A0A087XLN7_POEFO Loading...

Metal cation symporter ZIP14

AlphaFold DB , UniProt , Accession A0A087XLN7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 512 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
1M27.7Very low33.8Very low239 Ų239156.1 Ų156.1100%1.17783%0.834SS**  0127.10-72.2168.4168.500107.9
2P34Very low33.5Very low124 Ų124156.7 Ų156.781%0.80583%0.832SS**  trans-85150.1174.934.5-32.8000111.2
3I28.9Very low33.4Very low172 Ų172153 Ų15388%0.88282%0.819SS**  trans-120.6125.7154.9-65.1179.4000106.1
4W30.8Very low33.7Very low238 Ų238152.7 Ų152.790%0.90282%0.815SS**  trans-102.3138.1-179.2-147.855.3000108.5
5S29.7Very low33.9Very low111 Ų111149.7 Ų149.778%0.77681%0.805SS**  trans-146.3124.8164.1-170.10000108.7
6P45.7Very low34Very low84 Ų84146 Ų14655%0.54579%0.794SS.*  trans-89.7131.4-172.633.8-32.8000111.8
7H34.8Very low34.3Very low192 Ų192145.5 Ų145.589%0.88979%0.79SS**  -171140.1123.6-88.6-44.7000109.8R9H7-R9 PolarHBondContact O-N 3.49Å
8G45.9Very low34.5Very low77 Ų77144.1 Ų144.179%0.79478%0.781SS**  trans-78.8121.7-17000000113.8
9R29.9Very low35Very low224 Ų224141.4 Ų141.485%0.84577%0.774SS**  trans-15496.7146-142.1171.6-66.7-1572.1110.2H7 T11H7-R9 PolarHBondContact O-N 3.49Å; R9-T11 VanDerWaalsContact C-N 3.33Å; R9-T11 PolarHBondContact O-N 3.05Å
10V31.3Very low35.9Very low137 Ų137140.8 Ų140.883%0.8377%0.765SS**  trans-7986.6174.4-178.70000108.2M12V10-M12 HydrophobicContact CG1-CB 4.31Å; V10-M12 PolarHBondContact O-N 3.47Å
11T32.6Very low36.5Very low119 Ų119139 Ų13973%0.7376%0.761SS**  trans-7773.1173.1-36.60000109.2R9 T13R9-T11 VanDerWaalsContact C-N 3.33Å; R9-T11 PolarHBondContact O-N 3.05Å; T11-T13 PolarHBondContact O-N 2.86Å
12M30.3Very low37.8Very low163 Ų163133 Ų13380%0.80374%0.737SS**  trans-68.5119.8-178.1-163.4168.5-176.900110V10 I14V10-M12 HydrophobicContact CG1-CB 4.31Å; V10-M12 PolarHBondContact O-N 3.47Å; M12-I14 PolarHBondContact O-N 3.27Å
13T32Very low38.5Very low109 Ų109131.6 Ų131.667%0.66972%0.723SS**  trans-72.9110.3-170.434.50000112.3T11 T15T11-T13 PolarHBondContact O-N 2.86Å; T13-T15 PolarHBondContact O-N 2.79Å
14I38Very low39.5Very low149 Ų149128.2 Ų128.276%0.76471%0.706SS**THydrogen-bonded Turntrans-77.560.6175.7-44.9177.9000110.1M12M12-I14 PolarHBondContact O-N 3.27Å
15T36.7Very low40.4Very low108 Ų108122.9 Ų122.966%0.66369%0.694SS**THydrogen-bonded Turntrans-123-7.6-179.249.70000113.8T13T13-T15 PolarHBondContact O-N 2.79Å
16S36.1Very low41.4Very low90 Ų90119.9 Ų119.963%0.62968%0.676SS**SBendtrans-84.7-40.1-179.3-167.70000113.7L18 S19S16-L18 VanDerWaalsContact C-N 3.32Å; S16-L18 PolarHBondContact O-N 3.18Å; S16-S19 PolarHBondContact O-OG 3.23Å
