.62Å; M155-M159 WeakPolarHBondContact O-CG 3.03Å; M155-M159 PolarHBondContact O-N 3.21Å; S156-M159 PolarHBondContact O-N 3.45Å; Q157-M159 VanDerWaalsContact C-N 3.33Å; Q157-M159 PolarHBondContact O-N 2.77Å; M159-N163 PolarHBondContact O-N 3.08Å; M159-L164 HydrophobicContact CE-CB 3.73Å; M159-L164 WeakPolarHBondContact CE-O 3.34Å; M159-L164 PolarHBondContact O-N 2.92Å; M159-L164 HydrophobicContact SD-CB 3.84Å; M159-L164 HydrophobicContact SD-CD1 4.05Å; M159-P166 HydrophobicContact CE-CG 4.26Å
160K88.5Confident86.1Confident145 Ų14576.9 Ų76.963%0.6339%0.387SS*.Hα-helixtrans-64.1-47.9176.1-74.2174.3-178.9178.90112.1S156 Q157 N162 N163S156-K160 WeakPolarHBondContact O-CB 3.2Å; S156-K160 VanDerWaalsContact O-CG 3.27Å; S156-K160 WeakPolarHBondContact O-CG 3.43Å; S156-K160 PolarHBondContact O-N 2.88Å; Q157-K160 PolarHBondContact O-N 2.88Å; K160-N162 PolarHBondContact O-N 3.32Å; K160-N163 PolarHBondContact O-N 2.91Å
161N90.2Very high85.6Confident127 Ų12775.4 Ų75.468%0.67939%0.385SS*.Hα-helixtrans-62.4-29.2-178.4-69.1-6.5000112.5Q157Q157-N161 VanDerWaalsContact O-CB 3.23Å; Q157-N161 WeakPolarHBondContact O-CB 3.24Å; Q157-N161 PolarHBondContact O-N 3.5Å; Q157-N161 PolarHBondContact O-ND2 2.9Å; Q157-N161 PolarHBondContact O-OD1 3.44Å
162N86.7Confident85.1Confident65 Ų6576.5 Ų76.535%0.34839%0.388SS..THydrogen-bonded Turntrans-99.710.5176.5-66.4-87.2000113.9I125 L158 K160 L164I125-N162 HydrophobicContact CD1-CB 3.31Å; I125-N162 VanDerWaalsContact CD1-CG 3.46Å; I125-N162 WeakPolarHBondContact CD1-OD1 3.35Å; I125-N162 HydrophobicContact CG1-CB 4.16Å; I125-N162 HydrophobicContact CG2-CB 4.47Å; L158-N162 WeakPolarHBondContact CD1-ND2 3.47Å; L158-N162 PolarHBondContact O-N 2.87Å; L158-N162 PolarHBondContact O-ND2 2.91Å; K160-N162 PolarHBondContact O-N 3.32Å; N162-L164 HydrophobicContact CB-CG 4.05Å; N162-L164 PolarHBondContact O-N 3.02Å
163N82.2Confident84.5Confident134 Ų13476.8 Ų76.872%0.71739%0.387SS*.THydrogen-bonded Turntrans5227.8-177.7-65.4-54.8000114.5M159 K160 N165M159-N163 PolarHBondContact O-N 3.08Å; K160-N163 PolarHBondContact O-N 2.91Å; N163-N165 PolarHBondContact O-N 3.3Å; N163-N165 VanDerWaalsContact O-N 3.09Å
164L74.5Confident84.1Confident14 Ų1477.7 Ų77.77%0.07339%0.39CS..  trans-84.384.6177-64.9-168.7000109.5Y122 I125 M159 N162Y122-L164 HydrophobicContact CD2-CD1 4.09Å; Y122-L164 HydrophobicContact CD2-CD2 4.33Å; I125-L164 HydrophobicContact CB-CD1 3.6Å; I125-L164 HydrophobicContact CD1-CD1 3.52Å; I125-L164 HydrophobicContact CD1-CD2 4.05Å; I125-L164 HydrophobicContact CD1-CG 3.79Å; I125-L164 HydrophobicContact CG1-CD1 4.2Å; I125-L164 HydrophobicContact CG2-CD1 3.54Å; M159-L164 HydrophobicContact CE-CB 3.73Å; M159-L164 WeakPolarHBondContact CE-O 3.34Å; M159-L164 PolarHBondContact O-N 2.92Å; M159-L164 HydrophobicContact SD-CB 3.84Å; M159-L164 HydrophobicContact SD-CD1 4.05Å; N162-L164 HydrophobicContact CB-CG 4.05Å; N162-L164 PolarHBondContact O-N 3.02Å
165N76.4Confident83.7Confident73 Ų7377.5 Ų77.539%0.3939%0.393SS..  trans-82.7124.3158.2-175.6-15.9000107.5N163 L167 N168 T169N163-N165 PolarHBondContact O-N 3.3Å; N163-N165 VanDerWaalsContact O-N 3.09Å; N165-L167 PolarHBondContact O-N 3.3Å; N165-L167 VanDerWaalsContact O-N 3.08Å; N165-L167 WeakPolarHBondContact OD1-CB 3.38Å; N165-L167 PolarHBondContact OD1-N 3.38Å; N165-N168 HydrophobicContact CB-CB 4.02Å; N165-N168 WeakPolarHBondContact O-CA 3.49Å; N165-N168 WeakPolarHBondContact O-CB 3.25Å; N165-N168 PolarHBondContact O-N 3.21Å; N165-T169 PolarHBondContact O-N 3.44Å
166P70.5Confident83.4Confident73 Ų7378.5 Ų78.547%0.47440%0.397SS..Hα-helixtrans-48-37.9174.2-28.735000112.9M159 N168 T169 F170M159-P166 HydrophobicContact CE-CG 4.26Å; P166-N168 VanDerWaalsContact C-N 3.35Å; P166-N168 PolarHBondContact O-N 3.12Å; P166-T169 PolarHBondContact O-N 3.43Å; P166-F170 WeakPolarHBondContact O-CD2 3.35Å; P166-F170 PolarHBondContact O-N 2.95Å
167L79.4Confident83.3Confident117 Ų11778 Ų7861%0.61340%0.396SS*.Hα-helixtrans-67-32.9176.9-61.5178.2000113N165 T169 F170 K171N165-L167 PolarHBondContact O-N 3.3Å; N165-L167 VanDerWaalsContact O-N 3.08Å; N165-L167 WeakPolarHBondContact OD1-CB 3.38Å; N165-L167 PolarHBondContact OD1-N 3.38Å; L167-T169 VanDerWaalsContact C-N 3.35Å; L167-F170 CarbonylContact O-C 3.48Å; L167-F170 PolarHBondContact O-N 3.45Å; L167-K171 PolarHBondContact O-N 3.35Å
168N77.5Confident83.2Confident70 Ų7077.2 Ų77.237%0.37440%0.399SS..Hα-helixtrans-68.2-36177.5-73.1-6.1000111.5N165 P166 F170 K171N165-N168 HydrophobicContact CB-CB 4.02Å; N165-N168 WeakPolarHBondContact O-CA 3.49Å; N165-N168 WeakPolarHBondContact O-CB 3.25Å; N165-N168 PolarHBondContact O-N 3.21Å; P166-N168 VanDerWaalsContact C-N 3.35Å; P166-N168 PolarHBondContact O-N 3.12Å; N168-F170 VanDerWaalsContact C-N 3.29Å; N168-F170 PolarHBondContact O-N 3.31Å; N168-K171 WeakPolarHBondContact O-CB 3.43Å; N168-K171 PolarHBondContact O-N 3.34Å
169T72.7Confident83.2Confident16 Ų1679.1 Ų79.110%0.09841%0.409CS..Hα-helixtrans-61.1-41.4174.5-53.60000111Y122 N165 P166 L167Y122-T169 HydrophobicContact CD2-CG2 4.25Å; Y122-T169 HydrophobicContact CG-CG2 4.14Å; N165-T169 PolarHBondContact O-N 3.44Å; P166-T169 PolarHBondContact O-N 3.43Å; L167-T169 VanDerWaalsContact C-N 3.35Å
170F78.5Confident83.4Confident108 Ų10880.8 Ų80.847%0.47442%0.415SS..Hα-helixtrans-86.8-8.6180-62.7-66.6000114.4P166 L167 N168 Y172 V173 F174P166-F170 WeakPolarHBondContact O-CD2 3.35Å; P166-F170 PolarHBondContact O-N 2.95Å; L167-F170 CarbonylContact O-C 3.48Å; L167-F170 PolarHBondContact O-N 3.45Å; N168-F170 VanDerWaalsContact C-N 3.29Å; N168-F170 PolarHBondContact O-N 3.31Å; F170-Y172 PolarHBondContact O-N 3.46Å; F170-V173 HydrophobicContact CD1-CG2 4.37Å; F170-V173 WeakPolarHBondContact O-CA 3.21Å; F170-V173 WeakPolarHBondContact O-CB 3.25Å; F170-V173 PolarHBondContact O-N 2.9Å; F170-F174 HydrophobicContact CB-CD2 3.92Å; F170-F174 HydrophobicContact CB-CE2 3.59Å; F170-F174 HydrophobicContact CB-CZ 4.5Å; F170-F174 WeakPolarHBondContact O-CD2 3.32Å; F170-F174 PolarHBondContact O-N 3.42Å
171K84.7Confident83.7Confident133 Ų13378.6 Ų78.658%0.57841%0.409SS*.Hα-helixtrans-51.4-43.8180-179.6178.7178.5176.20112.5L167 N168 F174 L175L167-K171 PolarHBondContact O-N 3.35Å; N168-K171 WeakPolarHBondContact O-CB 3.43Å; N168-K171 PolarHBondContact O-N 3.34Å; K171-F174 PolarHBondContact O-N 3.28Å; K171-L175 PolarHBondContact O-N 3.33Å
172Y83.6Confident83.9Confident35 Ų3572.8 Ų72.814%0.13738%0.38CS..Hα-helixtrans-72.3-30.6179.7-59.1-75.3000112.8V111 R114 Q115 H118 F170 L175 Q176V111-Y172 HydrophobicContact CG1-CD1 4.27Å; R114-Y172 HydrophobicContact CB-CD1 4.16Å; R114-Y172 HydrophobicContact CB-CE1 3.63Å; Q115-Y172 HydrophobicContact CB-CD2 4.49Å; Q115-Y172 HydrophobicContact CB-CG 4.12Å; H118-Y172 HydrophobicContact CB-CD2 4.48Å; H118-Y172 HydrophobicContact CB-CE2 4.16Å; H118-Y172 AromaticContact CD2-CE2 3.17Å; H118-Y172 WeakPolarHBondContact CD2-CE2 3.33Å; H118-Y172 AromaticContact CD2-CZ 3.58Å; H118-Y172 PolarHBondContact CD2-OH 2.96Å; H118-Y172 AromaticContact CG-CE2 3.57Å; H118-Y172 AromaticContact NE2-CE2 3.47Å; H118-Y172 WeakPolarHBondContact NE2-CE2 3.47Å; H118-Y172 AromaticContact NE2-CZ 3.58Å; H118-Y172 PolarHBondContact NE2-OH 3.24Å; F170-Y172 PolarHBondContact O-N 3.46Å; Y172-L175 PolarHBondContact O-N 2.83Å; Y172-Q176 PolarHBondContact O-N 3.08Å
173V80.7Confident84.3Confident63 Ų6369.8 Ų69.838%0.38236%0.364SS..Hα-helixtrans-65.9-45172.1-179.30000109.9F170 L175 Q176 A177F170-V173 HydrophobicContact CD1-CG2 4.37Å; F170-V173 WeakPolarHBondContact O-CA 3.21Å; F170-V173 WeakPolarHBondContact O-CB 3.25Å; F170-V173 PolarHBondContact O-N 2.9Å; V173-L175 VanDerWaalsContact C-N 3.28Å; V173-L175 PolarHBondContact O-N 3.23Å; V173-Q176 PolarHBondContact O-N 3.4Å; V173-Q176 VanDerWaalsContact O-N 3.12Å; V173-A177 PolarHBondContact O-N 2.93Å
174F87.2Confident84.9Confident134 Ų13465.9 Ų65.959%0.58834%0.341SS*.Hα-helixtrans-64.8-31.8176.2-70.8-60.4000112.9F170 K171 Q176 A177 P178F170-F174 HydrophobicContact CB-CD2 3.92Å; F170-F174 HydrophobicContact CB-CE2 3.59Å; F170-F174 HydrophobicContact CB-CZ 4.5Å; F170-F174 WeakPolarHBondContact O-CD2 3.32Å; F170-F174 PolarHBondContact O-N 3.42Å; K171-F174 PolarHBondContact O-N 3.28Å; F174-Q176 PolarHBondContact O-N 3.49Å; F174-A177 PolarHBondContact O-N 3.42Å; F174-P178 WeakPolarHBondContact O-CD 3.32Å
175L86.9Confident85.9Confident94 Ų9468.3 Ų68.349%0.49236%0.356SS..Hα-helixtrans-65.7-28.7174.5-175.859.2000112.7V111 K171 Y172 V173V111-L175 HydrophobicContact CG1-CD2 3.76Å; V111-L175 HydrophobicContact CG1-CG 4.45Å; V111-L175 HydrophobicContact CG2-CD2 4.17Å; K171-L175 PolarHBondContact O-N 3.33Å; Y172-L175 PolarHBondContact O-N 2.83Å; V173-L175 VanDerWaalsContact C-N 3.28Å; V173-L175 PolarHBondContact O-N 3.23Å
176Q86.1Confident86.8Confident51 Ų5164.8 Ų64.824%0.23834%0.337CS..Hα-helixtrans-80-28178.5178.716936.200113M108 Y172 V173 F174 I179 F180M108-Q176 HydrophobicContact CE-CB 3.87Å; M108-Q176 HydrophobicContact CE-CG 3.72Å; Y172-Q176 PolarHBondContact O-N 3.08Å; V173-Q176 PolarHBondContact O-N 3.4Å; V173-Q176 VanDerWaalsContact O-N 3.12Å; F174-Q176 PolarHBondContact O-N 3.49Å; Q176-I179 PolarHBondContact O-N 2.89Å; Q176-F180 PolarHBondContact O-N 3.05Å
177A89.7Confident88Confident40 Ų4061.4 Ų61.433%0.33132%0.315SS..Hα-helixtrans-60.1-42.5-174.300000114.6V173 F174 I179 F180 L181V173-A177 PolarHBondContact O-N 2.93Å; F174-A177 PolarHBondContact O-N 3.42Å; A177-I179 VanDerWaalsContact C-N 3.33Å; A177-I179 PolarHBondContact O-N 3.14Å; A177-F180 WeakPolarHBondContact O-CB 3.39Å; A177-F180 PolarHBondContact O-N 3.49Å; A177-L181 WeakPolarHBondContact O-CB 3.43Å; A177-L181 WeakPolarHBondContact O-CG 3.38Å; A177-L181 PolarHBondContact O-N 3.23Å
178P91.1Very high88.7Confident73 Ų7360.1 Ų60.147%0.47430%0.302SS..Hα-helixtrans-62.1-38176.6-25.734.2000113.5F174 L181 G182F174-P178 WeakPolarHBondContact O-CD 3.32Å; P178-L181 PolarHBondContact O-N 3.5Å; P178-G182 PolarHBondContact O-N 3.42Å
179I92.1Very high89.5Confident63 Ų6357.7 Ų57.732%0.32329%0.293SS..Hα-helixtrans-66.3-45.8177.6-62.1168.9000109.1I104 M108 Q176 A177 L181 G182 V183I104-I179 HydrophobicContact CG2-CG2 3.71Å; M108-I179 HydrophobicContact CE-CD1 3.55Å; M108-I179 HydrophobicContact CG-CD1 4.04Å; M108-I179 HydrophobicContact SD-CB 4.3Å; M108-I179 HydrophobicContact SD-CD1 3.55Å; M108-I179 VanDerWaalsContact SD-CD1 3.55Å; M108-I179 HydrophobicContact SD-CG2 3.87Å; Q176-I179 PolarHBondContact O-N 2.89Å; A177-I179 VanDerWaalsContact C-N 3.33Å; A177-I179 PolarHBondContact O-N 3.14Å; I179-L181 PolarHBondContact O-N 2.68Å; I179-G182 PolarHBondContact O-N 3.08Å; I179-V183 WeakPolarHBondContact O-CG2 3.2Å; I179-V183 PolarHBondContact O-N 2.81Å
180F92.4Very high90.4Very high69 Ų6957 Ų5730%0.30329%0.29SS..Hα-helixtrans-58.6-46175172.7-92.9000112.1Q176 A177 G182 V183 F184 Y270 W271Q176-F180 PolarHBondContact O-N 3.05Å; A177-F180 WeakPolarHBondContact O-CB 3.39Å; A177-F180 PolarHBondContact O-N 3.49Å; F180-G182 PolarHBondContact O-N 2.91Å; F180-V183 PolarHBondContact O-N 2.88Å; F180-F184 HydrophobicContact CE1-CB 4.31Å; F180-F184 HydrophobicContact CZ-CB 4.36Å; F180-F184 HydrophobicContact CZ-CD2 4.33Å; F180-F184 VanDerWaalsContact O-CB 3.23Å; F180-F184 WeakPolarHBondContact O-CB 3.16Å; F180-F184 PolarHBondContact O-N 3.19Å; F180-Y270 HydrophobicContact CD2-CE1 4.23Å; F180-Y270 HydrophobicContact CE2-CE1 4.02Å; F180-W271 AromaticContact CE2-CE2 3.9Å; F180-W271 AromaticContact CE2-CZ2 3.89Å; F180-W271 HydrophobicContact CE2-CZ2 3.89Å; F180-W271 AromaticContact CE2-NE1 3.72Å; F180-W271 HydrophobicContact CZ-CH2 4.39Å; F180-W271 AromaticContact CZ-CZ2 3.55Å; F180-W271 HydrophobicContact CZ-CZ2 3.55Å
181L93.6Very high91.1Very high98 Ų9852.6 Ų52.651%0.51327%0.271SS..Hα-helixtrans-62.4-41.6177.4-80.7162.9000112A177 P178 I179 F184 T185A177-L181 WeakPolarHBondContact O-CB 3.43Å; A177-L181 WeakPolarHBondContact O-CG 3.38Å; A177-L181 PolarHBondContact O-N 3.23Å; P178-L181 PolarHBondContact O-N 3.5Å; I179-L181 PolarHBondContact O-N 2.68Å; L181-F184 PolarHBondContact O-N 2.85Å; L181-T185 WeakPolarHBondContact O-CB 3.33Å; L181-T185 WeakPolarHBondContact O-CG2 3.43Å; L181-T185 PolarHBondContact O-N 3.39Å; L181-T185 PolarHBondContact O-OG1 3.37Å
182G95Very high91.4Very high5 Ų551.1 Ų51.15%0.05227%0.27CS..Hα-helixtrans-60-49.6175.100000112S75 P178 I179 F180 T185 G186S75-G182 WeakPolarHBondContact CA-O 3.25Å; P178-G182 PolarHBondContact O-N 3.42Å; I179-G182 PolarHBondContact O-N 3.08Å; F180-G182 PolarHBondContact O-N 2.91Å; G182-T185 PolarHBondContact O-OG1 3.42Å; G182-G186 WeakPolarHBondContact O-CA 3.4Å; G182-G186 PolarHBondContact O-N 3.15Å
183V96Very high91.5Very high3 Ų352.4 Ų52.42%0.01828%0.279CS..Hα-helixtrans-61.9-48.5176.3176.10000111.3Y78 I104 I179 F180 G186 I187 Y270Y78-V183 HydrophobicContact CD1-CG1 4.36Å; Y78-V183 HydrophobicContact CD2-CB 4.33Å; Y78-V183 HydrophobicContact CD2-CG1 4.34Å; Y78-V183 HydrophobicContact CD2-CG2 3.68Å; Y78-V183 HydrophobicContact CE1-CG1 3.86Å; Y78-V183 HydrophobicContact CE2-CB 4.28Å; Y78-V183 HydrophobicContact CE2-CG1 3.81Å; Y78-V183 HydrophobicContact CE2-CG2 3.78Å; Y78-V183 HydrophobicContact CG-CB 4.44Å; Y78-V183 HydrophobicContact CG-CG2 4.14Å; I104-V183 HydrophobicContact CD1-CG2 3.85Å; I179-V183 WeakPolarHBondContact O-CG2 3.2Å; I179-V183 PolarHBondContact O-N 2.81Å; F180-V183 PolarHBondContact O-N 2.88Å; V183-G186 PolarHBondContact O-N 3.24Å; V183-I187 HydrophobicContact CG1-CD1 3.91Å; V183-I187 HydrophobicContact CG1-CG1 4.37Å; V183-I187 WeakPolarHBondContact O-CG1 3.42Å; V183-I187 PolarHBondContact O-N 3.17Å; V183-Y270 HydrophobicContact CB-CE2 4.29Å; V183-Y270 HydrophobicContact CG1-CD1 4.29Å; V183-Y270 HydrophobicContact CG1-CD2 3.64Å; V183-Y270 HydrophobicContact CG1-CE1 4.01Å; V183-Y270 HydrophobicContact CG1-CE2 3.37Å; V183-Y270 HydrophobicContact CG1-CG 4.11Å