17L38.2Very low41.9Very low138 Ų138119.1 Ų119.172%0.72367%0.67SS**G310 helixtrans-72.4-17.3-174.8-90.381.1000115S19L17-S19 PolarHBondContact O-N 2.94Å
18L39.1Very low42.6Very low120 Ų120112 Ų11263%0.62864%0.644SS**G310 helixtrans-78.92.2-179.8-78163.1000113.8S16S16-L18 VanDerWaalsContact C-N 3.32Å; S16-L18 PolarHBondContact O-N 3.18Å
19S43.2Very low43.1Very low92 Ų92113.5 Ų113.564%0.64364%0.638SS**G310 helixtrans-85.5-4.9-175.659.60000115.1S16 L17S16-S19 PolarHBondContact O-OG 3.23Å; L17-S19 PolarHBondContact O-N 2.94Å
20Q52.4Low43.9Very low129 Ų129109.2 Ų109.260%0.60363%0.631SS**  trans-94.3115.3177.4-67.7-161.6-5.100111.9V22 L23Q20-V22 PolarHBondContact O-N 3.33Å; Q20-L23 PolarHBondContact O-N 3.29Å
21P49.6Very low44.6Very low105 Ų105108.5 Ų108.568%0.68262%0.622SS**Hα-helixtrans-66.3-25.5-175.326.1-34.5000113.3L24 L25P21-L24 PolarHBondContact O-N 3.49Å; P21-L25 WeakPolarHBondContact O-CB 3.29Å; P21-L25 PolarHBondContact O-N 2.91Å
22V54.7Low45Very low111 Ų111108.4 Ų108.467%0.67363%0.625SS**Hα-helixtrans-64.5-44.2178.8-1760000111.6Q20 L25 A26Q20-V22 PolarHBondContact O-N 3.33Å; V22-L25 PolarHBondContact O-N 3.39Å; V22-A26 PolarHBondContact O-N 3.48Å
23L48.7Very low45.5Very low96 Ų96111.4 Ų111.450%0.50363%0.627SS.*Hα-helixtrans-68.1-39.5-179.6-174.565.1000111.4Q20 L25 A26 V27Q20-L23 PolarHBondContact O-N 3.29Å; L23-L25 VanDerWaalsContact C-N 3.34Å; L23-L25 PolarHBondContact O-N 3.24Å; L23-A26 PolarHBondContact O-N 3.15Å; L23-V27 WeakPolarHBondContact O-CB 3.43Å; L23-V27 WeakPolarHBondContact O-CG2 3.31Å; L23-V27 PolarHBondContact O-N 3.33Å
24L50.2Low45.9Very low100 Ų100109.9 Ų109.952%0.52463%0.625SS.*Hα-helixtrans-65.4-37177.5-123.5155.7000111.7P21 A28P21-L24 PolarHBondContact O-N 3.49Å; L24-A28 VanDerWaalsContact O-CB 3.29Å; L24-A28 WeakPolarHBondContact O-CB 3.5Å; L24-A28 PolarHBondContact O-N 3.44Å
25L48.5Very low45.6Very low126 Ų126106 Ų10666%0.6662%0.622SS**Hα-helixtrans-67.9-44.6174.3-156.176.9000112P21 V22 L23 A28 V29P21-L25 WeakPolarHBondContact O-CB 3.29Å; P21-L25 PolarHBondContact O-N 2.91Å; V22-L25 PolarHBondContact O-N 3.39Å; L23-L25 VanDerWaalsContact C-N 3.34Å; L23-L25 PolarHBondContact O-N 3.24Å; L25-A28 PolarHBondContact O-N 3.28Å; L25-V29 WeakPolarHBondContact O-CG2 3.21Å; L25-V29 PolarHBondContact O-N 3.33Å
26A52.2Low45.4Very low49 Ų49109.6 Ų109.641%0.40563%0.631SS.*Hα-helixtrans-62.2-44.5177.900000112.3V22 L23 V29 L30V22-A26 PolarHBondContact O-N 3.48Å; L23-A26 PolarHBondContact O-N 3.15Å; A26-V29 PolarHBondContact O-N 3.23Å; A26-L30 WeakPolarHBondContact O-CG 3.35Å; A26-L30 PolarHBondContact O-N 2.89Å; A26-L30 VanDerWaalsContact O-N 3.13Å