184F95.3Very high91.4Very high52 Ų5253.9 Ų53.923%0.22829%0.289CS..Hα-helixtrans-59.8-51.8-178177.6-93.2000111.9F180 L181 G186 I187 R188 M263 L267 W271F180-F184 HydrophobicContact CE1-CB 4.31Å; F180-F184 HydrophobicContact CZ-CB 4.36Å; F180-F184 HydrophobicContact CZ-CD2 4.33Å; F180-F184 VanDerWaalsContact O-CB 3.23Å; F180-F184 WeakPolarHBondContact O-CB 3.16Å; F180-F184 PolarHBondContact O-N 3.19Å; L181-F184 PolarHBondContact O-N 2.85Å; F184-G186 VanDerWaalsContact C-N 3.3Å; F184-G186 PolarHBondContact O-N 2.95Å; F184-I187 PolarHBondContact O-N 3.48Å; F184-R188 VanDerWaalsContact O-CB 3.25Å; F184-R188 WeakPolarHBondContact O-CB 3.38Å; F184-R188 PolarHBondContact O-N 3.12Å; F184-M263 HydrophobicContact CE2-CE 4.41Å; F184-L267 HydrophobicContact CD2-CD2 3.72Å; F184-L267 HydrophobicContact CE2-CD1 4.03Å; F184-L267 HydrophobicContact CE2-CD2 3.98Å; F184-L267 HydrophobicContact CG-CD2 4.47Å; F184-W271 AromaticContact CD2-CH2 3.87Å; F184-W271 HydrophobicContact CD2-CH2 3.87Å; F184-W271 HydrophobicContact CD2-CZ3 4.42Å; F184-W271 AromaticContact CE2-CH2 3.72Å; F184-W271 HydrophobicContact CE2-CH2 3.72Å; F184-W271 HydrophobicContact CE2-CZ3 4.25Å
185T94.3Very high91.4Very high64 Ų6447.7 Ų47.739%0.39326%0.263SS..Hα-helixtrans-67.2-33.2178.453.90000111.7S75 L181 G182 G189S75-T185 VanDerWaalsContact CB-OG1 3.28Å; S75-T185 WeakPolarHBondContact CB-OG1 3.42Å; L181-T185 WeakPolarHBondContact O-CB 3.33Å; L181-T185 WeakPolarHBondContact O-CG2 3.43Å; L181-T185 PolarHBondContact O-N 3.39Å; L181-T185 PolarHBondContact O-OG1 3.37Å; G182-T185 PolarHBondContact O-OG1 3.42Å; T185-G189 PolarHBondContact O-N 3.28Å
186G95.4Very high91.4Very high0 Ų047.6 Ų47.60%027%0.266CS..Hα-helixtrans-58.8-56.6172.800000112.3Q79 G182 V183 F184 G189 L190Q79-G186 PolarHBondContact NE2-O 3Å; G182-G186 WeakPolarHBondContact O-CA 3.4Å; G182-G186 PolarHBondContact O-N 3.15Å; V183-G186 PolarHBondContact O-N 3.24Å; F184-G186 VanDerWaalsContact C-N 3.3Å; F184-G186 PolarHBondContact O-N 2.95Å; G186-G189 PolarHBondContact O-N 3.45Å; G186-L190 VanDerWaalsContact O-CD1 3.29Å; G186-L190 WeakPolarHBondContact O-CD1 3.03Å; G186-L190 PolarHBondContact O-N 2.82Å
187I96.2Very high91.7Very high2 Ų245.8 Ų45.81%0.0126%0.259CS..Hα-helixtrans-62.5-43.5177.4-61.5176.1000110.8Y78 I97 V183 F184 G189 L190 V191 A266 L267 Y270Y78-I187 HydrophobicContact CD1-CG1 4.46Å; Y78-I187 HydrophobicContact CE1-CD1 4.14Å; Y78-I187 HydrophobicContact CE1-CG1 3.5Å; I97-I187 HydrophobicContact CG2-CD1 4.48Å; V183-I187 HydrophobicContact CG1-CD1 3.91Å; V183-I187 HydrophobicContact CG1-CG1 4.37Å; V183-I187 WeakPolarHBondContact O-CG1 3.42Å; V183-I187 PolarHBondContact O-N 3.17Å; F184-I187 PolarHBondContact O-N 3.48Å; I187-G189 VanDerWaalsContact C-N 3.26Å; I187-G189 PolarHBondContact O-N 2.87Å; I187-L190 WeakPolarHBondContact O-CB 3.43Å; I187-L190 PolarHBondContact O-N 3.14Å; I187-L190 VanDerWaalsContact O-N 3.13Å; I187-V191 HydrophobicContact CG2-CG2 4.32Å; I187-V191 WeakPolarHBondContact O-CG2 3.48Å; I187-V191 PolarHBondContact O-N 3.33Å; I187-A266 HydrophobicContact CG2-CB 3.57Å; I187-L267 HydrophobicContact CB-CD2 3.72Å; I187-L267 HydrophobicContact CB-CG 4.39Å; I187-L267 HydrophobicContact CD1-CD2 4.32Å; I187-L267 HydrophobicContact CG2-CD2 3.66Å; I187-L267 HydrophobicContact CG2-CG 3.78Å; I187-Y270 HydrophobicContact CD1-CD1 4.34Å; I187-Y270 HydrophobicContact CD1-CD2 4.28Å; I187-Y270 HydrophobicContact CD1-CG 3.79Å
188R94.6Very high91.8Very high89 Ų8944 Ų4434%0.33624%0.244SC..Hα-helixtrans-61.1-37.8179.8-164.874.8-175.8104.5-1.3111.5F184 V191 N192F184-R188 VanDerWaalsContact O-CB 3.25Å; F184-R188 WeakPolarHBondContact O-CB 3.38Å; F184-R188 PolarHBondContact O-N 3.12Å; R188-V191 PolarHBondContact O-N 3.17Å; R188-N192 PolarHBondContact NH1-OD1 3.38Å; R188-N192 WeakPolarHBondContact O-CB 3.41Å; R188-N192 PolarHBondContact O-N 3.04Å; R188-N192 VanDerWaalsContact O-N 3.13Å; R188-N192 PolarHBondContact O-ND2 3.01Å
189G92.5Very high91.9Very high19 Ų1945.3 Ų45.320%0.19624%0.244CC..Hα-helixtrans-62.2-43173.600000113T185 G186 I187 N192 L193T185-G189 PolarHBondContact O-N 3.28Å; G186-G189 PolarHBondContact O-N 3.45Å; I187-G189 VanDerWaalsContact C-N 3.26Å; I187-G189 PolarHBondContact O-N 2.87Å; G189-N192 PolarHBondContact O-N 2.94Å; G189-L193 PolarHBondContact O-N 3.34Å
190L92.5Very high92Very high3 Ų347.9 Ų47.92%0.01626%0.262CS..Hα-helixtrans-61.3-48175.9-9569.7000111.8L64 L69 Q79 L82 W93 G186 I187 N192 L193 L198L64-L190 HydrophobicContact CD1-CD1 4.17Å; L64-L190 HydrophobicContact CD2-CG 4.41Å; L69-L190 HydrophobicContact CD1-CD1 4.01Å; L69-L190 HydrophobicContact CD1-CG 4.35Å; Q79-L190 HydrophobicContact CB-CD1 4.14Å; Q79-L190 HydrophobicContact CG-CD1 3.45Å; Q79-L190 VanDerWaalsContact CG-CD1 3.45Å; L82-L190 HydrophobicContact CD1-CD2 3.85Å; W93-L190 HydrophobicContact CE3-CD2 4.28Å; W93-L190 HydrophobicContact CH2-CD2 4.22Å; W93-L190 HydrophobicContact CZ3-CD2 3.72Å; G186-L190 VanDerWaalsContact O-CD1 3.29Å; G186-L190 WeakPolarHBondContact O-CD1 3.03Å; G186-L190 PolarHBondContact O-N 2.82Å; I187-L190 WeakPolarHBondContact O-CB 3.43Å; I187-L190 PolarHBondContact O-N 3.14Å; I187-L190 VanDerWaalsContact O-N 3.13Å; L190-N192 VanDerWaalsContact C-N 3.26Å; L190-N192 PolarHBondContact O-N 3.17Å; L190-L193 PolarHBondContact O-N 3.39Å; L190-L198 HydrophobicContact CB-CD2 4.29Å; L190-L198 HydrophobicContact CD2-CD1 4.12Å
191V93.7Very high92Very high15 Ų1545 Ų459%0.09125%0.252CS..Hα-helixtrans-66.9-28.9-176.7171.10000112.5I187 R188 L193 L198 T210 P264 A266I187-V191 HydrophobicContact CG2-CG2 4.32Å; I187-V191 WeakPolarHBondContact O-CG2 3.48Å; I187-V191 PolarHBondContact O-N 3.33Å; R188-V191 PolarHBondContact O-N 3.17Å; V191-L193 VanDerWaalsContact C-N 3.33Å; V191-L198 HydrophobicContact CG2-CD2 4.26Å; V191-T210 HydrophobicContact CG1-CG2 4.44Å; V191-P264 HydrophobicContact CB-CB 4.49Å; V191-P264 HydrophobicContact CG1-CB 3.75Å; V191-P264 HydrophobicContact CG1-CG 3.64Å; V191-P264 HydrophobicContact CG2-CB 4.13Å; V191-A266 HydrophobicContact CG2-CB 3.81Å
192N91.1Very high92Very high102 Ų10240.9 Ų40.955%0.54523%0.233SC..THydrogen-bonded Turntrans-83.7-8.3-178.9-74.4-13.6000113.8R188 G189 L190R188-N192 PolarHBondContact NH1-OD1 3.38Å; R188-N192 WeakPolarHBondContact O-CB 3.41Å; R188-N192 PolarHBondContact O-N 3.04Å; R188-N192 VanDerWaalsContact O-N 3.13Å; R188-N192 PolarHBondContact O-ND2 3.01Å; G189-N192 PolarHBondContact O-N 2.94Å; L190-N192 VanDerWaalsContact C-N 3.26Å; L190-N192 PolarHBondContact O-N 3.17Å
193L84.7Confident92Very high62 Ų6243 Ų4333%0.32525%0.245SC..THydrogen-bonded Turntrans-109158.4178.8-75175.7000110.5L67 L69 G189 L190 V191 V195L67-L193 HydrophobicContact CB-CD1 4.41Å; L67-L193 WeakPolarHBondContact O-CD1 3.39Å; L69-L193 HydrophobicContact CD1-CD1 3.61Å; L69-L193 HydrophobicContact CD2-CD1 3.58Å; L69-L193 HydrophobicContact CG-CD1 3.36Å; G189-L193 PolarHBondContact O-N 3.34Å; L190-L193 PolarHBondContact O-N 3.39Å; V191-L193 VanDerWaalsContact C-N 3.33Å; L193-V195 PolarHBondContact O-N 2.98Å
194P79.3Confident91.9Very high93 Ų9346.2 Ų46.260%0.60427%0.273SS*.THydrogen-bonded Turntrans-76.458.5-17533.2-37.2000112T196P194-T196 PolarHBondContact O-N 2.88Å; P194-T196 VanDerWaalsContact O-N 3.16Å
195V86Confident91.9Very high5 Ų548.2 Ų48.23%0.0328%0.279CS..  trans-82.987.2170-167.80000107.6L64 L67 W93 L193 S197 L198L64-V195 HydrophobicContact CD2-CG2 4.36Å; L67-V195 HydrophobicContact CD1-CG2 3.74Å; W93-V195 HydrophobicContact CZ2-CG1 4.15Å; L193-V195 PolarHBondContact O-N 2.98Å; V195-S197 PolarHBondContact O-N 2.89Å; V195-L198 HydrophobicContact CB-CD1 3.64Å; V195-L198 HydrophobicContact CG1-CD1 3.35Å; V195-L198 HydrophobicContact CG2-CD1 4.37Å; V195-L198 WeakPolarHBondContact O-CB 3.44Å; V195-L198 PolarHBondContact O-N 3.47Å
196T87.3Confident91.9Very high92 Ų9245.5 Ų45.556%0.56426%0.261SS*.G310 helixtrans-57.1-33.6-17450.40000112.8P194 L198 Q199P194-T196 PolarHBondContact O-N 2.88Å; P194-T196 VanDerWaalsContact O-N 3.16Å; T196-L198 PolarHBondContact O-N 2.87Å; T196-Q199 WeakPolarHBondContact O-CB 3.2Å; T196-Q199 PolarHBondContact O-N 3.43Å
197S91.9Very high92Very high13 Ų1349.4 Ų49.49%0.09129%0.286CS..G310 helixtrans-66.3-18.4177.559.70000114.1E61 W93 V195 Q199 G201E61-S197 WeakPolarHBondContact OE1-CB 3.46Å; E61-S197 PolarHBondContact OE1-OG 2.96Å; E61-S197 VanDerWaalsContact OE2-CB 3.26Å; E61-S197 WeakPolarHBondContact OE2-CB 3.23Å; E61-S197 PolarHBondContact OE2-OG 3.37Å; W93-S197 VanDerWaalsContact CD1-O 3.23Å; W93-S197 PolarHBondContact NE1-OG 3.21Å; V195-S197 PolarHBondContact O-N 2.89Å; S197-Q199 VanDerWaalsContact C-N 3.34Å; S197-G201 VanDerWaalsContact O-CA 3.29Å; S197-G201 WeakPolarHBondContact O-CA 3.45Å; S197-G201 PolarHBondContact O-N 3.37Å
198L93.4Very high92Very high2 Ų251.6 Ų51.61%0.0130%0.297CS..G310 helixtrans-71.8-26.9171-96.395.7000113W93 L190 V191 V195 T196 T200 G201 L209 T210W93-L198 HydrophobicContact CB-CG 4.49Å; W93-L198 HydrophobicContact CD2-CD1 3.75Å; W93-L198 HydrophobicContact CD2-CG 4.14Å; W93-L198 HydrophobicContact CE3-CD1 4.13Å; W93-L198 HydrophobicContact CG-CD1 4.15Å; W93-L198 HydrophobicContact CG-CG 4.06Å; W93-L198 HydrophobicContact CH2-CD1 4.35Å; W93-L198 HydrophobicContact CZ2-CD1 3.99Å; W93-L198 HydrophobicContact CZ3-CD1 4.41Å; L190-L198 HydrophobicContact CB-CD2 4.29Å; L190-L198 HydrophobicContact CD2-CD1 4.12Å; V191-L198 HydrophobicContact CG2-CD2 4.26Å; V195-L198 HydrophobicContact CB-CD1 3.64Å; V195-L198 HydrophobicContact CG1-CD1 3.35Å; V195-L198 HydrophobicContact CG2-CD1 4.37Å; V195-L198 WeakPolarHBondContact O-CB 3.44Å; V195-L198 PolarHBondContact O-N 3.47Å; T196-L198 PolarHBondContact O-N 2.87Å; L198-T200 PolarHBondContact O-N 2.97Å; L198-G201 PolarHBondContact O-N 3.34Å; L198-L209 HydrophobicContact CD2-CB 4.23Å; L198-L209 WeakPolarHBondContact O-CB 3.32Å; L198-L209 PolarHBondContact O-N 2.77Å; L198-L209 VanDerWaalsContact O-N 3.1Å; L198-T210 HydrophobicContact CB-CG2 3.77Å
199Q93.1Very high92Very high101 Ų10147.4 Ų47.447%0.47228%0.281SS..THydrogen-bonded Turntrans-71-20.4-179-63.9178.4-11.600112.8T196 S197 T207 D208 T210T196-Q199 WeakPolarHBondContact O-CB 3.2Å; T196-Q199 PolarHBondContact O-N 3.43Å; S197-Q199 VanDerWaalsContact C-N 3.34Å; Q199-T207 CarbonylContact O-C 3.55Å; Q199-D208 WeakPolarHBondContact CA-OD1 3.42Å; Q199-D208 WeakPolarHBondContact O-CA 3.06Å; Q199-D208 WeakPolarHBondContact O-CB 3.23Å; Q199-T210 HydrophobicContact CG-CG2 4.16Å
200T93Very high92.2Very high116 Ų11648 Ų4871%0.71228%0.281SS*.THydrogen-bonded Turntrans-118.1-0.1175.856.10000112.5L198 G202 T207L198-T200 PolarHBondContact O-N 2.97Å; T200-G202 VanDerWaalsContact C-N 3.29Å; T200-G202 PolarHBondContact O-N 3.25Å; T200-T207 CarbonylContact C-O 3.52Å
201G92.8Very high92.3Very high8 Ų849.7 Ų49.78%0.08230%0.296CS..  trans-83.63.3-172.900000115.5W93 W94 S197 L198W93-G201 PolarHBondContact N-O 3.23Å; W94-G201 VanDerWaalsContact CD1-O 3.29Å; W94-G201 PolarHBondContact N-O 2.91Å; S197-G201 VanDerWaalsContact O-CA 3.29Å; S197-G201 WeakPolarHBondContact O-CA 3.45Å; S197-G201 PolarHBondContact O-N 3.37Å; L198-G201 PolarHBondContact O-N 3.34Å
202G94Very high92.4Very high12 Ų1251.6 Ų51.612%0.12431%0.31CS..  trans-81.2-165176.900000114W94 T200 F206 T207W94-G202 VanDerWaalsContact CD1-O 3.23Å; T200-G202 VanDerWaalsContact C-N 3.29Å; T200-G202 PolarHBondContact O-N 3.25Å; G202-F206 VanDerWaalsContact CA-O 3.29Å; G202-F206 WeakPolarHBondContact CA-O 3.49Å; G202-T207 VanDerWaalsContact CA-O 3.24Å; G202-T207 WeakPolarHBondContact CA-O 3.45Å; G202-T207 PolarHBondContact N-O 2.7Å
203T94.9Very high92.7Very high49 Ų4947 Ų4730%0.30129%0.285SS..BIsolated β-bridgetrans-148.6163.4179.3-171.50000111.5W94 W205 F206W94-T203 HydrophobicContact CB-CG2 4.39Å; W94-T203 HydrophobicContact CD2-CG2 3.77Å; W94-T203 HydrophobicContact CE3-CG2 4.18Å; W94-T203 HydrophobicContact CG-CG2 3.86Å; T203-W205 PolarHBondContact O-N 3.47Å; T203-W205 VanDerWaalsContact O-N 3.16Å; T203-F206 HydrophobicContact CG2-CE1 3.86Å; T203-F206 HydrophobicContact CG2-CE2 3.95Å; T203-F206 HydrophobicContact CG2-CZ 3.38Å; T203-F206 PolarHBondContact N-O 3.34Å; T203-F206 CarbonylContact O-C 3.58Å; T203-F206 VanDerWaalsContact O-CD1 3.24Å; T203-F206 WeakPolarHBondContact O-CD1 3.46Å; T203-F206 WeakPolarHBondContact O-CE1 3.23Å; T203-F206 PolarHBondContact O-N 3.03Å
204A94.3Very high93.2Very high72 Ų7248.3 Ų48.360%0.59530%0.297SS*.THydrogen-bonded Turntrans48.5-116.418000000112.4
205W94.9Very high94Very high94 Ų9451.6 Ų51.636%0.35630%0.299SS..THydrogen-bonded Turntrans-90.3-5.9-177.865.784.7000114.5T203 D213 Y215 I217 L218T203-W205 PolarHBondContact O-N 3.47Å; T203-W205 VanDerWaalsContact O-N 3.16Å; W205-D213 VanDerWaalsContact CD1-OD1 3.26Å; W205-D213 PolarHBondContact NE1-OD1 3.5Å; W205-D213 PolarHBondContact NE1-OD2 3.43Å; W205-Y215 HydrophobicContact CB-CD2 3.82Å; W205-Y215 HydrophobicContact CB-CE2 3.94Å; W205-Y215 AromaticContact CD1-CD2 3.89Å; W205-Y215 HydrophobicContact CG-CD2 4.08Å; W205-I217 HydrophobicContact CD2-CD1 4.02Å; W205-I217 HydrophobicContact CG-CD1 4.24Å; W205-I217 HydrophobicContact CH2-CG2 3.87Å; W205-I217 HydrophobicContact CZ2-CB 3.73Å; W205-I217 HydrophobicContact CZ2-CD1 4.39Å; W205-I217 HydrophobicContact CZ2-CG2 3.33Å; W205-L218 HydrophobicContact CZ2-CG 4.44Å
206F95.3Very high94.4Very high6 Ų653.4 Ų53.43%0.02631%0.311CS..BIsolated β-bridgetrans-117.862.4-178.963.5-84.6000110.3G202 T203 D208 L209 L218 W269G202-F206 VanDerWaalsContact CA-O 3.29Å; G202-F206 WeakPolarHBondContact CA-O 3.49Å; T203-F206 HydrophobicContact CG2-CE1 3.86Å; T203-F206 HydrophobicContact CG2-CE2 3.95Å; T203-F206 HydrophobicContact CG2-CZ 3.38Å; T203-F206 PolarHBondContact N-O 3.34Å; T203-F206 CarbonylContact O-C 3.58Å; T203-F206 VanDerWaalsContact O-CD1 3.24Å; T203-F206 WeakPolarHBondContact O-CD1 3.46Å; T203-F206 WeakPolarHBondContact O-CE1 3.23Å; T203-F206 PolarHBondContact O-N 3.03Å; F206-D208 VanDerWaalsContact C-N 3.34Å; F206-D208 PolarHBondContact O-N 2.8Å; F206-L209 HydrophobicContact CD2-CD2 3.99Å; F206-L209 HydrophobicContact CE2-CD2 4.17Å; F206-L218 HydrophobicContact CB-CD1 3.9Å; F206-L218 HydrophobicContact CD1-CD1 3.71Å; F206-L218 HydrophobicContact CD1-CD2 4.36Å; F206-L218 HydrophobicContact CD1-CG 4.02Å; F206-L218 HydrophobicContact CD2-CD1 3.63Å; F206-L218 HydrophobicContact CE1-CD1 4.09Å; F206-L218 HydrophobicContact CE1-CD2 4.06Å; F206-L218 HydrophobicContact CE1-CG 4.23Å; F206-L218 HydrophobicContact CE2-CD1 4.05Å; F206-L218 HydrophobicContact CG-CD1 3.46Å; F206-L218 VanDerWaalsContact CG-CD1 3.46Å; F206-L218 HydrophobicContact CG-CG 4.29Å; F206-L218 HydrophobicContact CZ-CD1 4.25Å; F206-L218 HydrophobicContact CZ-CD2 4.27Å; F206-W269 HydrophobicContact CE2-CD2 4.18Å; F206-W269 HydrophobicContact CE2-CE3 4.23Å; F206-W269 HydrophobicContact CE2-CG 4.32Å; F206-W269 HydrophobicContact CZ-CD2 4.08Å; F206-W269 AromaticContact CZ-CE3 3.76Å; F206-W269 HydrophobicContact CZ-CE3 3.76Å; F206-W269 HydrophobicContact CZ-CH2 4.48Å; F206-W269 AromaticContact CZ-CZ3 3.98Å; F206-W269 HydrophobicContact CZ-CZ3 3.98Å