27V55.4Low45Very low67 Ų67111.5 Ų111.541%0.40664%0.639SS.*Hα-helixtrans-67-37.4176.7172.30000111.5L23 L30 L31L23-V27 WeakPolarHBondContact O-CB 3.43Å; L23-V27 WeakPolarHBondContact O-CG2 3.31Å; L23-V27 PolarHBondContact O-N 3.33Å; V27-L30 PolarHBondContact O-N 3.37Å; V27-L31 HydrophobicContact CG1-CD1 3.68Å; V27-L31 HydrophobicContact CG1-CG 4.21Å; V27-L31 WeakPolarHBondContact O-CB 3.34Å; V27-L31 WeakPolarHBondContact O-CG 3.45Å; V27-L31 PolarHBondContact O-N 2.87Å
28A50.5Low44.6Very low43 Ų43110.9 Ų110.936%0.35564%0.641SS.*Hα-helixtrans-63.5-43.2175.200000112.5L24 L25 L30 L31 C32L24-A28 VanDerWaalsContact O-CB 3.29Å; L24-A28 WeakPolarHBondContact O-CB 3.5Å; L24-A28 PolarHBondContact O-N 3.44Å; L25-A28 PolarHBondContact O-N 3.28Å; A28-L30 VanDerWaalsContact C-N 3.33Å; A28-L30 PolarHBondContact O-N 3.27Å; A28-L31 PolarHBondContact O-N 3.01Å; A28-C32 WeakPolarHBondContact O-CB 3.5Å; A28-C32 PolarHBondContact O-N 3.37Å; A28-C32 PolarHBondContact O-SG 3.5Å
29V54.4Low44Very low108 Ų108111 Ų11166%0.65565%0.65SS**Hα-helixtrans-64.3-37.6176.9173.30000111.7L25 A26L25-V29 WeakPolarHBondContact O-CG2 3.21Å; L25-V29 PolarHBondContact O-N 3.33Å; A26-V29 PolarHBondContact O-N 3.23Å
30L48.6Very low43.2Very low135 Ų135115.1 Ų115.171%0.70766%0.66SS**Hα-helixtrans-68.9-41.6175.6-73.5166.9000112.8A26 V27 A28A26-L30 WeakPolarHBondContact O-CG 3.35Å; A26-L30 PolarHBondContact O-N 2.89Å; A26-L30 VanDerWaalsContact O-N 3.13Å; V27-L30 PolarHBondContact O-N 3.37Å; A28-L30 VanDerWaalsContact C-N 3.33Å; A28-L30 PolarHBondContact O-N 3.27Å
31L45.8Very low42.2Very low122 Ų122117.8 Ų117.864%0.63967%0.672SS**Hα-helixtrans-76-32.8-178.2-70175.1000113.5V27 A28 R33 A34V27-L31 HydrophobicContact CG1-CD1 3.68Å; V27-L31 HydrophobicContact CG1-CG 4.21Å; V27-L31 WeakPolarHBondContact O-CB 3.34Å; V27-L31 WeakPolarHBondContact O-CG 3.45Å; V27-L31 PolarHBondContact O-N 2.87Å; A28-L31 PolarHBondContact O-N 3.01Å; L31-R33 PolarHBondContact O-N 3.5Å; L31-A34 PolarHBondContact O-N 2.98Å; L31-A34 VanDerWaalsContact O-N 3.09Å
32C40.3Very low41.3Very low116 Ų116119.6 Ų119.678%0.78467%0.671SS**THydrogen-bonded Turntrans-64.4-10.5-179.3-79.20000114.8A28A28-C32 WeakPolarHBondContact O-CB 3.5Å; A28-C32 PolarHBondContact O-N 3.37Å; A28-C32 PolarHBondContact O-SG 3.5Å
33R41.8Very low40.4Very low226 Ų226118.9 Ų118.985%0.85367%0.671SS**THydrogen-bonded Turntrans-94-4.4175.8-136.2173.1-172.3167.81.6114L31 G35L31-R33 PolarHBondContact O-N 3.5Å; R33-G35 PolarHBondContact O-N 3.01Å
34A38.8Very low40.1Very low77 Ų77120.4 Ų120.464%0.63668%0.68SS**  trans-9447-178.100000113.5L31 Q36L31-A34 PolarHBondContact O-N 2.98Å; L31-A34 VanDerWaalsContact O-N 3.09Å; A34-Q36 PolarHBondContact O-N 3.31Å
35G32.3Very low39.6Very low67 Ų67121.9 Ų121.969%0.69169%0.693SS**  trans-71.8120.5171.200000110.9R33 V37R33-G35 PolarHBondContact O-N 3.01Å; G35-V37 PolarHBondContact O-N 3.25Å