207T95.8Very high94.9Very high83 Ų8352.3 Ų52.351%0.50930%0.301SS..  trans-67-35.6-177.4540000112.8Q199 T200 G202Q199-T207 CarbonylContact O-C 3.55Å; T200-T207 CarbonylContact C-O 3.52Å; G202-T207 VanDerWaalsContact CA-O 3.24Å; G202-T207 WeakPolarHBondContact CA-O 3.45Å; G202-T207 PolarHBondContact N-O 2.7Å
208D96Very high95.1Very high48 Ų4851.8 Ų51.826%0.25730%0.297SS..  trans-90.3109.3176.1-173.3-8.8000110.6Q199 F206 T210 A211Q199-D208 WeakPolarHBondContact CA-OD1 3.42Å; Q199-D208 WeakPolarHBondContact O-CA 3.06Å; Q199-D208 WeakPolarHBondContact O-CB 3.23Å; F206-D208 VanDerWaalsContact C-N 3.34Å; F206-D208 PolarHBondContact O-N 2.8Å; D208-T210 VanDerWaalsContact C-N 3.26Å; D208-T210 PolarHBondContact O-N 2.94Å; D208-T210 WeakPolarHBondContact OD1-CA 3.26Å; D208-T210 WeakPolarHBondContact OD1-CB 3.08Å; D208-T210 PolarHBondContact OD1-N 3.48Å; D208-T210 PolarHBondContact OD1-OG1 3.15Å; D208-T210 PolarHBondContact OD2-OG1 2.9Å; D208-A211 HydrophobicContact CB-CB 4.17Å; D208-A211 PolarHBondContact OD1-N 2.88Å; D208-A211 WeakPolarHBondContact OD2-CB 3.26Å
209L96.2Very high95.2Very high0 Ų051.7 Ų51.70%030%0.297CS..SBendtrans-76.7-15.1178.4-67.6175.9000113W93 I97 L198 F206 S265 A266W93-L209 HydrophobicContact CB-CD1 3.46Å; W93-L209 VanDerWaalsContact CB-CD1 3.46Å; I97-L209 HydrophobicContact CD1-CD1 4.28Å; L198-L209 HydrophobicContact CD2-CB 4.23Å; L198-L209 WeakPolarHBondContact O-CB 3.32Å; L198-L209 PolarHBondContact O-N 2.77Å; L198-L209 VanDerWaalsContact O-N 3.1Å; F206-L209 HydrophobicContact CD2-CD2 3.99Å; F206-L209 HydrophobicContact CE2-CD2 4.17Å; L209-S265 PolarHBondContact O-N 3.44Å; L209-A266 HydrophobicContact CB-CB 4.07Å; L209-A266 WeakPolarHBondContact O-CB 3.47Å; L209-A266 PolarHBondContact O-N 3.49Å
210T95.9Very high95.5Very high32 Ų3253.1 Ų53.120%0.19630%0.302CS..SBendtrans-86.5-28.5-179.473.60000112.4V191 L198 Q199 D208 P264V191-T210 HydrophobicContact CG1-CG2 4.44Å; L198-T210 HydrophobicContact CB-CG2 3.77Å; Q199-T210 HydrophobicContact CG-CG2 4.16Å; D208-T210 VanDerWaalsContact C-N 3.26Å; D208-T210 PolarHBondContact O-N 2.94Å; D208-T210 WeakPolarHBondContact OD1-CA 3.26Å; D208-T210 WeakPolarHBondContact OD1-CB 3.08Å; D208-T210 PolarHBondContact OD1-N 3.48Å; D208-T210 PolarHBondContact OD1-OG1 3.15Å; D208-T210 PolarHBondContact OD2-OG1 2.9Å; T210-P264 WeakPolarHBondContact O-CB 3.48Å
211A95Very high95.7Very high39 Ų3951.1 Ų51.132%0.32229%0.286SS..SBendtrans-87.4159.8174.600000112.7D208 S265D208-A211 HydrophobicContact CB-CB 4.17Å; D208-A211 PolarHBondContact OD1-N 2.88Å; D208-A211 WeakPolarHBondContact OD2-CB 3.26Å; A211-S265 WeakPolarHBondContact O-CB 3.33Å; A211-S265 PolarHBondContact O-N 3.12Å; A211-S265 PolarHBondContact O-OG 3.39Å
212S96.2Very high95.9Very high55 Ų5550.7 Ų50.739%0.38528%0.282SS..BIsolated β-bridgetrans-67.2152.4170.452.50000111.7P214 M263S212-P214 WeakPolarHBondContact O-CD 3.33Å; S212-P214 VanDerWaalsContact O-N 3.16Å; S212-M263 WeakPolarHBondContact CA-O 3.23Å
213D96.3Very high96Very high4 Ų450.9 Ų50.92%0.02128%0.28CS..PPolyproline II helixtrans-61.5116.9177.8-179.9-14.3000110.1W205 Y215 C216 I217 L218 S265W205-D213 VanDerWaalsContact CD1-OD1 3.26Å; W205-D213 PolarHBondContact NE1-OD1 3.5Å; W205-D213 PolarHBondContact NE1-OD2 3.43Å; D213-Y215 PolarHBondContact O-N 2.83Å; D213-Y215 VanDerWaalsContact O-N 3.13Å; D213-Y215 PolarHBondContact OD1-N 3.31Å; D213-C216 PolarHBondContact O-N 2.89Å; D213-C216 PolarHBondContact OD1-N 3.04Å; D213-I217 PolarHBondContact OD2-N 2.89Å; D213-I217 VanDerWaalsContact OD2-N 3.07Å; D213-L218 HydrophobicContact CB-CB 4.21Å; D213-L218 HydrophobicContact CB-CD1 4.4Å; D213-L218 VanDerWaalsContact OD2-CB 3.24Å; D213-L218 WeakPolarHBondContact OD2-CB 3.1Å; D213-L218 WeakPolarHBondContact OD2-CG 3.49Å; D213-L218 PolarHBondContact OD2-N 2.76Å; D213-S265 PolarHBondContact N-OG 2.88Å; D213-S265 VanDerWaalsContact N-OG 3.16Å
214P94.8Very high96.1Very high90 Ų9050.7 Ų50.758%0.58428%0.281SS*.THydrogen-bonded Turntrans-61.5-24.3-176.124-33.9000113.7S212S212-P214 WeakPolarHBondContact O-CD 3.33Å; S212-P214 VanDerWaalsContact O-N 3.16Å
215Y96Very high96.2Very high162 Ų16248.2 Ų48.264%0.63526%0.258SS*.THydrogen-bonded Turntrans-109.21.7-177.2-56.7-70.3000113.4W205 D213 I217W205-Y215 HydrophobicContact CB-CD2 3.82Å; W205-Y215 HydrophobicContact CB-CE2 3.94Å; W205-Y215 AromaticContact CD1-CD2 3.89Å; W205-Y215 HydrophobicContact CG-CD2 4.08Å; D213-Y215 PolarHBondContact O-N 2.83Å; D213-Y215 VanDerWaalsContact O-N 3.13Å; D213-Y215 PolarHBondContact OD1-N 3.31Å; Y215-I217 HydrophobicContact CG-CD1 4.42Å; Y215-I217 PolarHBondContact O-N 3.09Å
216C95.6Very high96.2Very high43 Ų4345.4 Ų45.429%0.29125%0.249SC..SBendtrans54.619.6-176.5-67.10000115D213 F220 F257D213-C216 PolarHBondContact O-N 2.89Å; D213-C216 PolarHBondContact OD1-N 3.04Å; C216-F220 WeakPolarHBondContact O-CB 3.38Å; C216-F220 PolarHBondContact O-N 3.36Å; C216-F220 VanDerWaalsContact O-N 3.14Å; C216-F257 HydrophobicContact CB-CZ 4.35Å
217I97.1Very high96.2Very high70 Ų7048 Ų4836%0.35926%0.263SS..Hα-helixtrans-70.6-43.1-178.6-61.2168.6000110W205 D213 Y215 F220 L221W205-I217 HydrophobicContact CD2-CD1 4.02Å; W205-I217 HydrophobicContact CG-CD1 4.24Å; W205-I217 HydrophobicContact CH2-CG2 3.87Å; W205-I217 HydrophobicContact CZ2-CB 3.73Å; W205-I217 HydrophobicContact CZ2-CD1 4.39Å; W205-I217 HydrophobicContact CZ2-CG2 3.33Å; D213-I217 PolarHBondContact OD2-N 2.89Å; D213-I217 VanDerWaalsContact OD2-N 3.07Å; Y215-I217 HydrophobicContact CG-CD1 4.42Å; Y215-I217 PolarHBondContact O-N 3.09Å; I217-F220 PolarHBondContact O-N 3.27Å; I217-L221 VanDerWaalsContact O-CB 3.27Å; I217-L221 WeakPolarHBondContact O-CB 3.27Å; I217-L221 PolarHBondContact O-N 2.96Å
218L96Very high96Very high1 Ų148 Ų481%0.00526%0.26CS..Hα-helixtrans-60.6-53175.7-80178.1000112.3W205 F206 D213 F220 L221 S222 V268 W269W205-L218 HydrophobicContact CZ2-CG 4.44Å; F206-L218 HydrophobicContact CB-CD1 3.9Å; F206-L218 HydrophobicContact CD1-CD1 3.71Å; F206-L218 HydrophobicContact CD1-CD2 4.36Å; F206-L218 HydrophobicContact CD1-CG 4.02Å; F206-L218 HydrophobicContact CD2-CD1 3.63Å; F206-L218 HydrophobicContact CE1-CD1 4.09Å; F206-L218 HydrophobicContact CE1-CD2 4.06Å; F206-L218 HydrophobicContact CE1-CG 4.23Å; F206-L218 HydrophobicContact CE2-CD1 4.05Å; F206-L218 HydrophobicContact CG-CD1 3.46Å; F206-L218 VanDerWaalsContact CG-CD1 3.46Å; F206-L218 HydrophobicContact CG-CG 4.29Å; F206-L218 HydrophobicContact CZ-CD1 4.25Å; F206-L218 HydrophobicContact CZ-CD2 4.27Å; D213-L218 HydrophobicContact CB-CB 4.21Å; D213-L218 HydrophobicContact CB-CD1 4.4Å; D213-L218 VanDerWaalsContact OD2-CB 3.24Å; D213-L218 WeakPolarHBondContact OD2-CB 3.1Å; D213-L218 WeakPolarHBondContact OD2-CG 3.49Å; D213-L218 PolarHBondContact OD2-N 2.76Å; L218-F220 VanDerWaalsContact C-N 3.29Å; L218-F220 PolarHBondContact O-N 3.31Å; L218-L221 PolarHBondContact O-N 3.24Å; L218-S222 VanDerWaalsContact O-CB 3.25Å; L218-S222 WeakPolarHBondContact O-CB 3.29Å; L218-S222 PolarHBondContact O-N 3.12Å; L218-V268 HydrophobicContact CB-CG1 3.87Å; L218-W269 HydrophobicContact CD2-CE3 3.62Å; L218-W269 HydrophobicContact CD2-CZ3 4.1Å
219P97Very high95.8Very high1 Ų146.5 Ų46.51%0.00625%0.252CS..Hα-helixtrans-48.5-49.2170.9-34.437.5000113.4S222 M223 F257 V260 V268P219-S222 PolarHBondContact O-N 3.39Å; P219-M223 WeakPolarHBondContact O-CG 3.47Å; P219-M223 PolarHBondContact O-N 3.39Å; P219-F257 HydrophobicContact CB-CD2 3.89Å; P219-F257 HydrophobicContact CB-CE2 3.68Å; P219-V260 HydrophobicContact CB-CG2 3.93Å; P219-V268 HydrophobicContact CG-CG1 4.16Å
220F97.6Very high95.4Very high131 Ų13149.3 Ų49.358%0.57526%0.264SS*.Hα-helixtrans-64.5-47.6-177.8178.2-99.9000111.7C216 I217 L218 M223 S224 F257C216-F220 WeakPolarHBondContact O-CB 3.38Å; C216-F220 PolarHBondContact O-N 3.36Å; C216-F220 VanDerWaalsContact O-N 3.14Å; I217-F220 PolarHBondContact O-N 3.27Å; L218-F220 VanDerWaalsContact C-N 3.29Å; L218-F220 PolarHBondContact O-N 3.31Å; F220-M223 PolarHBondContact O-N 3.38Å; F220-S224 VanDerWaalsContact O-CB 3.23Å; F220-S224 WeakPolarHBondContact O-CB 3.38Å; F220-S224 PolarHBondContact O-N 2.86Å; F220-S224 PolarHBondContact O-OG 3.19Å; F220-F257 HydrophobicContact CB-CD2 4.47Å; F220-F257 HydrophobicContact CB-CE2 3.88Å
221L97.1Very high95Very high73 Ų7350.1 Ų50.138%0.38227%0.266SS..Hα-helixtrans-61.6-47178.7179.761.5000111.1I217 L218 M223 S224 L225 T272I217-L221 VanDerWaalsContact O-CB 3.27Å; I217-L221 WeakPolarHBondContact O-CB 3.27Å; I217-L221 PolarHBondContact O-N 2.96Å; L218-L221 PolarHBondContact O-N 3.24Å; L221-M223 PolarHBondContact O-N 3.36Å; L221-S224 PolarHBondContact O-N 2.89Å; L221-L225 HydrophobicContact CD1-CD1 4.24Å; L221-L225 HydrophobicContact CD1-CG 4.3Å; L221-L225 HydrophobicContact CG-CD1 4.09Å; L221-L225 WeakPolarHBondContact O-CB 3.27Å; L221-L225 VanDerWaalsContact O-CG 3.29Å; L221-L225 WeakPolarHBondContact O-CG 3.38Å; L221-L225 PolarHBondContact O-N 3.39Å; L221-T272 HydrophobicContact CD2-CG2 3.77Å; L221-T272 HydrophobicContact CG-CG2 3.98Å
222S97Very high94.4Very high0 Ų049.6 Ų49.60%026%0.259CS..Hα-helixtrans-57.9-48.5179.3-172.40000112.2L218 P219 L225 L226 W271 T272 N275L218-S222 VanDerWaalsContact O-CB 3.25Å; L218-S222 WeakPolarHBondContact O-CB 3.29Å; L218-S222 PolarHBondContact O-N 3.12Å; P219-S222 PolarHBondContact O-N 3.39Å; S222-L225 PolarHBondContact O-N 3.25Å; S222-L226 PolarHBondContact O-N 2.93Å; S222-W271 WeakPolarHBondContact OG-CB 3.36Å; S222-T272 WeakPolarHBondContact CB-OG1 3.4Å; S222-N275 PolarHBondContact O-ND2 2.91Å; S222-N275 PolarHBondContact OG-ND2 2.8Å
223M97.3Very high93.5Very high15 Ų1547.2 Ų47.27%0.07424%0.243CC..Hα-helixtrans-72.5-33.3-179.6-65.4-57.3103.900112.3P219 F220 L221 L226 L227 P253 F257 V260P219-M223 WeakPolarHBondContact O-CG 3.47Å; P219-M223 PolarHBondContact O-N 3.39Å; F220-M223 PolarHBondContact O-N 3.38Å; L221-M223 PolarHBondContact O-N 3.36Å; M223-L226 PolarHBondContact O-N 3.4Å; M223-L226 HydrophobicContact SD-CD2 4.29Å; M223-L227 WeakPolarHBondContact O-CB 3.46Å; M223-L227 PolarHBondContact O-N 3.31Å; M223-P253 HydrophobicContact CB-CB 4.25Å; M223-P253 WeakPolarHBondContact CG-O 3.36Å; M223-F257 HydrophobicContact CB-CB 4.44Å; M223-F257 HydrophobicContact CG-CB 3.93Å; M223-V260 HydrophobicContact CE-CG1 4.35Å; M223-V260 HydrophobicContact CE-CG2 4.21Å; M223-V260 HydrophobicContact CG-CG2 4.25Å
224S96.8Very high91.7Very high46 Ų4649.4 Ų49.432%0.32226%0.262SS..Hα-helixtrans-64-42.6172.8-63.10000111.7F220 L221 L226 L227 L228F220-S224 VanDerWaalsContact O-CB 3.23Å; F220-S224 WeakPolarHBondContact O-CB 3.38Å; F220-S224 PolarHBondContact O-N 2.86Å; F220-S224 PolarHBondContact O-OG 3.19Å; L221-S224 PolarHBondContact O-N 2.89Å; S224-L226 VanDerWaalsContact C-N 3.34Å; S224-L226 PolarHBondContact O-N 3.33Å; S224-L227 PolarHBondContact O-N 3.07Å; S224-L228 WeakPolarHBondContact O-CB 3.45Å; S224-L228 PolarHBondContact O-N 2.72Å
225L96.8Very high90.1Very high20 Ų2045.7 Ų45.711%0.10524%0.237CC..Hα-helixtrans-63.8-38.7174.1-73.1168.9000112L221 S222 L228 T229 T272 N275 L276 L279L221-L225 HydrophobicContact CD1-CD1 4.24Å; L221-L225 HydrophobicContact CD1-CG 4.3Å; L221-L225 HydrophobicContact CG-CD1 4.09Å; L221-L225 WeakPolarHBondContact O-CB 3.27Å; L221-L225 VanDerWaalsContact O-CG 3.29Å; L221-L225 WeakPolarHBondContact O-CG 3.38Å; L221-L225 PolarHBondContact O-N 3.39Å; S222-L225 PolarHBondContact O-N 3.25Å; L225-L228 PolarHBondContact O-N 2.89Å; L225-T229 WeakPolarHBondContact O-CB 3.38Å; L225-T229 PolarHBondContact O-N 2.89Å; L225-T229 PolarHBondContact O-OG1 2.79Å; L225-T272 HydrophobicContact CD1-CG2 4Å; L225-N275 HydrophobicContact CB-CB 3.82Å; L225-L276 HydrophobicContact CD1-CB 4.09Å; L225-L276 HydrophobicContact CD2-CD1 4.11Å; L225-L279 HydrophobicContact CD2-CD2 3.88Å
226L94.7Very high88.1Confident34 Ų3440.1 Ų40.118%0.17822%0.218CC..Hα-helixtrans-64.7-47.4175.2-178.160.3000111.6S222 M223 S224 L228 T229 F230 P253S222-L226 PolarHBondContact O-N 2.93Å; M223-L226 PolarHBondContact O-N 3.4Å; M223-L226 HydrophobicContact SD-CD2 4.29Å; S224-L226 VanDerWaalsContact C-N 3.34Å; S224-L226 PolarHBondContact O-N 3.33Å; L226-L228 VanDerWaalsContact C-N 3.32Å; L226-L228 PolarHBondContact O-N 3.29Å; L226-T229 WeakPolarHBondContact O-CB 3.3Å; L226-T229 PolarHBondContact O-N 3.46Å; L226-T229 VanDerWaalsContact O-N 3.15Å; L226-F230 HydrophobicContact CD1-CE1 4.4Å; L226-F230 HydrophobicContact CD1-CE2 3.84Å; L226-F230 HydrophobicContact CD1-CZ 3.77Å; L226-F230 HydrophobicContact CD2-CE2 4.28Å; L226-F230 HydrophobicContact CG-CD2 4.32Å; L226-F230 HydrophobicContact CG-CE2 3.76Å; L226-F230 HydrophobicContact CG-CZ 4.21Å; L226-F230 PolarHBondContact O-N 3.46Å; L226-P253 HydrophobicContact CB-CG 4.5Å; L226-P253 HydrophobicContact CD2-CB 4.47Å; L226-P253 HydrophobicContact CD2-CG 4.14Å; L226-P253 HydrophobicContact CG-CG 4.1Å
227L94.1Very high86.2Confident60 Ų6045.9 Ų45.931%0.31423%0.233SC..Hα-helixtrans-58.5-45.4175.8-178.663.9000111.1M223 S224 T229 F230 E231 R250 P253M223-L227 WeakPolarHBondContact O-CB 3.46Å; M223-L227 PolarHBondContact O-N 3.31Å; S224-L227 PolarHBondContact O-N 3.07Å; L227-T229 VanDerWaalsContact C-N 3.3Å; L227-T229 PolarHBondContact O-N 3.37Å; L227-F230 PolarHBondContact O-N 2.89Å; L227-E231 PolarHBondContact O-N 3.3Å; L227-R250 HydrophobicContact CD1-CB 4.48Å; L227-R250 HydrophobicContact CD1-CG 4.25Å; L227-P253 HydrophobicContact CB-CB 4.15Å; L227-P253 HydrophobicContact CB-CG 4.03Å; L227-P253 HydrophobicContact CD1-CG 4.26Å
228L93.6Very high84.1Confident84 Ų8443 Ų4344%0.4422%0.219SC..Hα-helixtrans-64.3-35.5177.1-173.958.9000112S224 L225 L226 F230 E231 T232 L279S224-L228 WeakPolarHBondContact O-CB 3.45Å; S224-L228 PolarHBondContact O-N 2.72Å; L225-L228 PolarHBondContact O-N 2.89Å; L226-L228 VanDerWaalsContact C-N 3.32Å; L226-L228 PolarHBondContact O-N 3.29Å; L228-F230 VanDerWaalsContact C-N 3.34Å; L228-F230 PolarHBondContact O-N 3.31Å; L228-E231 PolarHBondContact O-N 3.29Å; L228-T232 HydrophobicContact CD1-CG2 4.05Å; L228-T232 HydrophobicContact CG-CG2 4.28Å; L228-T232 WeakPolarHBondContact O-CB 3.18Å; L228-T232 VanDerWaalsContact O-CG2 3.25Å; L228-T232 WeakPolarHBondContact O-CG2 3.36Å; L228-T232 PolarHBondContact O-N 3.46Å; L228-T232 PolarHBondContact O-OG1 3.47Å; L228-L279 HydrophobicContact CB-CD1 4.47Å; L228-L279 HydrophobicContact CD2-CD1 4.21Å; L228-L279 HydrophobicContact CD2-CD2 3.56Å; L228-L279 HydrophobicContact CG-CD1 3.85Å; L228-L279 HydrophobicContact CG-CD2 4.09Å
229T91.5Very high82Confident16 Ų1644.5 Ų44.510%0.09823%0.234CC..Hα-helixtrans-62.3-41.6174-60.40000111.2L225 L226 L227 T232 G233L225-T229 WeakPolarHBondContact O-CB 3.38Å; L225-T229 PolarHBondContact O-N 2.89Å; L225-T229 PolarHBondContact O-OG1 2.79Å; L226-T229 WeakPolarHBondContact O-CB 3.3Å; L226-T229 PolarHBondContact O-N 3.46Å; L226-T229 VanDerWaalsContact O-N 3.15Å; L227-T229 VanDerWaalsContact C-N 3.3Å; L227-T229 PolarHBondContact O-N 3.37Å; T229-T232 WeakPolarHBondContact CA-OG1 3.5Å; T229-T232 PolarHBondContact O-OG1 3.49Å; T229-T232 VanDerWaalsContact O-OG1 3.08Å; T229-G233 PolarHBondContact O-N 2.87Å
230F88.2Confident80Confident59 Ų5945.4 Ų45.426%0.25924%0.239SC..Hα-helixtrans-67.8-42.9174.6-66.4-39.6000112.6L226 L227 L228 T232 G233 L236 S249 L252 P253L226-F230 HydrophobicContact CD1-CE1 4.4Å; L226-F230 HydrophobicContact CD1-CE2 3.84Å; L226-F230 HydrophobicContact CD1-CZ 3.77Å; L226-F230 HydrophobicContact CD2-CE2 4.28Å; L226-F230 HydrophobicContact CG-CD2 4.32Å; L226-F230 HydrophobicContact CG-CE2 3.76Å; L226-F230 HydrophobicContact CG-CZ 4.21Å; L226-F230 PolarHBondContact O-N 3.46Å; L227-F230 PolarHBondContact O-N 2.89Å; L228-F230 VanDerWaalsContact C-N 3.34Å; L228-F230 PolarHBondContact O-N 3.31Å; F230-T232 VanDerWaalsContact C-N 3.33Å; F230-T232 PolarHBondContact O-N 3.06Å; F230-G233 PolarHBondContact O-N 2.78Å; F230-L236 HydrophobicContact CB-CD2 4.12Å; F230-S249 WeakPolarHBondContact CD2-O 3.49Å; F230-L252 HydrophobicContact CE2-CD2 4.24Å; F230-L252 HydrophobicContact CZ-CD2 4.28Å; F230-P253 HydrophobicContact CD2-CG 4.13Å; F230-P253 HydrophobicContact CE2-CG 4.12Å
231E85.5Confident78.3Confident50 Ų5040 Ų4023%0.23422%0.217CC..Hα-helixtrans-69.6-28.4179.5-74.2-66.8162.400113.1L227 L228 R237 R250L227-E231 PolarHBondContact O-N 3.3Å; L228-E231 PolarHBondContact O-N 3.29Å; E231-R237 VanDerWaalsContact O-CD 3.31Å; E231-R237 WeakPolarHBondContact O-CD 3.47Å; E231-R237 IonicContact OE2-NH1 3.3Å; E231-R237 PolarHBondContact OE2-NH1 3.3Å; E231-R250 IonicContact OE1-CZ 3.78Å; E231-R250 VanDerWaalsContact OE1-CZ 3.23Å; E231-R250 IonicContact OE1-NE 3.96Å; E231-R250 PolarHBondContact OE1-NE 3.03Å; E231-R250 IonicContact OE1-NH2 3.46Å; E231-R250 PolarHBondContact OE1-NH2 3.32Å; E231-R250 IonicContact OE2-NH2 2.68Å
232T84Confident76.8Confident27 Ų2740.3 Ų40.317%0.16622%0.216CC..Hα-helixtrans-80.9-18.9173.854.30000113.2L228 T229 F230 A234 L279 S282L228-T232 HydrophobicContact CD1-CG2 4.05Å; L228-T232 HydrophobicContact CG-CG2 4.28Å; L228-T232 WeakPolarHBondContact O-CB 3.18Å; L228-T232 VanDerWaalsContact O-CG2 3.25Å; L228-T232 WeakPolarHBondContact O-CG2 3.36Å; L228-T232 PolarHBondContact O-N 3.46Å; L228-T232 PolarHBondContact O-OG1 3.47Å; T229-T232 WeakPolarHBondContact CA-OG1 3.5Å; T229-T232 PolarHBondContact O-OG1 3.49Å; T229-T232 VanDerWaalsContact O-OG1 3.08Å; F230-T232 VanDerWaalsContact C-N 3.33Å; F230-T232 PolarHBondContact O-N 3.06Å; T232-A234 PolarHBondContact O-N 2.89Å; T232-A234 VanDerWaalsContact O-N 3.09Å; T232-L279 HydrophobicContact CG2-CD1 3.97Å; T232-S282 PolarHBondContact OG1-OG 3.21Å
233G76.5Confident75.6Confident6 Ų644.2 Ų44.26%0.06224%0.241CC..  trans-65.5103.4176.100000111.9T229 F230 E235 L236 R237T229-G233 PolarHBondContact O-N 2.87Å; F230-G233 PolarHBondContact O-N 2.78Å; G233-E235 PolarHBondContact O-N 2.93Å; G233-E235 VanDerWaalsContact O-N 3.1Å; G233-L236 PolarHBondContact O-N 3.44Å; G233-L236 VanDerWaalsContact O-N 3.1Å; G233-R237 PolarHBondContact O-N 3.45Å
234A58.9Low74.6Confident49 Ų4948.6 Ų48.641%0.40527%0.269SS..THydrogen-bonded Turntrans-56.4-29.4-179.200000113.5T232 L236 R237 S238T232-A234 PolarHBondContact O-N 2.89Å; T232-A234 VanDerWaalsContact O-N 3.09Å; A234-L236 VanDerWaalsContact C-N 3.33Å; A234-L236 PolarHBondContact O-N 3.33Å; A234-R237 PolarHBondContact O-N 2.85Å; A234-S238 PolarHBondContact O-N 3.24Å
235E60.7Low73.8Confident13 Ų1350.3 Ų50.36%0.06127%0.274CS..THydrogen-bonded Turntrans-65.5-36.1-179.4-66.6143.7172.100111.8R116 L119 G233 S238 T241 V299R116-E235 IonicContact CZ-OE2 3.24Å; R116-E235 IonicContact NH1-OE2 3.21Å; R116-E235 PolarHBondContact NH1-OE2 3.48Å; L119-E235 HydrophobicContact CD2-CB 4.26Å; L119-E235 VanDerWaalsContact CD2-CD 3.5Å; L119-E235 HydrophobicContact CD2-CG 4.28Å; L119-E235 WeakPolarHBondContact CD2-OE2 3.18Å; L119-E235 HydrophobicContact CG-CB 4.16Å; L119-E235 HydrophobicContact CG-CG 3.98Å; G233-E235 PolarHBondContact O-N 2.93Å; G233-E235 VanDerWaalsContact O-N 3.1Å; E235-S238 WeakPolarHBondContact O-CB 3.27Å; E235-S238 PolarHBondContact O-OG 3.44Å; E235-T241 PolarHBondContact O-OG1 3.35Å; E235-T241 VanDerWaalsContact O-OG1 3.12Å; E235-V299 HydrophobicContact CG-CG2 4.33Å
236L55.3Low73Confident45 Ų4553 Ų5324%0.23628%0.283CS..THydrogen-bonded Turntrans-82.9-25.4-178.8-140.973.2000113.2F230 G233 A234 S238 T241 I245 S249F230-L236 HydrophobicContact CB-CD2 4.12Å; G233-L236 PolarHBondContact O-N 3.44Å; G233-L236 VanDerWaalsContact O-N 3.1Å; A234-L236 VanDerWaalsContact C-N 3.33Å; A234-L236 PolarHBondContact O-N 3.33Å; L236-S238 VanDerWaalsContact C-N 3.25Å; L236-T241 WeakPolarHBondContact CA-OG1 3.49Å; L236-T241 HydrophobicContact CD1-CG2 3.97Å; L236-T241 HydrophobicContact CG-CG2 4.16Å; L236-T241 WeakPolarHBondContact O-CB 3.5Å; L236-T241 PolarHBondContact O-OG1 3.39Å; L236-I245 HydrophobicContact CD1-CG2 3.81Å; L236-S249 VanDerWaalsContact CD2-OG 3.25Å; L236-S249 WeakPolarHBondContact CD2-OG 3.29Å
237R53.9Low72.6Confident164 Ų16455.4 Ų55.462%0.61930%0.298SS*.THydrogen-bonded Turntrans-78.8-9.6173.9-65.9-172.573.997.5-3113E231 G233 A234 G239E231-R237 VanDerWaalsContact O-CD 3.31Å; E231-R237 WeakPolarHBondContact O-CD 3.47Å; E231-R237 IonicContact OE2-NH1 3.3Å; E231-R237 PolarHBondContact OE2-NH1 3.3Å; G233-R237 PolarHBondContact O-N 3.45Å; A234-R237 PolarHBondContact O-N 2.85Å; R237-G239 PolarHBondContact O-N 2.89Å
238S53Low72.3Confident10 Ų1058.8 Ų58.87%0.0731%0.311CS..SBendtrans-53.2129.3169.764.90000107.6A234 E235 L236 Q240 T241A234-S238 PolarHBondContact O-N 3.24Å; E235-S238 WeakPolarHBondContact O-CB 3.27Å; E235-S238 PolarHBondContact O-OG 3.44Å; L236-S238 VanDerWaalsContact C-N 3.25Å; S238-Q240 PolarHBondContact O-N 3.25Å; S238-T241 PolarHBondContact O-N 3.48Å; S238-T241 PolarHBondContact OG-N 3.34Å; S238-T241 PolarHBondContact OG-OG1 3.41Å
239G51.9Low72Confident31 Ų3155.2 Ų55.232%0.3229%0.293SS..THydrogen-bonded Turntrans-59.1-0.3176.400000113.6R237R237-G239 PolarHBondContact O-N 2.89Å
240Q55.6Low71.9Confident21 Ų2159.9 Ų59.910%0.09831%0.309CS..THydrogen-bonded Turntrans-109.2-4.5-177.9-69.6174.4-13.200113.2P127 S238 Q242 P302P127-Q240 HydrophobicContact CB-CG 4.39Å; P127-Q240 VanDerWaalsContact CB-NE2 3.32Å; S238-Q240 PolarHBondContact O-N 3.25Å; Q240-Q242 PolarHBondContact O-N 2.88Å; Q240-Q242 VanDerWaalsContact O-N 3.1Å; Q240-P302 HydrophobicContact CG-CB 3.5Å; Q240-P302 VanDerWaalsContact NE2-CA 3.34Å
241T61.4Low72.1Confident18 Ų1859.1 Ų59.111%0.1131%0.313CS..SBendtrans-64.3115.9164.1-62.80000107.3E235 L236 S238 I245E235-T241 PolarHBondContact O-OG1 3.35Å; E235-T241 VanDerWaalsContact O-OG1 3.12Å; L236-T241 WeakPolarHBondContact CA-OG1 3.49Å; L236-T241 HydrophobicContact CD1-CG2 3.97Å; L236-T241 HydrophobicContact CG-CG2 4.16Å; L236-T241 WeakPolarHBondContact O-CB 3.5Å; L236-T241 PolarHBondContact O-OG1 3.39Å; S238-T241 PolarHBondContact O-N 3.48Å; S238-T241 PolarHBondContact OG-N 3.34Å; S238-T241 PolarHBondContact OG-OG1 3.41Å; T241-I245 HydrophobicContact CG2-CB 3.59Å; T241-I245 HydrophobicContact CG2-CD1 4.35Å; T241-I245 HydrophobicContact CG2-CG2 3.51Å
242Q66.2Low72.5Confident78 Ų7860.3 Ų60.336%0.36432%0.32SS..  trans-42.7133.8178.4-70.4-74.312.600109.8Q240 T244 I245 R246Q240-Q242 PolarHBondContact O-N 2.88Å; Q240-Q242 VanDerWaalsContact O-N 3.1Å; Q242-T244 PolarHBondContact O-N 3.31Å; Q242-I245 HydrophobicContact CB-CD1 4.07Å; Q242-I245 HydrophobicContact CB-CG1 4.16Å; Q242-I245 HydrophobicContact CG-CD1 4.47Å; Q242-I245 WeakPolarHBondContact O-CB 3.34Å; Q242-I245 PolarHBondContact O-N 3.45Å; Q242-R246 PolarHBondContact O-N 3.46Å
243P72.3Confident73Confident82 Ų8259.2 Ų59.253%0.53231%0.314SS..Hα-helixtrans-52.9-33.9-178.520.1-32.1000111.5I245 R246 V247P243-I245 PolarHBondContact O-N 3.46Å; P243-R246 PolarHBondContact O-N 2.86Å; P243-V247 WeakPolarHBondContact O-CG2 3.42Å; P243-V247 PolarHBondContact O-N 3.31Å
244T75.4Confident73.9Confident107 Ų10763.6 Ų63.666%0.65634%0.339SS*.Hα-helixtrans-55.6-45.2172.8-47.70000113.2Q242 V247 F248Q242-T244 PolarHBondContact O-N 3.31Å; T244-V247 PolarHBondContact O-N 3.27Å; T244-F248 WeakPolarHBondContact O-CB 3.4Å; T244-F248 PolarHBondContact O-N 2.98Å
245I80Confident75.6Confident82 Ų8265.8 Ų65.842%0.42135%0.347SS..Hα-helixtrans-67.3-40.4179.4-63.5170.3000110.1L236 T241 Q242 P243 F248 S249L236-I245 HydrophobicContact CD1-CG2 3.81Å; T241-I245 HydrophobicContact CG2-CB 3.59Å; T241-I245 HydrophobicContact CG2-CD1 4.35Å; T241-I245 HydrophobicContact CG2-CG2 3.51Å; Q242-I245 HydrophobicContact CB-CD1 4.07Å; Q242-I245 HydrophobicContact CB-CG1 4.16Å; Q242-I245 HydrophobicContact CG-CD1 4.47Å; Q242-I245 WeakPolarHBondContact O-CB 3.34Å; Q242-I245 PolarHBondContact O-N 3.45Å; P243-I245 PolarHBondContact O-N 3.46Å; I245-F248 PolarHBondContact O-N 2.91Å; I245-S249 WeakPolarHBondContact O-CB 3.5Å; I245-S249 PolarHBondContact O-N 2.98Å; I245-S249 PolarHBondContact O-OG 3.29Å
246R81.1Confident77.2Confident78 Ų7866 Ų6629%0.29435%0.353SS..Hα-helixtrans-66-41.9177.9-171.9-175.2-63.7163.44.5112.2Q242 P243 S249 R250Q242-R246 PolarHBondContact O-N 3.46Å; P243-R246 PolarHBondContact O-N 2.86Å; R246-S249 PolarHBondContact O-OG 2.65Å; R246-R250 VanDerWaalsContact O-CG 3.32Å; R246-R250 WeakPolarHBondContact O-CG 3.38Å; R246-R250 PolarHBondContact O-N 3.06Å
247V85.9Confident79.2Confident84 Ų8466.5 Ų66.551%0.50935%0.354SS..Hα-helixtrans-64.5-47.4174.5171.70000109.6P243 T244 S249 R250 A251P243-V247 WeakPolarHBondContact O-CG2 3.42Å; P243-V247 PolarHBondContact O-N 3.31Å; T244-V247 PolarHBondContact O-N 3.27Å; V247-S249 PolarHBondContact O-N 3.34Å; V247-R250 PolarHBondContact O-N 3.41Å; V247-A251 VanDerWaalsContact O-CB 3.32Å; V247-A251 WeakPolarHBondContact O-CB 3.49Å; V247-A251 PolarHBondContact O-N 3.06Å
248F87.5Confident81.2Confident130 Ų13063.9 Ų63.957%0.5735%0.351SS*.Hα-helixtrans-58.6-47178.4177.8-100000112.4T244 I245 R250 A251 L252T244-F248 WeakPolarHBondContact O-CB 3.4Å; T244-F248 PolarHBondContact O-N 2.98Å; I245-F248 PolarHBondContact O-N 2.91Å; F248-R250 PolarHBondContact O-N 2.96Å; F248-A251 PolarHBondContact O-N 3.37Å; F248-L252 HydrophobicContact CE1-CD2 4.27Å; F248-L252 HydrophobicContact CZ-CD1 4.33Å; F248-L252 HydrophobicContact CZ-CD2 4.47Å; F248-L252 VanDerWaalsContact O-CB 3.23Å; F248-L252 WeakPolarHBondContact O-CB 3.42Å; F248-L252 PolarHBondContact O-N 3.37Å
249S87.5Confident83.1Confident9 Ų969.9 Ų69.96%0.06338%0.376CS..Hα-helixtrans-64.7-25.1179.363.90000113.7F230 L236 I245 R246 V247 P253F230-S249 WeakPolarHBondContact CD2-O 3.49Å; L236-S249 VanDerWaalsContact CD2-OG 3.25Å; L236-S249 WeakPolarHBondContact CD2-OG 3.29Å; I245-S249 WeakPolarHBondContact O-CB 3.5Å; I245-S249 PolarHBondContact O-N 2.98Å; I245-S249 PolarHBondContact O-OG 3.29Å; R246-S249 PolarHBondContact O-OG 2.65Å; V247-S249 PolarHBondContact O-N 3.34Å; S249-P253 WeakPolarHBondContact O-CD 3.45Å
250R90.3Very high85.1Confident115 Ų11568.6 Ų68.643%0.43436%0.363SS..Hα-helixtrans-86.5-37.2175.5-71.6174.2175.5-178.8-2.9112.3L227 E231 R246 V247 F248 V254L227-R250 HydrophobicContact CD1-CB 4.48Å; L227-R250 HydrophobicContact CD1-CG 4.25Å; E231-R250 IonicContact OE1-CZ 3.78Å; E231-R250 VanDerWaalsContact OE1-CZ 3.23Å; E231-R250 IonicContact OE1-NE 3.96Å; E231-R250 PolarHBondContact OE1-NE 3.03Å; E231-R250 IonicContact OE1-NH2 3.46Å; E231-R250 PolarHBondContact OE1-NH2 3.32Å; E231-R250 IonicContact OE2-NH2 2.68Å; R246-R250 VanDerWaalsContact O-CG 3.32Å; R246-R250 WeakPolarHBondContact O-CG 3.38Å; R246-R250 PolarHBondContact O-N 3.06Å; V247-R250 PolarHBondContact O-N 3.41Å; F248-R250 PolarHBondContact O-N 2.96Å; R250-V254 WeakPolarHBondContact O-CG2 3.24Å
251A92.2Very high87Confident42 Ų4270 Ų7035%0.34737%0.369SS..Hα-helixtrans-70.7-35.1176.800000111.8V247 F248 V254 V255V247-A251 VanDerWaalsContact O-CB 3.32Å; V247-A251 WeakPolarHBondContact O-CB 3.49Å; V247-A251 PolarHBondContact O-N 3.06Å; F248-A251 PolarHBondContact O-N 3.37Å; A251-V254 WeakPolarHBondContact O-CB 3.45Å; A251-V254 PolarHBondContact O-N 3.08Å; A251-V254 VanDerWaalsContact O-N 3.09Å; A251-V255 WeakPolarHBondContact O-CG2 3.25Å; A251-V255 PolarHBondContact O-N 2.84Å
252L93.2Very high88.6Confident75 Ų7575.2 Ų75.239%0.39340%0.397SS..Hα-helixtrans-57.7-48.9-175.7177.871.4000112.9F230 F248 V254 G256F230-L252 HydrophobicContact CE2-CD2 4.24Å; F230-L252 HydrophobicContact CZ-CD2 4.28Å; F248-L252 HydrophobicContact CE1-CD2 4.27Å; F248-L252 HydrophobicContact CZ-CD1 4.33Å; F248-L252 HydrophobicContact CZ-CD2 4.47Å; F248-L252 VanDerWaalsContact O-CB 3.23Å; F248-L252 WeakPolarHBondContact O-CB 3.42Å; F248-L252 PolarHBondContact O-N 3.37Å; L252-V254 VanDerWaalsContact C-N 3.33Å; L252-V254 PolarHBondContact O-N 2.98Å; L252-G256 WeakPolarHBondContact O-CA 3.47Å; L252-G256 PolarHBondContact O-N 3.3Å
253P94Very high90Very high5 Ų572.8 Ų72.83%0.03239%0.386CS..Hα-helixtrans-64.2-33.5174-23.734.1000114M223 L226 L227 F230 S249 G256 F257M223-P253 HydrophobicContact CB-CB 4.25Å; M223-P253 WeakPolarHBondContact CG-O 3.36Å; L226-P253 HydrophobicContact CB-CG 4.5Å; L226-P253 HydrophobicContact CD2-CB 4.47Å; L226-P253 HydrophobicContact CD2-CG 4.14Å; L226-P253 HydrophobicContact CG-CG 4.1Å; L227-P253 HydrophobicContact CB-CB 4.15Å; L227-P253 HydrophobicContact CB-CG 4.03Å; L227-P253 HydrophobicContact CD1-CG 4.26Å; F230-P253 HydrophobicContact CD2-CG 4.13Å; F230-P253 HydrophobicContact CE2-CG 4.12Å; S249-P253 WeakPolarHBondContact O-CD 3.45Å; P253-G256 PolarHBondContact O-N 2.73Å; P253-F257 PolarHBondContact O-N 3.06Å
254V95.1Very high91.1Very high97 Ų9769.5 Ų69.559%0.58837%0.365SS*.Hα-helixtrans-68.4-47.3179.8177.60000110.9R250 A251 L252 G256 F257R250-V254 WeakPolarHBondContact O-CG2 3.24Å; A251-V254 WeakPolarHBondContact O-CB 3.45Å; A251-V254 PolarHBondContact O-N 3.08Å; A251-V254 VanDerWaalsContact O-N 3.09Å; L252-V254 VanDerWaalsContact C-N 3.33Å; L252-V254 PolarHBondContact O-N 2.98Å; V254-G256 VanDerWaalsContact C-N 3.34Å; V254-F257 WeakPolarHBondContact O-CB 3.41Å; V254-F257 PolarHBondContact O-N 3.35Å