36Q32.4Very low39.6Very low185 Ų185121 Ų12186%0.86469%0.686SS**  trans-67.9124.9-176.2-64.4178.1-83.300112.1A34A34-Q36 PolarHBondContact O-N 3.31Å
37V28.3Very low39.9Very low130 Ų130123.7 Ų123.779%0.78869%0.693SS**  trans-100.2110.1161.1178.90000108G35 C39G35-V37 PolarHBondContact O-N 3.25Å; V37-C39 PolarHBondContact O-N 2.99Å
38T29.5Very low40.1Very low124 Ų124125.8 Ų125.876%0.76171%0.708SS**  trans-84.296.3172.949.60000109.8Q40T38-Q40 PolarHBondContact O-N 3.47Å
39C26.7Very low40.5Very low122 Ų122127 Ų12782%0.82472%0.718SS**  trans-68.6122.1167.6-65.20000109.5V37V37-C39 PolarHBondContact O-N 2.99Å
40Q26.7Very low41Very low180 Ų180126.3 Ų126.384%0.84171%0.708SS**  trans-105.1118171.2-173.9168.7-49.700108.4T38T38-Q40 PolarHBondContact O-N 3.47Å
41E30.2Very low42Very low184 Ų184123.3 Ų123.386%0.8669%0.694SS**  trans-81.3122.3-173.3-157.6177.1151.200110.6
42Q30.3Very low43Very low143 Ų143119.6 Ų119.667%0.66868%0.675SS**  trans-135.6102179.3-175.8173.9-42.500110D44Q42-D44 PolarHBondContact NE2-OD2 3.5Å; Q42-D44 PolarHBondContact O-N 3.28Å; Q42-D44 VanDerWaalsContact O-N 3.1Å
43S37.3Very low44.4Very low97 Ų97120.3 Ų120.368%0.67867%0.667SS**  trans-84.773.2-173.5-44.90000112.9T45S43-T45 PolarHBondContact O-N 3.04Å; S43-T45 VanDerWaalsContact O-N 3.16Å
44D40.9Very low45.6Very low127 Ų127113 Ų11368%0.67965%0.645SS**  trans-70.9106.4172-83.4-53.1000111Q42 Q46Q42-D44 PolarHBondContact NE2-OD2 3.5Å; Q42-D44 PolarHBondContact O-N 3.28Å; Q42-D44 VanDerWaalsContact O-N 3.1Å; D44-Q46 PolarHBondContact O-N 3.02Å
45T40.3Very low47.2Very low131 Ų131111.9 Ų111.980%0.80463%0.628SS**  trans-80.381.9-178-53.50000110.6S43 L47S43-T45 PolarHBondContact O-N 3.04Å; S43-T45 VanDerWaalsContact O-N 3.16Å; T45-L47 PolarHBondContact O-N 3.36Å
46Q49.7Very low49.1Very low107 Ų107109.1 Ų109.150%0.560%0.597SS.*  trans-61.4129.9-175.6-141.6176.8-2.400112.1D44 Q50 V51 D54D44-Q46 PolarHBondContact O-N 3.02Å; Q46-Q50 HydrophobicContact CG-CB 4.24Å; Q46-V51 HydrophobicContact CB-CG2 4.19Å; Q46-V51 HydrophobicContact CG-CG2 4.15Å; Q46-D54 PolarHBondContact NE2-OD2 3Å
47L57.2Low51Low107 Ų107102.6 Ų102.656%0.5658%0.575SS**  trans-73.9145.5-179.9-74.793.4000111.3T45 A49 Q50 V51T45-L47 PolarHBondContact O-N 3.36Å; L47-A49 PolarHBondContact O-N 3.05Å; L47-Q50 HydrophobicContact CB-CG 4.3Å; L47-Q50 WeakPolarHBondContact O-CA 3.25Å; L47-Q50 WeakPolarHBondContact O-CB 3.49Å; L47-Q50 PolarHBondContact O-N 3.05Å; L47-V51 PolarHBondContact O-N 3.38Å
48P59.4Low53Low111 Ų111104.7 Ų104.772%0.72157%0.569SS**Hα-helixtrans-55.6-31.1-179-28.435.5000115L52P48-L52 PolarHBondContact O-N 3.13Å; P48-L52 VanDerWaalsContact O-N 3.17Å