255V95.4Very high92.1Very high95 Ų9564.5 Ų64.558%0.57633%0.334SS*.Hα-helixtrans-69-37.6174.4178.90000110.4A251 F257 L258 F259A251-V255 WeakPolarHBondContact O-CG2 3.25Å; A251-V255 PolarHBondContact O-N 2.84Å; V255-F257 VanDerWaalsContact C-N 3.28Å; V255-F257 PolarHBondContact O-N 2.74Å; V255-L258 WeakPolarHBondContact O-CB 3.23Å; V255-L258 PolarHBondContact O-N 3.14Å; V255-L258 VanDerWaalsContact O-N 3.1Å; V255-F259 PolarHBondContact O-N 3.07Å
256G94.3Very high93Very high18 Ų1860.6 Ų60.619%0.18631%0.314CS..Hα-helixtrans-59.5-35.8177.100000113L252 P253 V254 L258 F259 V260L252-G256 WeakPolarHBondContact O-CA 3.47Å; L252-G256 PolarHBondContact O-N 3.3Å; P253-G256 PolarHBondContact O-N 2.73Å; V254-G256 VanDerWaalsContact C-N 3.34Å; G256-L258 VanDerWaalsContact C-N 3.28Å; G256-L258 PolarHBondContact O-N 2.98Å; G256-F259 WeakPolarHBondContact O-CB 3.45Å; G256-F259 PolarHBondContact O-N 3.4Å; G256-V260 WeakPolarHBondContact O-CG2 3.31Å; G256-V260 PolarHBondContact O-N 3.33Å
257F96.9Very high93.7Very high56 Ų5656.9 Ų56.925%0.24630%0.3CS..Hα-helixtrans-55.5-43.5173.7177-97.7000111.9C216 P219 F220 M223 P253 V254 V255 F259 V260 M261C216-F257 HydrophobicContact CB-CZ 4.35Å; P219-F257 HydrophobicContact CB-CD2 3.89Å; P219-F257 HydrophobicContact CB-CE2 3.68Å; F220-F257 HydrophobicContact CB-CD2 4.47Å; F220-F257 HydrophobicContact CB-CE2 3.88Å; M223-F257 HydrophobicContact CB-CB 4.44Å; M223-F257 HydrophobicContact CG-CB 3.93Å; P253-F257 PolarHBondContact O-N 3.06Å; V254-F257 WeakPolarHBondContact O-CB 3.41Å; V254-F257 PolarHBondContact O-N 3.35Å; V255-F257 VanDerWaalsContact C-N 3.28Å; V255-F257 PolarHBondContact O-N 2.74Å; F257-F259 PolarHBondContact O-N 3.35Å; F257-V260 PolarHBondContact O-N 3.43Å; F257-M261 HydrophobicContact CD1-CE 4.16Å; F257-M261 HydrophobicContact CE1-CE 3.92Å; F257-M261 PolarHBondContact O-N 3.34Å
258L95.3Very high94.3Very high109 Ų10953 Ų5357%0.57128%0.276SS*.Hα-helixtrans-65.8-29.2178.6-55.3178.4000112.9V255 G256 M261V255-L258 WeakPolarHBondContact O-CB 3.23Å; V255-L258 PolarHBondContact O-N 3.14Å; V255-L258 VanDerWaalsContact O-N 3.1Å; G256-L258 VanDerWaalsContact C-N 3.28Å; G256-L258 PolarHBondContact O-N 2.98Å; L258-M261 HydrophobicContact CB-CE 4.2Å; L258-M261 HydrophobicContact CD2-CE 3.37Å; L258-M261 HydrophobicContact CG-CE 4.37Å; L258-M261 WeakPolarHBondContact O-CG 3.43Å
259F93.3Very high94.8Very high135 Ų13548.6 Ų48.659%0.59226%0.256SS*.Hα-helixtrans-78.4-42178.3-178.8-105.3000112.2V255 G256 F257 M263V255-F259 PolarHBondContact O-N 3.07Å; G256-F259 WeakPolarHBondContact O-CB 3.45Å; G256-F259 PolarHBondContact O-N 3.4Å; F257-F259 PolarHBondContact O-N 3.35Å; F259-M263 HydrophobicContact CD1-CE 4.08Å; F259-M263 HydrophobicContact CD1-SD 4.26Å; F259-M263 HydrophobicContact CE1-CE 3.23Å; F259-M263 HydrophobicContact CE1-SD 3.89Å; F259-M263 HydrophobicContact CE2-CE 4.34Å; F259-M263 HydrophobicContact CZ-CE 3.4Å
260V94.5Very high95.2Very high5 Ų548.9 Ų48.93%0.0326%0.256CS..Hα-helixtrans-84.4-15.3-175.3-57.40000113.8P219 M223 G256 F257 N262 M263 V268P219-V260 HydrophobicContact CB-CG2 3.93Å; M223-V260 HydrophobicContact CE-CG1 4.35Å; M223-V260 HydrophobicContact CE-CG2 4.21Å; M223-V260 HydrophobicContact CG-CG2 4.25Å; G256-V260 WeakPolarHBondContact O-CG2 3.31Å; G256-V260 PolarHBondContact O-N 3.33Å; F257-V260 PolarHBondContact O-N 3.43Å; V260-N262 PolarHBondContact O-N 3.1Å; V260-M263 HydrophobicContact CG1-SD 4.36Å; V260-M263 WeakPolarHBondContact O-CB 3.44Å; V260-M263 PolarHBondContact O-N 3.03Å; V260-M263 VanDerWaalsContact O-N 3.11Å; V260-V268 HydrophobicContact CB-CG2 4.34Å
261M95.2Very high95.5Very high49 Ų4945.6 Ų45.624%0.24124%0.243CC..THydrogen-bonded Turntrans-59.4-32-178.571.3164.379.800113.7F257 L258F257-M261 HydrophobicContact CD1-CE 4.16Å; F257-M261 HydrophobicContact CE1-CE 3.92Å; F257-M261 PolarHBondContact O-N 3.34Å; L258-M261 HydrophobicContact CB-CE 4.2Å; L258-M261 HydrophobicContact CD2-CE 3.37Å; L258-M261 HydrophobicContact CG-CE 4.37Å; L258-M261 WeakPolarHBondContact O-CG 3.43Å
262N94.4Very high95.7Very high128 Ų12843.8 Ų43.868%0.68423%0.228SC*.THydrogen-bonded Turntrans-996.8-179.1-63-52000112.9V260V260-N262 PolarHBondContact O-N 3.1Å
263M95.3Very high95.9Very high27 Ų2740.8 Ų40.813%0.13321%0.213CC..SBendtrans-85.4150.8179.2-72.9-165.6147.200111.4F184 S212 F259 V260 S265 V268 W271F184-M263 HydrophobicContact CE2-CE 4.41Å; S212-M263 WeakPolarHBondContact CA-O 3.23Å; F259-M263 HydrophobicContact CD1-CE 4.08Å; F259-M263 HydrophobicContact CD1-SD 4.26Å; F259-M263 HydrophobicContact CE1-CE 3.23Å; F259-M263 HydrophobicContact CE1-SD 3.89Å; F259-M263 HydrophobicContact CE2-CE 4.34Å; F259-M263 HydrophobicContact CZ-CE 3.4Å; V260-M263 HydrophobicContact CG1-SD 4.36Å; V260-M263 WeakPolarHBondContact O-CB 3.44Å; V260-M263 PolarHBondContact O-N 3.03Å; V260-M263 VanDerWaalsContact O-N 3.11Å; M263-S265 PolarHBondContact O-N 3.32Å; M263-V268 HydrophobicContact CB-CG2 3.94Å; M263-W271 HydrophobicContact SD-CH2 4Å; M263-W271 HydrophobicContact SD-CZ3 3.67Å
264P96.7Very high96Very high14 Ų1440.7 Ų40.79%0.09121%0.212CC..BIsolated β-bridgetrans-51.6137.3171.2-28.434.4000113.1V191 T210 A266 L267 V268V191-P264 HydrophobicContact CB-CB 4.49Å; V191-P264 HydrophobicContact CG1-CB 3.75Å; V191-P264 HydrophobicContact CG1-CG 3.64Å; V191-P264 HydrophobicContact CG2-CB 4.13Å; T210-P264 WeakPolarHBondContact O-CB 3.48Å; P264-A266 PolarHBondContact O-N 3.26Å; P264-A266 VanDerWaalsContact O-N 3.12Å; P264-L267 PolarHBondContact O-N 3.49Å; P264-V268 PolarHBondContact O-N 3.39Å
265S97Very high96.1Very high1 Ų136.6 Ų36.61%0.00719%0.187CC..Hα-helixtrans-57.5-30.9-177.2-62.90000112.2L209 A211 D213 M263 L267 V268 W269L209-S265 PolarHBondContact O-N 3.44Å; A211-S265 WeakPolarHBondContact O-CB 3.33Å; A211-S265 PolarHBondContact O-N 3.12Å; A211-S265 PolarHBondContact O-OG 3.39Å; D213-S265 PolarHBondContact N-OG 2.88Å; D213-S265 VanDerWaalsContact N-OG 3.16Å; M263-S265 PolarHBondContact O-N 3.32Å; S265-L267 VanDerWaalsContact C-N 3.32Å; S265-L267 PolarHBondContact O-N 2.99Å; S265-V268 PolarHBondContact O-N 3.03Å; S265-W269 WeakPolarHBondContact O-CB 3.33Å; S265-W269 PolarHBondContact O-N 3.13Å
266A97.3Very high96.1Very high0 Ų035.9 Ų35.90%018%0.18CC..Hα-helixtrans-53.9-45.7173.100000113.2I97 I187 V191 L209 P264 Y270I97-A266 HydrophobicContact CD1-CB 4.03Å; I187-A266 HydrophobicContact CG2-CB 3.57Å; V191-A266 HydrophobicContact CG2-CB 3.81Å; L209-A266 HydrophobicContact CB-CB 4.07Å; L209-A266 WeakPolarHBondContact O-CB 3.47Å; L209-A266 PolarHBondContact O-N 3.49Å; P264-A266 PolarHBondContact O-N 3.26Å; P264-A266 VanDerWaalsContact O-N 3.12Å; A266-Y270 PolarHBondContact O-N 3.38Å; A266-Y270 VanDerWaalsContact O-N 3.07Å
267L96.9Very high96.2Very high0 Ų035.8 Ų35.80%018%0.175CC..Hα-helixtrans-71.4-46.1-179.4-75.9169.9000110.7F184 I187 P264 S265 W269 Y270 W271F184-L267 HydrophobicContact CD2-CD2 3.72Å; F184-L267 HydrophobicContact CE2-CD1 4.03Å; F184-L267 HydrophobicContact CE2-CD2 3.98Å; F184-L267 HydrophobicContact CG-CD2 4.47Å; I187-L267 HydrophobicContact CB-CD2 3.72Å; I187-L267 HydrophobicContact CB-CG 4.39Å; I187-L267 HydrophobicContact CD1-CD2 4.32Å; I187-L267 HydrophobicContact CG2-CD2 3.66Å; I187-L267 HydrophobicContact CG2-CG 3.78Å; P264-L267 PolarHBondContact O-N 3.49Å; S265-L267 VanDerWaalsContact C-N 3.32Å; S265-L267 PolarHBondContact O-N 2.99Å; L267-W269 VanDerWaalsContact C-N 3.29Å; L267-W269 PolarHBondContact O-N 3.29Å; L267-Y270 WeakPolarHBondContact O-CB 3.23Å; L267-Y270 PolarHBondContact O-N 2.87Å; L267-W271 HydrophobicContact CB-CE3 4.2Å; L267-W271 HydrophobicContact CB-CZ3 3.93Å; L267-W271 PolarHBondContact O-N 3.27Å
268V97.3Very high96.1Very high2 Ų233.7 Ų33.71%0.01217%0.168CC..Hα-helixtrans-64.9-37.1-179.7-170.60000110.8L218 P219 V260 M263 P264 S265 W271 T272L218-V268 HydrophobicContact CB-CG1 3.87Å; P219-V268 HydrophobicContact CG-CG1 4.16Å; V260-V268 HydrophobicContact CB-CG2 4.34Å; M263-V268 HydrophobicContact CB-CG2 3.94Å; P264-V268 PolarHBondContact O-N 3.39Å; S265-V268 PolarHBondContact O-N 3.03Å; V268-W271 PolarHBondContact O-N 3.5Å; V268-T272 WeakPolarHBondContact O-CB 3.29Å; V268-T272 PolarHBondContact O-N 2.66Å; V268-T272 PolarHBondContact O-OG1 2.84Å
269W97.8Very high96Very high39 Ų3929.5 Ų29.515%0.14815%0.146CC..Hα-helixtrans-63-47.7173.8179.1-120.1000112W94 A98 F206 L218 S265 L267 W271 T272 V273W94-W269 AromaticContact CE3-CZ2 3.78Å; W94-W269 HydrophobicContact CE3-CZ2 3.78Å; W94-W269 HydrophobicContact CZ3-CZ2 4.24Å; W94-W269 PolarHBondContact O-NE1 3.4Å; A98-W269 HydrophobicContact CB-CZ2 4.23Å; F206-W269 HydrophobicContact CE2-CD2 4.18Å; F206-W269 HydrophobicContact CE2-CE3 4.23Å; F206-W269 HydrophobicContact CE2-CG 4.32Å; F206-W269 HydrophobicContact CZ-CD2 4.08Å; F206-W269 AromaticContact CZ-CE3 3.76Å; F206-W269 HydrophobicContact CZ-CE3 3.76Å; F206-W269 HydrophobicContact CZ-CH2 4.48Å; F206-W269 AromaticContact CZ-CZ3 3.98Å; F206-W269 HydrophobicContact CZ-CZ3 3.98Å; L218-W269 HydrophobicContact CD2-CE3 3.62Å; L218-W269 HydrophobicContact CD2-CZ3 4.1Å; S265-W269 WeakPolarHBondContact O-CB 3.33Å; S265-W269 PolarHBondContact O-N 3.13Å; L267-W269 VanDerWaalsContact C-N 3.29Å; L267-W269 PolarHBondContact O-N 3.29Å; W269-W271 VanDerWaalsContact C-N 3.31Å; W269-W271 PolarHBondContact O-N 2.89Å; W269-T272 HydrophobicContact CE3-CG2 4.49Å; W269-T272 HydrophobicContact CZ3-CG2 4.44Å; W269-T272 WeakPolarHBondContact O-CB 3.35Å; W269-T272 PolarHBondContact O-N 2.88Å; W269-T272 VanDerWaalsContact O-N 3.08Å; W269-V273 HydrophobicContact CD2-CG2 4.06Å; W269-V273 HydrophobicContact CE3-CG2 4.43Å; W269-V273 HydrophobicContact CH2-CG2 4.16Å; W269-V273 HydrophobicContact CZ2-CG2 3.73Å; W269-V273 HydrophobicContact CZ3-CG2 4.49Å; W269-V273 WeakPolarHBondContact O-CG2 3.28Å; W269-V273 PolarHBondContact O-N 2.93Å
270Y97Very high96.1Very high15 Ų1527.6 Ų27.66%0.05914%0.141CC..Hα-helixtrans-51.5-51.3170.9158.5-103.5000111.1T101 F180 V183 I187 A266 L267 T272 V273 S274T101-Y270 HydrophobicContact CG2-CD2 4.04Å; T101-Y270 HydrophobicContact CG2-CE2 3.97Å; T101-Y270 VanDerWaalsContact OG1-CD2 3.27Å; T101-Y270 WeakPolarHBondContact OG1-CD2 3.23Å; F180-Y270 HydrophobicContact CD2-CE1 4.23Å; F180-Y270 HydrophobicContact CE2-CE1 4.02Å; V183-Y270 HydrophobicContact CB-CE2 4.29Å; V183-Y270 HydrophobicContact CG1-CD1 4.29Å; V183-Y270 HydrophobicContact CG1-CD2 3.64Å; V183-Y270 HydrophobicContact CG1-CE1 4.01Å; V183-Y270 HydrophobicContact CG1-CE2 3.37Å; V183-Y270 HydrophobicContact CG1-CG 4.11Å; I187-Y270 HydrophobicContact CD1-CD1 4.34Å; I187-Y270 HydrophobicContact CD1-CD2 4.28Å; I187-Y270 HydrophobicContact CD1-CG 3.79Å; A266-Y270 PolarHBondContact O-N 3.38Å; A266-Y270 VanDerWaalsContact O-N 3.07Å; L267-Y270 WeakPolarHBondContact O-CB 3.23Å; L267-Y270 PolarHBondContact O-N 2.87Å; Y270-T272 VanDerWaalsContact C-N 3.31Å; Y270-T272 PolarHBondContact O-N 3.44Å; Y270-V273 PolarHBondContact O-N 2.8Å; Y270-S274 WeakPolarHBondContact O-CB 3.39Å; Y270-S274 PolarHBondContact O-N 3.26Å
271W95.6Very high95.9Very high45 Ų4527.8 Ų27.817%0.1714%0.142CC..Hα-helixtrans-59.5-41.2177.3-95.2-65.9000112.8F180 F184 S222 M263 L267 V268 W269 S274 N275F180-W271 AromaticContact CE2-CE2 3.9Å; F180-W271 AromaticContact CE2-CZ2 3.89Å; F180-W271 HydrophobicContact CE2-CZ2 3.89Å; F180-W271 AromaticContact CE2-NE1 3.72Å; F180-W271 HydrophobicContact CZ-CH2 4.39Å; F180-W271 AromaticContact CZ-CZ2 3.55Å; F180-W271 HydrophobicContact CZ-CZ2 3.55Å; F184-W271 AromaticContact CD2-CH2 3.87Å; F184-W271 HydrophobicContact CD2-CH2 3.87Å; F184-W271 HydrophobicContact CD2-CZ3 4.42Å; F184-W271 AromaticContact CE2-CH2 3.72Å; F184-W271 HydrophobicContact CE2-CH2 3.72Å; F184-W271 HydrophobicContact CE2-CZ3 4.25Å; S222-W271 WeakPolarHBondContact OG-CB 3.36Å; M263-W271 HydrophobicContact SD-CH2 4Å; M263-W271 HydrophobicContact SD-CZ3 3.67Å; L267-W271 HydrophobicContact CB-CE3 4.2Å; L267-W271 HydrophobicContact CB-CZ3 3.93Å; L267-W271 PolarHBondContact O-N 3.27Å; V268-W271 PolarHBondContact O-N 3.5Å; W269-W271 VanDerWaalsContact C-N 3.31Å; W269-W271 PolarHBondContact O-N 2.89Å; W271-S274 PolarHBondContact O-N 3.01Å; W271-N275 VanDerWaalsContact O-CB 3.27Å; W271-N275 WeakPolarHBondContact O-CB 3.11Å; W271-N275 PolarHBondContact O-N 3.3Å; W271-N275 PolarHBondContact O-ND2 3.35Å
272T97.5Very high95.7Very high5 Ų525.9 Ų25.93%0.03113%0.133CC..Hα-helixtrans-60.3-51.8179.9-56.90000110.7L221 S222 L225 V268 W269 Y270 S274 N275 L276L221-T272 HydrophobicContact CD2-CG2 3.77Å; L221-T272 HydrophobicContact CG-CG2 3.98Å; S222-T272 WeakPolarHBondContact CB-OG1 3.4Å; L225-T272 HydrophobicContact CD1-CG2 4Å; V268-T272 WeakPolarHBondContact O-CB 3.29Å; V268-T272 PolarHBondContact O-N 2.66Å; V268-T272 PolarHBondContact O-OG1 2.84Å; W269-T272 HydrophobicContact CE3-CG2 4.49Å; W269-T272 HydrophobicContact CZ3-CG2 4.44Å; W269-T272 WeakPolarHBondContact O-CB 3.35Å; W269-T272 PolarHBondContact O-N 2.88Å; W269-T272 VanDerWaalsContact O-N 3.08Å; Y270-T272 VanDerWaalsContact C-N 3.31Å; Y270-T272 PolarHBondContact O-N 3.44Å; T272-S274 VanDerWaalsContact C-N 3.33Å; T272-S274 PolarHBondContact O-N 2.96Å; T272-N275 PolarHBondContact O-N 2.88Å; T272-L276 WeakPolarHBondContact O-CB 3.36Å; T272-L276 PolarHBondContact O-N 2.8Å
273V97.8Very high95.5Very high11 Ų1123 Ų237%0.06712%0.12CC..Hα-helixtrans-63-42.3177.3178.60000110.7A98 T101 I102 W269 Y270 N275 L276 V277A98-V273 HydrophobicContact CB-CG1 4.32Å; A98-V273 HydrophobicContact CB-CG2 3.93Å; T101-V273 HydrophobicContact CG2-CB 4.25Å; T101-V273 HydrophobicContact CG2-CG1 3.95Å; I102-V273 HydrophobicContact CD1-CG1 4.43Å; I102-V273 HydrophobicContact CG1-CG1 4.05Å; W269-V273 HydrophobicContact CD2-CG2 4.06Å; W269-V273 HydrophobicContact CE3-CG2 4.43Å; W269-V273 HydrophobicContact CH2-CG2 4.16Å; W269-V273 HydrophobicContact CZ2-CG2 3.73Å; W269-V273 HydrophobicContact CZ3-CG2 4.49Å; W269-V273 WeakPolarHBondContact O-CG2 3.28Å; W269-V273 PolarHBondContact O-N 2.93Å; Y270-V273 PolarHBondContact O-N 2.8Å; V273-N275 PolarHBondContact O-N 3.31Å; V273-L276 WeakPolarHBondContact O-CB 3.48Å; V273-L276 PolarHBondContact O-N 3.07Å; V273-V277 HydrophobicContact CG1-CG2 4.45Å; V273-V277 WeakPolarHBondContact O-CG2 3.49Å; V273-V277 PolarHBondContact O-N 3.28Å
274S95.8Very high95.3Very high3 Ų325.1 Ų25.12%0.02113%0.131CC..Hα-helixtrans-62.9-41.2179.6-156.90000112.1R105 Y270 W271 T272 S278R105-S274 VanDerWaalsContact CZ-OG 3.28Å; R105-S274 PolarHBondContact NE-OG 3.25Å; R105-S274 PolarHBondContact NH2-O 2.94Å; R105-S274 PolarHBondContact NH2-OG 2.78Å; Y270-S274 WeakPolarHBondContact O-CB 3.39Å; Y270-S274 PolarHBondContact O-N 3.26Å; W271-S274 PolarHBondContact O-N 3.01Å; T272-S274 VanDerWaalsContact C-N 3.33Å; T272-S274 PolarHBondContact O-N 2.96Å; S274-S278 WeakPolarHBondContact O-CB 3.24Å; S274-S278 PolarHBondContact O-N 3.35Å; S274-S278 PolarHBondContact O-OG 3.47Å
275N96Very high95Very high12 Ų1224.8 Ų24.86%0.06413%0.128CC..Hα-helixtrans-70.9-39175.6-71.8-22.1000111.5S222 L225 W271 T272 V273 S278 L279S222-N275 PolarHBondContact O-ND2 2.91Å; S222-N275 PolarHBondContact OG-ND2 2.8Å; L225-N275 HydrophobicContact CB-CB 3.82Å; W271-N275 VanDerWaalsContact O-CB 3.27Å; W271-N275 WeakPolarHBondContact O-CB 3.11Å; W271-N275 PolarHBondContact O-N 3.3Å; W271-N275 PolarHBondContact O-ND2 3.35Å; T272-N275 PolarHBondContact O-N 2.88Å; V273-N275 PolarHBondContact O-N 3.31Å; N275-S278 WeakPolarHBondContact O-CB 3.49Å; N275-S278 PolarHBondContact O-N 2.78Å; N275-L279 WeakPolarHBondContact O-CB 3.34Å; N275-L279 PolarHBondContact O-N 3.11Å
276L97.2Very high94.5Very high80 Ų8031.9 Ų31.942%0.41916%0.155SC..Hα-helixtrans-59.2-51.4173.2-178.462000110.8L225 T272 V273 S278 L279 L280L225-L276 HydrophobicContact CD1-CB 4.09Å; L225-L276 HydrophobicContact CD2-CD1 4.11Å; T272-L276 WeakPolarHBondContact O-CB 3.36Å; T272-L276 PolarHBondContact O-N 2.8Å; V273-L276 WeakPolarHBondContact O-CB 3.48Å; V273-L276 PolarHBondContact O-N 3.07Å; L276-S278 VanDerWaalsContact C-N 3.28Å; L276-S278 PolarHBondContact O-N 3.33Å; L276-L279 WeakPolarHBondContact O-CB 3.22Å; L276-L279 PolarHBondContact O-N 3.23Å; L276-L279 VanDerWaalsContact O-N 3.15Å; L276-L280 HydrophobicContact CD1-CD1 3.68Å; L276-L280 HydrophobicContact CG-CD1 3.78Å; L276-L280 WeakPolarHBondContact O-CD1 3.35Å; L276-L280 PolarHBondContact O-N 3.02Å
277V96.1Very high94.1Very high16 Ų1636.8 Ų36.810%0.09718%0.178CC..Hα-helixtrans-60.5-38.9176.6176.50000111.3I102 R105 V273 L279 L280 Q281I102-V277 HydrophobicContact CG1-CG2 3.91Å; R105-V277 HydrophobicContact CB-CB 4.49Å; R105-V277 HydrophobicContact CB-CG1 3.64Å; R105-V277 HydrophobicContact CG-CB 4.35Å; R105-V277 HydrophobicContact CG-CG1 3.97Å; V273-V277 HydrophobicContact CG1-CG2 4.45Å; V273-V277 WeakPolarHBondContact O-CG2 3.49Å; V273-V277 PolarHBondContact O-N 3.28Å; V277-L279 VanDerWaalsContact C-N 3.34Å; V277-L279 PolarHBondContact O-N 3.42Å; V277-L280 PolarHBondContact O-N 2.98Å; V277-Q281 HydrophobicContact CG1-CG 4.26Å; V277-Q281 WeakPolarHBondContact O-CB 3.5Å; V277-Q281 VanDerWaalsContact O-CG 3.25Å; V277-Q281 WeakPolarHBondContact O-CG 3.49Å; V277-Q281 PolarHBondContact O-N 3.07Å
278S93.4Very high93.7Very high12 Ų1247.5 Ų47.58%0.08422%0.218CC..Hα-helixtrans-61.6-42176-58.40000112.3R105 S274 N275 L276 Q281 S282R105-S278 PolarHBondContact NH1-OG 3.3Å; R105-S278 PolarHBondContact NH2-OG 3.12Å; S274-S278 WeakPolarHBondContact O-CB 3.24Å; S274-S278 PolarHBondContact O-N 3.35Å; S274-S278 PolarHBondContact O-OG 3.47Å; N275-S278 WeakPolarHBondContact O-CB 3.49Å; N275-S278 PolarHBondContact O-N 2.78Å; L276-S278 VanDerWaalsContact C-N 3.28Å; L276-S278 PolarHBondContact O-N 3.33Å; S278-Q281 PolarHBondContact O-N 3.41Å; S278-S282 WeakPolarHBondContact O-CB 3.44Å; S278-S282 PolarHBondContact O-N 3.16Å
279L94.5Very high93.4Very high21 Ų2154.4 Ų54.411%0.1126%0.255CS..Hα-helixtrans-63.8-48.1175.617962.9000110.9L225 L228 T232 N275 L276 V277 Q281 S282 V283L225-L279 HydrophobicContact CD2-CD2 3.88Å; L228-L279 HydrophobicContact CB-CD1 4.47Å; L228-L279 HydrophobicContact CD2-CD1 4.21Å; L228-L279 HydrophobicContact CD2-CD2 3.56Å; L228-L279 HydrophobicContact CG-CD1 3.85Å; L228-L279 HydrophobicContact CG-CD2 4.09Å; T232-L279 HydrophobicContact CG2-CD1 3.97Å; N275-L279 WeakPolarHBondContact O-CB 3.34Å; N275-L279 PolarHBondContact O-N 3.11Å; L276-L279 WeakPolarHBondContact O-CB 3.22Å; L276-L279 PolarHBondContact O-N 3.23Å; L276-L279 VanDerWaalsContact O-N 3.15Å; V277-L279 VanDerWaalsContact C-N 3.34Å; V277-L279 PolarHBondContact O-N 3.42Å; L279-Q281 VanDerWaalsContact C-N 3.35Å; L279-Q281 PolarHBondContact O-N 2.89Å; L279-S282 WeakPolarHBondContact O-CB 3.25Å; L279-S282 PolarHBondContact O-N 3.13Å; L279-S282 VanDerWaalsContact O-N 3.14Å; L279-V283 HydrophobicContact CD1-CG2 4.42Å; L279-V283 WeakPolarHBondContact O-CG2 3.24Å; L279-V283 PolarHBondContact O-N 3.24Å
280L94.3Very high93.2Very high94 Ų9454 Ų5449%0.49226%0.256SS..Hα-helixtrans-57.2-47.9175.8-87.190.4000111.2L276 V277 S282 V283 I284L276-L280 HydrophobicContact CD1-CD1 3.68Å; L276-L280 HydrophobicContact CG-CD1 3.78Å; L276-L280 WeakPolarHBondContact O-CD1 3.35Å; L276-L280 PolarHBondContact O-N 3.02Å; V277-L280 PolarHBondContact O-N 2.98Å; L280-S282 VanDerWaalsContact C-N 3.32Å; L280-S282 PolarHBondContact O-N 3.16Å; L280-V283 PolarHBondContact O-N 3Å; L280-I284 WeakPolarHBondContact O-CB 3.5Å; L280-I284 VanDerWaalsContact O-CG1 3.24Å; L280-I284 WeakPolarHBondContact O-CG1 3.49Å; L280-I284 PolarHBondContact O-N 3.39Å
281Q91.7Very high92.8Very high10 Ų1055.8 Ų55.85%0.04726%0.263CS..Hα-helixtrans-58.1-43.4175.8-73.7174.4-16.800111.6R105 F109 V277 S278 L279 V283 I284 L285R105-Q281 PolarHBondContact O-NE2 3.41Å; F109-Q281 HydrophobicContact CD2-CG 4.26Å; F109-Q281 HydrophobicContact CE2-CG 4.36Å; V277-Q281 HydrophobicContact CG1-CG 4.26Å; V277-Q281 WeakPolarHBondContact O-CB 3.5Å; V277-Q281 VanDerWaalsContact O-CG 3.25Å; V277-Q281 WeakPolarHBondContact O-CG 3.49Å; V277-Q281 PolarHBondContact O-N 3.07Å; S278-Q281 PolarHBondContact O-N 3.41Å; L279-Q281 VanDerWaalsContact C-N 3.35Å; L279-Q281 PolarHBondContact O-N 2.89Å; Q281-V283 PolarHBondContact O-N 3.18Å; Q281-I284 PolarHBondContact O-N 2.93Å; Q281-L285 VanDerWaalsContact O-CB 3.3Å; Q281-L285 WeakPolarHBondContact O-CB 3.32Å; Q281-L285 VanDerWaalsContact O-CG 3.24Å; Q281-L285 WeakPolarHBondContact O-CG 3.49Å; Q281-L285 PolarHBondContact O-N 2.72Å
282S89.6Confident92.6Very high8 Ų858 Ų586%0.05629%0.285CS..Hα-helixtrans-60.1-44177.3-167.60000111.8R116 T232 S278 L279 L280 R286R116-S282 PolarHBondContact NH2-OG 3.21Å; T232-S282 PolarHBondContact OG1-OG 3.21Å; S278-S282 WeakPolarHBondContact O-CB 3.44Å; S278-S282 PolarHBondContact O-N 3.16Å; L279-S282 WeakPolarHBondContact O-CB 3.25Å; L279-S282 PolarHBondContact O-N 3.13Å; L279-S282 VanDerWaalsContact O-N 3.14Å; L280-S282 VanDerWaalsContact C-N 3.32Å; L280-S282 PolarHBondContact O-N 3.16Å; S282-R286 PolarHBondContact O-N 2.86Å
283V91.3Very high92.4Very high67 Ų6767 Ų6741%0.40632%0.32SS..Hα-helixtrans-66.9-47178.1173.10000111.2L279 L280 Q281 R286L279-V283 HydrophobicContact CD1-CG2 4.42Å; L279-V283 WeakPolarHBondContact O-CG2 3.24Å; L279-V283 PolarHBondContact O-N 3.24Å; L280-V283 PolarHBondContact O-N 3Å; Q281-V283 PolarHBondContact O-N 3.18Å; V283-R286 WeakPolarHBondContact O-CB 3.36Å; V283-R286 PolarHBondContact O-N 2.98Å
284I91.9Very high92.1Very high73 Ų7368.1 Ų68.137%0.37433%0.325SS..Hα-helixtrans-61.1-48179.3-68.6165.2000110.7L280 Q281 R286 Q287 V290L280-I284 WeakPolarHBondContact O-CB 3.5Å; L280-I284 VanDerWaalsContact O-CG1 3.24Å; L280-I284 WeakPolarHBondContact O-CG1 3.49Å; L280-I284 PolarHBondContact O-N 3.39Å; Q281-I284 PolarHBondContact O-N 2.93Å; I284-R286 PolarHBondContact O-N 2.92Å; I284-R286 VanDerWaalsContact O-N 3.15Å; I284-Q287 WeakPolarHBondContact O-CB 3.42Å; I284-Q287 PolarHBondContact O-N 3.47Å; I284-V290 HydrophobicContact CG2-CG1 4.27Å; I284-V290 HydrophobicContact CG2-CG2 4.04Å; I284-V290 WeakPolarHBondContact O-CB 3.17Å
285L89.5Confident91.9Very high6 Ų674 Ų743%0.03136%0.356CS..THydrogen-bonded Turntrans-70.7-7.8-179.3-67.5171.2000113.9F109 V113 R116 Q281 V290 R291 L294 L296F109-L285 HydrophobicContact CE2-CD1 4.38Å; F109-L285 HydrophobicContact CE2-CD2 4.33Å; F109-L285 HydrophobicContact CE2-CG 4.45Å; F109-L285 HydrophobicContact CZ-CD2 4.02Å; V113-L285 HydrophobicContact CG2-CD2 4.06Å; R116-L285 HydrophobicContact CG-CD1 4.17Å; Q281-L285 VanDerWaalsContact O-CB 3.3Å; Q281-L285 WeakPolarHBondContact O-CB 3.32Å; Q281-L285 VanDerWaalsContact O-CG 3.24Å; Q281-L285 WeakPolarHBondContact O-CG 3.49Å; Q281-L285 PolarHBondContact O-N 2.72Å; L285-V290 HydrophobicContact CD2-CG1 4Å; L285-R291 WeakPolarHBondContact O-CG 3.33Å; L285-R291 PolarHBondContact O-NH1 3.15Å; L285-L294 HydrophobicContact CD2-CD1 3.52Å; L285-L296 HydrophobicContact CD2-CD1 4.24Å
286R85.7Confident91.5Very high151 Ų15174.1 Ų74.157%0.5736%0.357SS*.THydrogen-bonded Turntrans-85.5-22.7171.5-157.9178.292.8-165.95.5112.5S282 V283 I284 R288S282-R286 PolarHBondContact O-N 2.86Å; V283-R286 WeakPolarHBondContact O-CB 3.36Å; V283-R286 PolarHBondContact O-N 2.98Å; I284-R286 PolarHBondContact O-N 2.92Å; I284-R286 VanDerWaalsContact O-N 3.15Å; R286-R288 PolarHBondContact O-N 3.41Å
287Q89.8Confident90.9Very high103 Ų10372 Ų7248%0.48135%0.348SS..SBendtrans-63.9132.7-178.6-64-176-13.600110.6I284 L289 V290 R291I284-Q287 WeakPolarHBondContact O-CB 3.42Å; I284-Q287 PolarHBondContact O-N 3.47Å; Q287-L289 VanDerWaalsContact C-N 3.25Å; Q287-L289 PolarHBondContact O-N 3.28Å; Q287-V290 HydrophobicContact CB-CB 4.43Å; Q287-V290 HydrophobicContact CB-CG2 4.19Å; Q287-V290 PolarHBondContact O-N 2.97Å; Q287-R291 WeakPolarHBondContact O-CG 3.35Å; Q287-R291 PolarHBondContact O-N 3.37Å
288R87.6Confident90.2Very high225 Ų22575.4 Ų75.485%0.84937%0.373SS*.Hα-helixtrans-57-40.1-175.9-65.7-177-176.31782.1112.2R286 R291 S292R286-R288 PolarHBondContact O-N 3.41Å; R288-R291 PolarHBondContact O-N 3.24Å; R288-S292 WeakPolarHBondContact O-CB 3.47Å; R288-S292 PolarHBondContact O-N 3.19Å
289L92.3Very high89.4Confident147 Ų14776.8 Ų76.877%0.7738%0.38SS*.Hα-helixtrans-59.7-49.7178.3-61.7177.6000111.7Q287 S292 Y293Q287-L289 VanDerWaalsContact C-N 3.25Å; Q287-L289 PolarHBondContact O-N 3.28Å; L289-S292 PolarHBondContact O-N 2.81Å; L289-Y293 WeakPolarHBondContact O-CB 3.48Å; L289-Y293 PolarHBondContact O-N 2.93Å
290V92.2Very high88.2Confident30 Ų3084.2 Ų84.218%0.18241%0.407CS..Hα-helixtrans-65.1-42.1178.9177.60000111.1I284 L285 Q287 S292 Y293 L294I284-V290 HydrophobicContact CG2-CG1 4.27Å; I284-V290 HydrophobicContact CG2-CG2 4.04Å; I284-V290 WeakPolarHBondContact O-CB 3.17Å; L285-V290 HydrophobicContact CD2-CG1 4Å; Q287-V290 HydrophobicContact CB-CB 4.43Å; Q287-V290 HydrophobicContact CB-CG2 4.19Å; Q287-V290 PolarHBondContact O-N 2.97Å; V290-S292 VanDerWaalsContact C-N 3.33Å; V290-S292 PolarHBondContact O-N 3.13Å; V290-Y293 PolarHBondContact O-N 3.41Å; V290-L294 HydrophobicContact CG1-CD1 3.73Å; V290-L294 HydrophobicContact CG1-CG 4.33Å; V290-L294 WeakPolarHBondContact O-CB 3.28Å; V290-L294 WeakPolarHBondContact O-CG 3.48Å; V290-L294 PolarHBondContact O-N 3.14Å
291R89.7Confident87Confident53 Ų5389 Ų8920%0.242%0.423CS..Hα-helixtrans-62.4-40.2176.8-68.9-171.176.792.1-4.1112.5L285 Q287 R288 N295 L296 P297L285-R291 WeakPolarHBondContact O-CG 3.33Å; L285-R291 PolarHBondContact O-NH1 3.15Å; Q287-R291 WeakPolarHBondContact O-CG 3.35Å; Q287-R291 PolarHBondContact O-N 3.37Å; R288-R291 PolarHBondContact O-N 3.24Å; R291-N295 PolarHBondContact O-N 3.48Å; R291-N295 VanDerWaalsContact O-N 3.07Å; R291-L296 HydrophobicContact CB-CB 4.31Å; R291-L296 HydrophobicContact CG-CB 4.43Å; R291-L296 HydrophobicContact CG-CD1 4.18Å; R291-L296 PolarHBondContact O-N 3.25Å; R291-P297 PolarHBondContact NH2-O 3.46Å
292S90.6Very high85.4Confident90 Ų9090.6 Ų90.663%0.62944%0.435SS*.Hα-helixtrans-65.6-46.6176.1-166.60000110.8R288 L289 V290 L294 N295R288-S292 WeakPolarHBondContact O-CB 3.47Å; R288-S292 PolarHBondContact O-N 3.19Å; L289-S292 PolarHBondContact O-N 2.81Å; V290-S292 VanDerWaalsContact C-N 3.33Å; V290-S292 PolarHBondContact O-N 3.13Å; S292-L294 VanDerWaalsContact C-N 3.33Å; S292-L294 PolarHBondContact O-N 3.3Å; S292-N295 PolarHBondContact O-N 2.81Å; S292-N295 PolarHBondContact O-OD1 3.45Å
293Y93.6Very high84.1Confident195 Ų19594.3 Ų94.377%0.76546%0.459SS*.Hα-helixtrans-61.6-40.6178.3-178.3-101.2000112.5L289 V290 N295L289-Y293 WeakPolarHBondContact O-CB 3.48Å; L289-Y293 PolarHBondContact O-N 2.93Å; V290-Y293 PolarHBondContact O-N 3.41Å; Y293-N295 VanDerWaalsContact C-N 3.34Å
294L92Very high82.6Confident35 Ų3597.2 Ų97.218%0.18348%0.479CS..THydrogen-bonded Turntrans-884.9-179.5-64177.6000114V113 R117 L285 V290 S292 L296V113-L294 HydrophobicContact CG1-CB 4.37Å; V113-L294 HydrophobicContact CG1-CD1 4.01Å; V113-L294 HydrophobicContact CG1-CD2 4.47Å; V113-L294 HydrophobicContact CG2-CD1 3.9Å; R117-L294 PolarHBondContact NH2-O 3.21Å; L285-L294 HydrophobicContact CD2-CD1 3.52Å; V290-L294 HydrophobicContact CG1-CD1 3.73Å; V290-L294 HydrophobicContact CG1-CG 4.33Å; V290-L294 WeakPolarHBondContact O-CB 3.28Å; V290-L294 WeakPolarHBondContact O-CG 3.48Å; V290-L294 PolarHBondContact O-N 3.14Å; S292-L294 VanDerWaalsContact C-N 3.33Å; S292-L294 PolarHBondContact O-N 3.3Å; L294-L296 VanDerWaalsContact C-N 3.26Å; L294-L296 HydrophobicContact CB-CD1 4.33Å; L294-L296 HydrophobicContact CB-CG 3.99Å; L294-L296 PolarHBondContact O-N 2.94Å
295N90.9Very high81Confident126 Ų12698 Ų9867%0.67449%0.487SS*.THydrogen-bonded Turntrans4748.4-176.7-62.6-57.9000112.4R291 S292 Y293R291-N295 PolarHBondContact O-N 3.48Å; R291-N295 VanDerWaalsContact O-N 3.07Å; S292-N295 PolarHBondContact O-N 2.81Å; S292-N295 PolarHBondContact O-OD1 3.45Å; Y293-N295 VanDerWaalsContact C-N 3.34Å
296L87.3Confident79.3Confident15 Ų15105.2 Ų105.28%0.07952%0.524CS..PPolyproline II helixtrans-82.1126.8178.8-70.1175.9000109.8V113 R117 L285 R291 L294 S298V113-L296 HydrophobicContact CG1-CD2 4.18Å; R117-L296 HydrophobicContact CB-CD2 3.96Å; L285-L296 HydrophobicContact CD2-CD1 4.24Å; R291-L296 HydrophobicContact CB-CB 4.31Å; R291-L296 HydrophobicContact CG-CB 4.43Å; R291-L296 HydrophobicContact CG-CD1 4.18Å; R291-L296 PolarHBondContact O-N 3.25Å; L294-L296 VanDerWaalsContact C-N 3.26Å; L294-L296 HydrophobicContact CB-CD1 4.33Å; L294-L296 HydrophobicContact CB-CG 3.99Å; L294-L296 PolarHBondContact O-N 2.94Å; L296-S298 PolarHBondContact O-N 2.9Å
297P84.6Confident77.9Confident36 Ų36103.7 Ų103.723%0.23452%0.524CS..PPolyproline II helixtrans-60.6141.5-177.420.7-28.1000110.4R117 A120 E121 R291 V299R117-P297 HydrophobicContact CG-CG 4.12Å; A120-P297 HydrophobicContact CB-CG 3.88Å; E121-P297 HydrophobicContact CG-CG 3.97Å; R291-P297 PolarHBondContact NH2-O 3.46Å; P297-V299 PolarHBondContact O-N 3.13Å
298S80.8Confident76.3Confident87 Ų87106.4 Ų106.461%0.60853%0.534SS*.PPolyproline II helixtrans-68.8130.6175.459.40000109.5N124 L296 R300N124-S298 PolarHBondContact ND2-O 3.36Å; N124-S298 PolarHBondContact OD1-O 2.88Å; L296-S298 PolarHBondContact O-N 2.9Å; S298-R300 PolarHBondContact O-N 2.83Å
299V76.7Confident74.7Confident41 Ų41105.8 Ų105.825%0.24854%0.537CS..  trans-72.5113167.1-177.80000107A120 T123 N124 E235 P297A120-V299 HydrophobicContact CB-CG2 3.89Å; T123-V299 HydrophobicContact CG2-CG1 3.66Å; N124-V299 WeakPolarHBondContact OD1-CA 3.48Å; E235-V299 HydrophobicContact CG-CG2 4.33Å; P297-V299 PolarHBondContact O-N 3.13Å
300R71.1Confident73.3Confident177 Ų177105.4 Ų105.467%0.66853%0.525SS*.PPolyproline II helixtrans-62.1136.3177.1-66.1-178.2-177.1-1751.5108N124 S298N124-R300 PolarHBondContact OD1-N 2.94Å; S298-R300 PolarHBondContact O-N 2.83Å
301K67.6Low72.3Confident193 Ų193106.2 Ų106.284%0.83954%0.54SS*.PPolyproline II helixtrans-61.5133.4169-72.7-177.3-179.2179.10107.5
302P59.5Low71.4Confident45 Ų45111.6 Ų111.629%0.29257%0.565SS.*PPolyproline II helixtrans-60.4138.7178.128.1-36.6000109.4Q240Q240-P302 HydrophobicContact CG-CB 3.5Å; Q240-P302 VanDerWaalsContact NE2-CA 3.34Å
303P62.3Low70.9Confident86 Ų86113.9 Ų113.956%0.55857%0.569SS**PPolyproline II helixtrans-51.4144.916121.4-33.6000109.1V305P303-V305 PolarHBondContact O-N 3.26Å
304P59.1Low70.3Confident128 Ų128107 Ų10783%0.83155%0.553SS**  trans-62.299.3177.726-32.5000108.5I306P304-I306 PolarHBondContact O-N 2.94Å
305V58Low69.6Low88 Ų88106.9 Ų106.953%0.53356%0.559SS.*  trans-72.5124.3166.6-178.20000105.2P303 E307P303-V305 PolarHBondContact O-N 3.26Å; V305-E307 HydrophobicContact CG1-CG 4.33Å; V305-E307 PolarHBondContact O-N 3.36Å
306I54.5Low69.1Low159 Ų159106.6 Ų106.682%0.81555%0.552SS**  trans-68.378.8167.6-56.2170000105.8P304 K308P304-I306 PolarHBondContact O-N 2.94Å; I306-K308 VanDerWaalsContact C-N 3.34Å; I306-K308 PolarHBondContact O-N 3.46Å
307E55.8Low69Low119 Ų119112.2 Ų112.256%0.55658%0.576SS**  trans-62.8101.8168.8-73.4-172.2176.200106.1V305 K309V305-E307 HydrophobicContact CG1-CG 4.33Å; V305-E307 PolarHBondContact O-N 3.36Å; E307-K309 VanDerWaalsContact C-N 3.35Å; E307-K309 PolarHBondContact O-N 3.08Å
308K56.3Low69Low159 Ų159113.6 Ų113.669%0.69158%0.579SS**  trans-56.5111.4156.9-75.4-175.2178.4-178.30104.2I306 R310I306-K308 VanDerWaalsContact C-N 3.34Å; I306-K308 PolarHBondContact O-N 3.46Å; K308-R310 HydrophobicContact CB-CG 4.2Å; K308-R310 PolarHBondContact O-N 3.42Å
309K54Low69Low212 Ų212113 Ų11392%0.92258%0.575SS**  trans-58.976.1172.6-75.7-176177.1-178.80108.6E307 G311E307-K309 VanDerWaalsContact C-N 3.35Å; E307-K309 PolarHBondContact O-N 3.08Å; K309-G311 PolarHBondContact O-N 2.72Å
310R62.3Low69.4Low139 Ų139114.7 Ų114.753%0.52558%0.582SS.*  trans-79.9117.8173-69.7-178.4179.4170.3-1.3105K308 E318K308-R310 HydrophobicContact CB-CG 4.2Å; K308-R310 PolarHBondContact O-N 3.42Å; R310-E318 IonicContact CZ-OE1 2.8Å; R310-E318 IonicContact CZ-OE2 3.61Å; R310-E318 IonicContact NE-OE2 2.74Å; R310-E318 IonicContact NH1-OE1 3.65Å; R310-E318 PolarHBondContact NH1-OE1 3.48Å; R310-E318 IonicContact NH1-OE2 3.92Å; R310-E318 PolarHBondContact NH1-OE2 2.9Å; R310-E318 IonicContact NH2-OE1 3.45Å
311G71.6Confident70.2Confident47 Ų47109.6 Ų109.649%0.48557%0.568SS.*  trans-56.1151.7174.200000110.5K309 I313 A314 G315K309-G311 PolarHBondContact O-N 2.72Å; G311-I313 PolarHBondContact O-N 3.13Å; G311-I313 VanDerWaalsContact O-N 3.13Å; G311-A314 WeakPolarHBondContact O-CA 3.49Å; G311-A314 WeakPolarHBondContact O-CB 3.29Å; G311-A314 PolarHBondContact O-N 3.03Å; G311-G315 PolarHBondContact O-N 3.34Å
312F71.8Confident71Confident167 Ų167102.4 Ų102.473%0.73254%0.539SS*.Hα-helixtrans-49.1-42.6-178.4177.7-97000112.8A314 G315 F316F312-A314 PolarHBondContact O-N 3.19Å; F312-G315 PolarHBondContact O-N 3.01Å; F312-F316 WeakPolarHBondContact O-CB 3.25Å; F312-F316 PolarHBondContact O-N 3.48Å
313I78.8Confident72.2Confident138 Ų138103.7 Ų103.771%0.70855%0.549SS*.Hα-helixtrans-62.9-41.1178.2-58172.8000111.6G311 F316 K317G311-I313 PolarHBondContact O-N 3.13Å; G311-I313 VanDerWaalsContact O-N 3.13Å; I313-F316 PolarHBondContact O-N 3.36Å; I313-K317 WeakPolarHBondContact O-CB 3.34Å; I313-K317 PolarHBondContact O-N 3.36Å
314A80.7Confident73.6Confident51 Ų51107.9 Ų107.942%0.42155%0.554SS.*Hα-helixtrans-67-44178.500000111G311 F312 F316 K317 E318G311-A314 WeakPolarHBondContact O-CA 3.49Å; G311-A314 WeakPolarHBondContact O-CB 3.29Å; G311-A314 PolarHBondContact O-N 3.03Å; F312-A314 PolarHBondContact O-N 3.19Å; A314-F316 PolarHBondContact O-N 3.3Å; A314-K317 PolarHBondContact O-N 2.9Å; A314-E318 VanDerWaalsContact O-CB 3.31Å; A314-E318 WeakPolarHBondContact O-CB 3.24Å; A314-E318 PolarHBondContact O-N 3.17Å
315G78.8Confident74.9Confident31 Ų31106.3 Ų106.332%0.3254%0.538SS..Hα-helixtrans-62.8-40.3175.200000112.6G311 F312 E318 S319G311-G315 PolarHBondContact O-N 3.34Å; F312-G315 PolarHBondContact O-N 3.01Å; G315-E318 PolarHBondContact O-N 3.47Å; G315-S319 WeakPolarHBondContact O-CB 3.29Å; G315-S319 PolarHBondContact O-N 2.84Å
316F80.7Confident76.2Confident120 Ų120104.5 Ų104.553%0.52653%0.525SS..Hα-helixtrans-65.9-45.9175.9-175.6-103.5000112.1F312 I313 A314 E318 S319 L320F312-F316 WeakPolarHBondContact O-CB 3.25Å; F312-F316 PolarHBondContact O-N 3.48Å; I313-F316 PolarHBondContact O-N 3.36Å; A314-F316 PolarHBondContact O-N 3.3Å; F316-E318 VanDerWaalsContact C-N 3.33Å; F316-E318 PolarHBondContact O-N 2.92Å; F316-S319 WeakPolarHBondContact O-CB 3.4Å; F316-S319 PolarHBondContact O-N 2.81Å; F316-L320 HydrophobicContact CD1-CD1 3.9Å; F316-L320 HydrophobicContact CD1-CG 4.39Å; F316-L320 HydrophobicContact CE1-CD1 3.35Å; F316-L320 HydrophobicContact CE1-CG 4.02Å; F316-L320 HydrophobicContact CZ-CD1 3.83Å; F316-L320 HydrophobicContact CZ-CD2 4.37Å; F316-L320 HydrophobicContact CZ-CG 4.13Å; F316-L320 PolarHBondContact O-N 2.85Å
317K84.9Confident77.9Confident134 Ų13499.7 Ų99.758%0.58351%0.509SS*.Hα-helixtrans-61.4-41.9176.4-173.4177.7-179.5179.60111.7I313 A314 L320 N321I313-K317 WeakPolarHBondContact O-CB 3.34Å; I313-K317 PolarHBondContact O-N 3.36Å; A314-K317 PolarHBondContact O-N 2.9Å; K317-L320 PolarHBondContact O-N 3.5Å; K317-N321 WeakPolarHBondContact O-CB 3.39Å; K317-N321 PolarHBondContact O-N 3.14Å
318E83.1Confident79.5Confident65 Ų6598.1 Ų98.130%0.30450%0.502SS..Hα-helixtrans-63.3-43.4174.1-176.2177-173.600111.5R310 A314 G315 F316 L320 N321 N322R310-E318 IonicContact CZ-OE1 2.8Å; R310-E318 IonicContact CZ-OE2 3.61Å; R310-E318 IonicContact NE-OE2 2.74Å; R310-E318 IonicContact NH1-OE1 3.65Å; R310-E318 PolarHBondContact NH1-OE1 3.48Å; R310-E318 IonicContact NH1-OE2 3.92Å; R310-E318 PolarHBondContact NH1-OE2 2.9Å; R310-E318 IonicContact NH2-OE1 3.45Å; A314-E318 VanDerWaalsContact O-CB 3.31Å; A314-E318 WeakPolarHBondContact O-CB 3.24Å; A314-E318 PolarHBondContact O-N 3.17Å; G315-E318 PolarHBondContact O-N 3.47Å; F316-E318 VanDerWaalsContact C-N 3.33Å; F316-E318 PolarHBondContact O-N 2.92Å; E318-L320 VanDerWaalsContact C-N 3.34Å; E318-L320 PolarHBondContact O-N 3.38Å; E318-N321 PolarHBondContact O-N 3.1Å; E318-N322 VanDerWaalsContact O-CB 3.27Å; E318-N322 WeakPolarHBondContact O-CB 3.44Å; E318-N322 PolarHBondContact O-N 3.44Å; E318-N322 PolarHBondContact O-ND2 3.35Å
319S81.2Confident81Confident74 Ų7493.2 Ų93.252%0.51748%0.483SS..Hα-helixtrans-60.9-42175.3-172.40000112.2G315 F316 S323G315-S319 WeakPolarHBondContact O-CB 3.29Å; G315-S319 PolarHBondContact O-N 2.84Å; F316-S319 WeakPolarHBondContact O-CB 3.4Å; F316-S319 PolarHBondContact O-N 2.81Å; S319-S323 VanDerWaalsContact O-CB 3.31Å; S319-S323 WeakPolarHBondContact O-CB 3.36Å; S319-S323 PolarHBondContact O-N 3.39Å
320L85.1Confident82.6Confident76 Ų7686.2 Ų86.240%0.39846%0.455SS..Hα-helixtrans-66.2-43.4175.6-74.6179.9000111.8F316 K317 E318 S323 R324F316-L320 HydrophobicContact CD1-CD1 3.9Å; F316-L320 HydrophobicContact CD1-CG 4.39Å; F316-L320 HydrophobicContact CE1-CD1 3.35Å; F316-L320 HydrophobicContact CE1-CG 4.02Å; F316-L320 HydrophobicContact CZ-CD1 3.83Å; F316-L320 HydrophobicContact CZ-CD2 4.37Å; F316-L320 HydrophobicContact CZ-CG 4.13Å; F316-L320 PolarHBondContact O-N 2.85Å; K317-L320 PolarHBondContact O-N 3.5Å; E318-L320 VanDerWaalsContact C-N 3.34Å; E318-L320 PolarHBondContact O-N 3.38Å; L320-S323 PolarHBondContact O-N 3.45Å; L320-R324 WeakPolarHBondContact O-CG 3.38Å; L320-R324 PolarHBondContact O-N 3.46Å
321N88.5Confident84Confident70 Ų7081.6 Ų81.637%0.37445%0.445SS..Hα-helixtrans-63.6-45.8176.8-74-11000111.4K317 E318 S323 R324 L325K317-N321 WeakPolarHBondContact O-CB 3.39Å; K317-N321 PolarHBondContact O-N 3.14Å; E318-N321 PolarHBondContact O-N 3.1Å; N321-S323 VanDerWaalsContact C-N 3.32Å; N321-S323 PolarHBondContact O-N 3.46Å; N321-R324 PolarHBondContact O-N 3.13Å; N321-L325 WeakPolarHBondContact O-CG 3.36Å; N321-L325 PolarHBondContact O-N 2.82Å
322N84.4Confident84.8Confident42 Ų4286 Ų8623%0.22545%0.446CS..Hα-helixtrans-61-42.1175.1-70.3-12.9000110.8E318 R324 L325 L326E318-N322 VanDerWaalsContact O-CB 3.27Å; E318-N322 WeakPolarHBondContact O-CB 3.44Å; E318-N322 PolarHBondContact O-N 3.44Å; E318-N322 PolarHBondContact O-ND2 3.35Å; N322-R324 PolarHBondContact O-N 3.44Å; N322-L325 PolarHBondContact O-N 3.29Å; N322-L326 WeakPolarHBondContact O-CB 3.25Å; N322-L326 WeakPolarHBondContact O-CG 3.22Å; N322-L326 PolarHBondContact O-N 3.35Å
323S85.5Confident85.6Confident73 Ų7383.9 Ų83.951%0.5144%0.439SS..Hα-helixtrans-63.2-39.4175.7-174.10000112.6S319 L320 N321 A327S319-S323 VanDerWaalsContact O-CB 3.31Å; S319-S323 WeakPolarHBondContact O-CB 3.36Å; S319-S323 PolarHBondContact O-N 3.39Å; L320-S323 PolarHBondContact O-N 3.45Å; N321-S323 VanDerWaalsContact C-N 3.32Å; N321-S323 PolarHBondContact O-N 3.46Å; S323-A327 WeakPolarHBondContact O-CB 3.45Å; S323-A327 PolarHBondContact O-N 3.13Å
324R89.7Confident86.2Confident174 Ų17484.4 Ų84.466%0.65743%0.432SS*.Hα-helixtrans-66.8-44.2175.4-75.2176.6179.5166.2-1.7111.6L320 N321 N322 L326 A327 E328L320-R324 WeakPolarHBondContact O-CG 3.38Å; L320-R324 PolarHBondContact O-N 3.46Å; N321-R324 PolarHBondContact O-N 3.13Å; N322-R324 PolarHBondContact O-N 3.44Å; R324-L326 VanDerWaalsContact C-N 3.34Å; R324-L326 PolarHBondContact O-N 3.45Å; R324-A327 PolarHBondContact O-N 3.5Å; R324-E328 WeakPolarHBondContact O-CB 3.24Å; R324-E328 PolarHBondContact O-N 3.25Å
325L87.3Confident86.8Confident94 Ų9487.1 Ų87.149%0.49244%0.438SS..Hα-helixtrans-60.7-43.7175.1-73171.4000111.4L141 N321 N322 E328 L329L141-L325 HydrophobicContact CD2-CB 3.88Å; L141-L325 HydrophobicContact CD2-CD1 4.19Å; N321-L325 WeakPolarHBondContact O-CG 3.36Å; N321-L325 PolarHBondContact O-N 2.82Å; N322-L325 PolarHBondContact O-N 3.29Å; L325-E328 PolarHBondContact O-N 2.97Å; L325-L329 VanDerWaalsContact O-CG 3.3Å; L325-L329 WeakPolarHBondContact O-CG 3.34Å; L325-L329 PolarHBondContact O-N 3.46Å
326L86.2Confident87.4Confident51 Ų5190.8 Ų90.827%0.26745%0.451SS..Hα-helixtrans-64.6-40.3176.2-71.8177000112.6R140 L141 N322 R324 E328 L329 D330R140-L326 HydrophobicContact CB-CD2 4.15Å; R140-L326 HydrophobicContact CG-CD2 3.42Å; R140-L326 VanDerWaalsContact CG-CD2 3.42Å; L141-L326 HydrophobicContact CD2-CD2 4.16Å; L141-L326 HydrophobicContact CD2-CG 4.28Å; N322-L326 WeakPolarHBondContact O-CB 3.25Å; N322-L326 WeakPolarHBondContact O-CG 3.22Å; N322-L326 PolarHBondContact O-N 3.35Å; R324-L326 VanDerWaalsContact C-N 3.34Å; R324-L326 PolarHBondContact O-N 3.45Å; L326-E328 VanDerWaalsContact C-N 3.31Å; L326-L329 HydrophobicContact CD2-CD1 4.44Å; L326-L329 PolarHBondContact O-N 3.44Å; L326-D330 WeakPolarHBondContact O-CB 3.04Å; L326-D330 PolarHBondContact O-N 3.35Å
327A88.9Confident87.9Confident58 Ų5887.9 Ų87.948%0.47945%0.448SS..Hα-helixtrans-65.2-36.8175.400000112S323 R324 S331S323-A327 WeakPolarHBondContact O-CB 3.45Å; S323-A327 PolarHBondContact O-N 3.13Å; R324-A327 PolarHBondContact O-N 3.5Å; A327-S331 VanDerWaalsContact O-CB 3.32Å; A327-S331 WeakPolarHBondContact O-CB 3.41Å; A327-S331 PolarHBondContact O-N 2.77Å
328E89.6Confident88.2Confident86 Ų8687.8 Ų87.840%0.40245%0.448SS..Hα-helixtrans-69.1-37.1174.3178.862-168.900112.2R324 L325 L326 S331 R332R324-E328 WeakPolarHBondContact O-CB 3.24Å; R324-E328 PolarHBondContact O-N 3.25Å; L325-E328 PolarHBondContact O-N 2.97Å; L326-E328 VanDerWaalsContact C-N 3.31Å; E328-S331 WeakPolarHBondContact CA-OG 3.46Å; E328-S331 PolarHBondContact O-OG 3Å; E328-S331 PolarHBondContact OE2-OG 3.4Å; E328-R332 VanDerWaalsContact O-CG 3.23Å; E328-R332 WeakPolarHBondContact O-CG 3.46Å; E328-R332 PolarHBondContact O-N 3.36Å; E328-R332 VanDerWaalsContact O-N 3.07Å; E328-R332 IonicContact OE1-CZ 3.4Å; E328-R332 VanDerWaalsContact OE1-CZ 3.3Å; E328-R332 IonicContact OE1-NE 3.76Å; E328-R332 PolarHBondContact OE1-NE 2.79Å; E328-R332 IonicContact OE1-NH2 2.68Å; E328-R332 PolarHBondContact OE1-NH2 3.29Å
329L87.4Confident88.6Confident56 Ų5687.2 Ų87.229%0.29345%0.454SS..Hα-helixtrans-66.8-44.9174.3-71.4170.2000111.6R140 L325 L326 S331 R332 E333R140-L329 VanDerWaalsContact O-CD1 3.3Å; R140-L329 WeakPolarHBondContact O-CD1 3.36Å; L325-L329 VanDerWaalsContact O-CG 3.3Å; L325-L329 WeakPolarHBondContact O-CG 3.34Å; L325-L329 PolarHBondContact O-N 3.46Å; L326-L329 HydrophobicContact CD2-CD1 4.44Å; L326-L329 PolarHBondContact O-N 3.44Å; L329-S331 VanDerWaalsContact C-N 3.35Å; L329-R332 PolarHBondContact O-N 2.95Å; L329-E333 WeakPolarHBondContact O-CB 3.43Å; L329-E333 PolarHBondContact O-N 2.89Å
330D87.8Confident88.9Confident64 Ų6493.5 Ų93.534%0.34247%0.467SS..Hα-helixtrans-66-35.8175.9-177.132.9000111.6L326 E333 R334L326-D330 WeakPolarHBondContact O-CB 3.04Å; L326-D330 PolarHBondContact O-N 3.35Å; D330-E333 PolarHBondContact O-N 3.36Å; D330-R334 WeakPolarHBondContact O-CB 3.17Å; D330-R334 WeakPolarHBondContact O-CG 3.4Å; D330-R334 PolarHBondContact O-N 3.44Å; D330-R334 IonicContact OD1-CZ 2.87Å; D330-R334 IonicContact OD1-NE 3.23Å; D330-R334 PolarHBondContact OD1-NE 3.31Å; D330-R334 IonicContact OD1-NH2 2.77Å; D330-R334 IonicContact OD2-CZ 2.85Å; D330-R334 IonicContact OD2-NE 2.9Å; D330-R334 PolarHBondContact OD2-NE 2.99Å; D330-R334 IonicContact OD2-NH2 3.17Å; D330-R334 PolarHBondContact OD2-NH2 2.9Å
331S91.7Very high89.2Confident43 Ų4395.8 Ų95.830%0.30148%0.475SS..Hα-helixtrans-63.6-4317578.20000111.6A327 E328 L329 R334 I335A327-S331 VanDerWaalsContact O-CB 3.32Å; A327-S331 WeakPolarHBondContact O-CB 3.41Å; A327-S331 PolarHBondContact O-N 2.77Å; E328-S331 WeakPolarHBondContact CA-OG 3.46Å; E328-S331 PolarHBondContact O-OG 3Å; E328-S331 PolarHBondContact OE2-OG 3.4Å; L329-S331 VanDerWaalsContact C-N 3.35Å; S331-R334 PolarHBondContact O-N 3.09Å; S331-I335 VanDerWaalsContact O-CG1 3.28Å; S331-I335 WeakPolarHBondContact O-CG1 3.29Å; S331-I335 PolarHBondContact O-N 3.28Å
332R89.8Confident89.2Confident138 Ų13899.2 Ų99.252%0.52149%0.487SS..Hα-helixtrans-63.6-47.9175.2-72171.8-173.8-166.40.4111.7E328 L329 R334 I335 D336E328-R332 VanDerWaalsContact O-CG 3.23Å; E328-R332 WeakPolarHBondContact O-CG 3.46Å; E328-R332 PolarHBondContact O-N 3.36Å; E328-R332 VanDerWaalsContact O-N 3.07Å; E328-R332 IonicContact OE1-CZ 3.4Å; E328-R332 VanDerWaalsContact OE1-CZ 3.3Å; E328-R332 IonicContact OE1-NE 3.76Å; E328-R332 PolarHBondContact OE1-NE 2.79Å; E328-R332 IonicContact OE1-NH2 2.68Å; E328-R332 PolarHBondContact OE1-NH2 3.29Å; L329-R332 PolarHBondContact O-N 2.95Å; R332-R334 VanDerWaalsContact C-N 3.28Å; R332-R334 PolarHBondContact O-N 3.32Å; R332-I335 PolarHBondContact O-N 3.3Å; R332-D336 PolarHBondContact O-N 2.8Å
333E87.6Confident89.3Confident123 Ų123100.4 Ų100.458%0.57550%0.499SS*.Hα-helixtrans-57.7-41.6177.1-172.4177.3177.500111.5L329 D330 D336 A337L329-E333 WeakPolarHBondContact O-CB 3.43Å; L329-E333 PolarHBondContact O-N 2.89Å; D330-E333 PolarHBondContact O-N 3.36Å; E333-D336 PolarHBondContact O-N 2.61Å; E333-A337 VanDerWaalsContact O-CB 3.28Å; E333-A337 WeakPolarHBondContact O-CB 3.37Å; E333-A337 PolarHBondContact O-N 3.06Å
334R91.3Very high89.3Confident149 Ų149100.2 Ų100.256%0.56251%0.508SS*.Hα-helixtrans-66.5-37.6175.1-71.2172.2-168-165.53.2113.2D330 S331 R332 K338D330-R334 WeakPolarHBondContact O-CB 3.17Å; D330-R334 WeakPolarHBondContact O-CG 3.4Å; D330-R334 PolarHBondContact O-N 3.44Å; D330-R334 IonicContact OD1-CZ 2.87Å; D330-R334 IonicContact OD1-NE 3.23Å; D330-R334 PolarHBondContact OD1-NE 3.31Å; D330-R334 IonicContact OD1-NH2 2.77Å; D330-R334 IonicContact OD2-CZ 2.85Å; D330-R334 IonicContact OD2-NE 2.9Å; D330-R334 PolarHBondContact OD2-NE 2.99Å; D330-R334 IonicContact OD2-NH2 3.17Å; D330-R334 PolarHBondContact OD2-NH2 2.9Å; S331-R334 PolarHBondContact O-N 3.09Å; R332-R334 VanDerWaalsContact C-N 3.28Å; R332-R334 PolarHBondContact O-N 3.32Å; R334-K338 WeakPolarHBondContact O-CB 3.44Å; R334-K338 VanDerWaalsContact O-CG 3.25Å; R334-K338 WeakPolarHBondContact O-CG 3.34Å; R334-K338 PolarHBondContact O-N 3.07Å
335I93Very high88.9Confident108 Ų10899.2 Ų99.255%0.55451%0.511SS*.Hα-helixtrans-66.7-45.4176.5-70.9165.1000109.6S331 R332 K338 A339S331-I335 VanDerWaalsContact O-CG1 3.28Å; S331-I335 WeakPolarHBondContact O-CG1 3.29Å; S331-I335 PolarHBondContact O-N 3.28Å; R332-I335 PolarHBondContact O-N 3.3Å; I335-K338 PolarHBondContact O-N 3.27Å; I335-A339 WeakPolarHBondContact O-CB 3.5Å; I335-A339 PolarHBondContact O-N 3.01Å
336D91.6Very high88.6Confident109 Ų109102 Ų10258%0.58352%0.519SS*.Hα-helixtrans-63.8-43.9178.5-69.6-16.5000111.3R332 E333 K338 A339 W340R332-D336 PolarHBondContact O-N 2.8Å; E333-D336 PolarHBondContact O-N 2.61Å; D336-K338 VanDerWaalsContact C-N 3.34Å; D336-K338 PolarHBondContact O-N 3.39Å; D336-A339 PolarHBondContact O-N 3.22Å; D336-W340 VanDerWaalsContact O-CB 3.29Å; D336-W340 WeakPolarHBondContact O-CB 3.4Å; D336-W340 PolarHBondContact O-N 3.15Å
337A90.7Very high88.3Confident58 Ų58106 Ų10648%0.47955%0.546SS..Hα-helixtrans-60.4-42.4174.600000112E333 Q341E333-A337 VanDerWaalsContact O-CB 3.28Å; E333-A337 WeakPolarHBondContact O-CB 3.37Å; E333-A337 PolarHBondContact O-N 3.06Å; A337-Q341 WeakPolarHBondContact O-CB 3.17Å; A337-Q341 PolarHBondContact O-N 2.94Å
338K92.4Very high87.9Confident133 Ų133108.6 Ų108.658%0.57856%0.557SS**Hα-helixtrans-67.5-39.1174.7-75.8175.6-178.4-179.40112.1R334 I335 D336 K342R334-K338 WeakPolarHBondContact O-CB 3.44Å; R334-K338 VanDerWaalsContact O-CG 3.25Å; R334-K338 WeakPolarHBondContact O-CG 3.34Å; R334-K338 PolarHBondContact O-N 3.07Å; I335-K338 PolarHBondContact O-N 3.27Å; D336-K338 VanDerWaalsContact C-N 3.34Å; D336-K338 PolarHBondContact O-N 3.39Å; K338-K342 WeakPolarHBondContact O-CB 3.31Å; K338-K342 VanDerWaalsContact O-CG 3.26Å; K338-K342 WeakPolarHBondContact O-CG 3.26Å; K338-K342 PolarHBondContact O-N 3.42Å
339A91.3Very high87.5Confident52 Ų52109.6 Ų109.643%0.4357%0.571SS.*Hα-helixtrans-65.1-45177.900000110.6I335 D336 K342 S343I335-A339 WeakPolarHBondContact O-CB 3.5Å; I335-A339 PolarHBondContact O-N 3.01Å; D336-A339 PolarHBondContact O-N 3.22Å; A339-K342 PolarHBondContact O-N 3.5Å; A339-S343 PolarHBondContact O-N 2.68Å; A339-S343 PolarHBondContact O-OG 3.42Å
340W87.1Confident87.2Confident207 Ų207113.2 Ų113.278%0.78460%0.595SS**Hα-helixtrans-59.2-48174.4-177.4-95000112.2D336 K342 S343 G344D336-W340 VanDerWaalsContact O-CB 3.29Å; D336-W340 WeakPolarHBondContact O-CB 3.4Å; D336-W340 PolarHBondContact O-N 3.15Å; W340-K342 VanDerWaalsContact C-N 3.33Å; W340-K342 PolarHBondContact O-N 3.3Å; W340-S343 WeakPolarHBondContact CA-OG 3.48Å; W340-S343 PolarHBondContact O-N 3.46Å; W340-S343 PolarHBondContact O-OG 2.95Å; W340-G344 PolarHBondContact O-N 3.01Å
341Q90.7Very high87.1Confident123 Ų123115.9 Ų115.958%0.57561%0.614SS**Hα-helixtrans-61.1-43.5176.4-170.8178.52.100111.2A337 G344 H345A337-Q341 WeakPolarHBondContact O-CB 3.17Å; A337-Q341 PolarHBondContact O-N 2.94Å; Q341-G344 PolarHBondContact O-N 3.27Å; Q341-H345 PolarHBondContact O-CD2 3.19Å; Q341-H345 PolarHBondContact O-N 3.27Å
342K90.2Very high86.8Confident142 Ų142120.9 Ų120.962%0.61763%0.631SS**Hα-helixtrans-64.2-39.3175.9-76.6177.3179.8-175.40112.6K338 A339 W340 G344 H345 K346K338-K342 WeakPolarHBondContact O-CB 3.31Å; K338-K342 VanDerWaalsContact O-CG 3.26Å; K338-K342 WeakPolarHBondContact O-CG 3.26Å; K338-K342 PolarHBondContact O-N 3.42Å; A339-K342 PolarHBondContact O-N 3.5Å; W340-K342 VanDerWaalsContact C-N 3.33Å; W340-K342 PolarHBondContact O-N 3.3Å; K342-G344 VanDerWaalsContact C-N 3.33Å; K342-H345 PolarHBondContact O-N 2.62Å; K342-K346 WeakPolarHBondContact O-CG 3.39Å; K342-K346 PolarHBondContact O-N 3.16Å
343S85.4Confident86.3Confident67 Ų67123.2 Ų123.247%0.46965%0.652SS.*Hα-helixtrans-67.6-32.9177.250.60000112.6A339 W340 H345 K346A339-S343 PolarHBondContact O-N 2.68Å; A339-S343 PolarHBondContact O-OG 3.42Å; W340-S343 WeakPolarHBondContact CA-OG 3.48Å; W340-S343 PolarHBondContact O-N 3.46Å; W340-S343 PolarHBondContact O-OG 2.95Å; S343-H345 PolarHBondContact O-N 3.32Å; S343-K346 PolarHBondContact O-N 2.77Å
344G85Confident85.9Confident69 Ų69121.6 Ų121.671%0.71165%0.654SS**Hα-helixtrans-65.8-21.9173.500000114.1W340 Q341 K342W340-G344 PolarHBondContact O-N 3.01Å; Q341-G344 PolarHBondContact O-N 3.27Å; K342-G344 VanDerWaalsContact C-N 3.33Å
345H81.3Confident85.4Confident154 Ų154118 Ų11871%0.71365%0.646SS**Hα-helixtrans-95.9-9.3177-70.2-62.4000114.3Q341 K342 S343Q341-H345 PolarHBondContact O-CD2 3.19Å; Q341-H345 PolarHBondContact O-N 3.27Å; K342-H345 PolarHBondContact O-N 2.62Å; S343-H345 PolarHBondContact O-N 3.32Å
346K82.3Confident84.4Confident152 Ų152117.1 Ų117.166%0.66165%0.647SS**SBendtrans-84142.2178.1-74.5177.1-178.5-173.70110.2K342 S343K342-K346 WeakPolarHBondContact O-CG 3.39Å; K342-K346 PolarHBondContact O-N 3.16Å; S343-K346 PolarHBondContact O-N 2.77Å
347T79.9Confident83.7Confident135 Ų135117.9 Ų117.983%0.82866%0.656SS**PPolyproline II helixtrans-57.5131.1171.3-29.90000109.4
348P79.4Confident82.6Confident112 Ų112122.8 Ų122.873%0.72767%0.666SS**PPolyproline II helixtrans-56.9132.7-179.8-2533.2000111.3
349P81.8Confident81Confident107 Ų107124.1 Ų124.170%0.69568%0.679SS**PPolyproline II helixtrans-67.7146.9174.328.9-33.5000110.3T351P349-T351 PolarHBondContact O-N 2.99Å
350V81.5Confident79.2Confident132 Ų132127.2 Ų127.280%0.869%0.693SS**PPolyproline II helixtrans-67.5118.9173.1-177.50000108.6
351T85Confident77.5Confident120 Ų120123.2 Ų123.274%0.73670%0.696SS**  trans-111.6138.9179.455.10000110.7P349P349-T351 PolarHBondContact O-N 2.99Å
352F85Confident75.4Confident149 Ų149124.4 Ų124.465%0.65471%0.707SS**  trans-94.3145.4176.1-60-83.2000111.1S354 P356F352-S354 WeakPolarHBondContact CB-O 3.4Å; F352-P356 HydrophobicContact CD2-CG 4.02Å; F352-P356 HydrophobicContact CG-CG 4.48Å
353I80.4Confident73.5Confident187 Ų187125.4 Ų125.496%0.95971%0.713SS**SBendtrans-69.5-36.7179.8-65.7170.9000111.4
354S78.8Confident71.5Confident89 Ų89131.2 Ų131.262%0.62273%0.733SS**SBendtrans-106.8146.7174.553.10000109.8F352 P356F352-S354 WeakPolarHBondContact CB-O 3.4Å; S354-P356 WeakPolarHBondContact O-CD 3.41Å
355D80.2Confident69.3Low73 Ų73136.1 Ų136.139%0.3974%0.743SS.*  trans-57105.6171.3-177.6-9.3000109.7T357 K358D355-T357 PolarHBondContact O-N 3.13Å; D355-T357 VanDerWaalsContact O-N 3.11Å; D355-T357 WeakPolarHBondContact OD1-CB 3.26Å; D355-T357 PolarHBondContact OD1-N 3.25Å; D355-T357 PolarHBondContact OD1-OG1 2.79Å; D355-K358 HydrophobicContact CB-CB 4.31Å; D355-K358 HydrophobicContact CB-CD 4.44Å; D355-K358 HydrophobicContact CB-CG 4.4Å; D355-K358 PolarHBondContact O-N 2.77Å; D355-K358 WeakPolarHBondContact OD2-CD 3.41Å; D355-K358 WeakPolarHBondContact OD2-CE 3.28Å; D355-K358 WeakPolarHBondContact OD2-CG 2.95Å
356P73.1Confident67.6Low89 Ų89134 Ų13458%0.57874%0.741SS**THydrogen-bonded Turntrans-67.2-13.7-175.829.9-34.5000112F352 S354F352-P356 HydrophobicContact CD2-CG 4.02Å; F352-P356 HydrophobicContact CG-CG 4.48Å; S354-P356 WeakPolarHBondContact O-CD 3.41Å
357T77Confident65.6Low126 Ų126136 Ų13677%0.77375%0.75SS**THydrogen-bonded Turntrans-85.5-11.5175.425.10000113.7D355D355-T357 PolarHBondContact O-N 3.13Å; D355-T357 VanDerWaalsContact O-N 3.11Å; D355-T357 WeakPolarHBondContact OD1-CB 3.26Å; D355-T357 PolarHBondContact OD1-N 3.25Å; D355-T357 PolarHBondContact OD1-OG1 2.79Å
358K66.3Low63.8Low160 Ų160135 Ų13570%0.69675%0.746SS**SBendtrans-105.180.5173.6-68.6-177.3-173.5-179.50110.4D355 T360D355-K358 HydrophobicContact CB-CB 4.31Å; D355-K358 HydrophobicContact CB-CD 4.44Å; D355-K358 HydrophobicContact CB-CG 4.4Å; D355-K358 PolarHBondContact O-N 2.77Å; D355-K358 WeakPolarHBondContact OD2-CD 3.41Å; D355-K358 WeakPolarHBondContact OD2-CE 3.28Å; D355-K358 WeakPolarHBondContact OD2-CG 2.95Å; K358-T360 PolarHBondContact O-N 2.65Å
359L60.2Low61.8Low162 Ų162135.9 Ų135.985%0.84875%0.751SS**  trans-58.5125.8165.5-81.4158.1000109.2S361L359-S361 PolarHBondContact O-N 2.9Å
360T53Low59.8Low116 Ų116138.4 Ų138.471%0.71276%0.759SS**  trans-50109.7176.346.30000110.9K358 N362K358-T360 PolarHBondContact O-N 2.65Å; T360-N362 PolarHBondContact O-N 3.33Å
361S51Low57.6Low123 Ų123140.7 Ų140.786%0.8676%0.758SS**THydrogen-bonded Turntrans-71.630.7178.562.90000114L359L359-S361 PolarHBondContact O-N 2.9Å
362N47.6Very low55.6Low149 Ų149141.1 Ų141.180%0.79776%0.761SS**THydrogen-bonded Turntrans-129.414.9-173.4-110.35.2000115.2T360T360-N362 PolarHBondContact O-N 3.33Å
363H49.2Very low53.6Low162 Ų162140 Ų14075%0.7577%0.767SS**SBendtrans-138.387.8171.1-97.6-77.5000109.9
364Q43.2Very low51.6Low190 Ų190137.8 Ų137.889%0.88876%0.756SS**  trans175.579.3150.5-97151.62.200110.5
365N40.1Very low49.7Very low172 Ų172140.3 Ų140.392%0.9276%0.763SS**  trans-119.954158.9-108.5-7.5000107.9
366V45.1Very low47.9Very low110 Ų110140.1 Ų140.167%0.66778%0.778SS**SBendtrans-150.4125.4166.3-164.50000106.8
367F40.6Very low46.3Very low192 Ų192146.7 Ų146.784%0.84279%0.793SS**  trans99.4120.6175.8-64.6-79.8000117.9
368P40.9Very low44.4Very low115 Ų115149.8 Ų149.875%0.74780%0.799SS**PPolyproline II helixtrans-84.4165.5-17635.9-31.6000112.2
369P37.4Very low43.3Very low130 Ų130148.4 Ų148.484%0.84480%0.803SS**PPolyproline II helixtrans-86.2133.2-160.533.7-31.5000111.8
370D39.7Very low42.2Very low160 Ų160149.2 Ų149.286%0.85680%0.803SS**PPolyproline II helixtrans-103.8138.3161.7-154.91.4000110.6
371K37Very low41.5Very low181 Ų181151.6 Ų151.679%0.78781%0.81SS**PPolyproline II helixtrans-72.9139.3-170.8-65.1166.2177.3172.50109.1
372T42.4Very low40.9Very low128 Ų128153.9 Ų153.979%0.78581%0.807SS**  164.9131.1124.142.80000112.8
373T43.4Very low40.8Very low127 Ų127154.1 Ų154.178%0.77981%0.807SS**  trans62.198.4144.250.20000121.8
374N36.7Very low40.4Very low139 Ų139155.3 Ų155.374%0.74381%0.81SS**  71.7136.3107.7-140.913.3000121.4
375N40.1Very low40.4Very low143 Ų143154.8 Ų154.877%0.76581%0.807SS**  trans81.9115.5160.6-62.5-21.7000119.5
376G41Very low40.8Very low68 Ų68153.2 Ų153.270%0.70180%0.799SS**  trans154.275.9149.700000118
377Y40.7Very low40.7Very low228 Ų228153.6 Ų153.689%0.89480%0.804SS**  trans34.4105.5146.8-57.9-83.6000120.2
378Q36.4Very low40.8Very low191 Ų191152.9 Ų152.989%0.89380%0.8SS**  trans-89124.8155-79.1-162.5-700110.5
379V44.2Very low41.3Very low131 Ų131155.7 Ų155.779%0.79481%0.809SS**  trans-102.3111.8168.61790000107.9
380Q36.3Very low41.7Very low179 Ų179165 Ų16584%0.83683%0.827SS**  trans-84.1118.7174.4-121.7164.911.500109E382Q380-E382 PolarHBondContact O-N 3.28Å
381L39.3Very low41.8Very low166 Ų166165.2 Ų165.287%0.86983%0.826SS**  trans-85.5100.7170-84.4160.9000109.2I383L381-I383 PolarHBondContact O-N 3.1Å
382E38.2Very low42.1Very low171 Ų171164.4 Ų164.480%0.79983%0.828SS**  trans-81.4104.2173.1-164.6-176.515900109.6Q380 K384Q380-E382 PolarHBondContact O-N 3.28Å; E382-K384 PolarHBondContact O-N 3.07Å
383I43.9Very low42.1Very low153 Ų153166.4 Ų166.479%0.78583%0.83SS**  trans-80.799.1171.6-61.2175.8000108L381 Q385L381-I383 PolarHBondContact O-N 3.1Å; I383-Q385 PolarHBondContact O-N 2.99Å
384K42.4Very low42Very low187 Ų187168.7 Ų168.781%0.81383%0.833SS**  trans-79.1101.2175.5-153.9175.3-169174.50110E382E382-K384 PolarHBondContact O-N 3.07Å
385Q43Very low42.3Very low179 Ų179170.6 Ų170.684%0.83684%0.839SS**  trans-79.9124166.4-77.1-174-21.600110I383I383-Q385 PolarHBondContact O-N 2.99Å
386N48.6Very low42.5Very low139 Ų139172.4 Ų172.474%0.74384%0.844SS**  trans-92121.5175.7-178.314.9000110
387P41.8Very low42.6Very low118 Ų118179.9 Ų179.977%0.76685%0.854SS**  trans-99.586.8178.135.6-26.5000110.5
388K44.2Very low42.7Very low177 Ų177176.2 Ų176.277%0.7785%0.851SS**  trans-149.385159.9-79.2-165.9179.3179.60108.8
389D49.9Very low43.2Very low174 Ų174174.9 Ų174.993%0.9385%0.847SS**  trans-17894.1149.9-89.5-21.5000107.6
390R47.2Very low43.1Very low325 Ų325178.9 Ų178.9100%1.22685%0.852SS**  trans-132.30162.2-131.4-166.3-150.8-158.97.4108.2

Retrieved 390 of 390 residues in 112.4 ms (Link to these results)