49A59.1Low54.9Low68 Ų68103 Ų10356%0.56255%0.549SS*.Hα-helixtrans-68.7-35.7174.700000112.8L47 Q53L47-A49 PolarHBondContact O-N 3.05Å; A49-Q53 VanDerWaalsContact O-CB 3.3Å; A49-Q53 WeakPolarHBondContact O-CB 3.37Å; A49-Q53 PolarHBondContact O-N 2.83Å
50Q65.9Low57Low94 Ų9497.8 Ų97.844%0.43952%0.516SS..Hα-helixtrans-68.2-44.1175.9-65.7171.2-48.600110.6Q46 L47 L52 Q53 D54Q46-Q50 HydrophobicContact CG-CB 4.24Å; L47-Q50 HydrophobicContact CB-CG 4.3Å; L47-Q50 WeakPolarHBondContact O-CA 3.25Å; L47-Q50 WeakPolarHBondContact O-CB 3.49Å; L47-Q50 PolarHBondContact O-N 3.05Å; Q50-L52 VanDerWaalsContact C-N 3.33Å; Q50-L52 PolarHBondContact O-N 2.7Å; Q50-Q53 PolarHBondContact O-N 3.16Å; Q50-Q53 VanDerWaalsContact O-N 3.13Å; Q50-D54 WeakPolarHBondContact O-CB 3.45Å; Q50-D54 PolarHBondContact O-N 2.99Å
51V68.8Low59.3Low71 Ų7192.4 Ų92.443%0.4349%0.493SS..Hα-helixtrans-59.5-43.7177.3-179.40000111.4Q46 L47 Q53 L55Q46-V51 HydrophobicContact CB-CG2 4.19Å; Q46-V51 HydrophobicContact CG-CG2 4.15Å; L47-V51 PolarHBondContact O-N 3.38Å; V51-Q53 VanDerWaalsContact C-N 3.34Å; V51-L55 WeakPolarHBondContact O-CB 3.29Å; V51-L55 PolarHBondContact O-N 3.44Å; V51-L55 VanDerWaalsContact O-N 3.12Å
52L68.1Low61.1Low45 Ų4589 Ų8924%0.23648%0.481CS..Hα-helixtrans-64.2-38.8175.7-178.560.3000112.2P48 Q50 L56 L129P48-L52 PolarHBondContact O-N 3.13Å; P48-L52 VanDerWaalsContact O-N 3.17Å; Q50-L52 VanDerWaalsContact C-N 3.33Å; Q50-L52 PolarHBondContact O-N 2.7Å; L52-L56 HydrophobicContact CD1-CD1 4.4Å; L52-L56 HydrophobicContact CG-CD1 4.27Å; L52-L56 WeakPolarHBondContact O-CG 3.39Å; L52-L56 PolarHBondContact O-N 3.26Å; L52-L129 HydrophobicContact CD1-CB 4.44Å; L52-L129 HydrophobicContact CD1-CD2 4.02Å; L52-L129 HydrophobicContact CD1-CG 4.44Å
53Q68.4Low62.8Low131 Ų13185.8 Ų85.861%0.61247%0.474SS*.Hα-helixtrans-77-37-177.9-166.5160.5-0.300112.7A49 Q50 V51 L55 L56 A57A49-Q53 VanDerWaalsContact O-CB 3.3Å; A49-Q53 WeakPolarHBondContact O-CB 3.37Å; A49-Q53 PolarHBondContact O-N 2.83Å; Q50-Q53 PolarHBondContact O-N 3.16Å; Q50-Q53 VanDerWaalsContact O-N 3.13Å; V51-Q53 VanDerWaalsContact C-N 3.34Å; Q53-L55 VanDerWaalsContact C-N 3.32Å; Q53-L55 PolarHBondContact O-N 3.24Å; Q53-L56 PolarHBondContact O-N 3.06Å; Q53-A57 VanDerWaalsContact O-CB 3.27Å; Q53-A57 WeakPolarHBondContact O-CB 3.45Å; Q53-A57 PolarHBondContact O-N 2.86Å
54D68.3Low64.6Low73 Ų7381.9 Ų81.939%0.3945%0.446SS..Hα-helixtrans-60.7-41.2169.7-85.8-13000111.4Q46 Q50 A57 R58Q46-D54 PolarHBondContact NE2-OD2 3Å; Q50-D54 WeakPolarHBondContact O-CB 3.45Å; Q50-D54 PolarHBondContact O-N 2.99Å; D54-A57 PolarHBondContact O-N 2.88Å; D54-R58 WeakPolarHBondContact O-CB 3.15Å; D54-R58 PolarHBondContact O-N 3.15Å
55L70.5Confident66.2Low52 Ų5275.9 Ų75.927%0.27241%0.414SS..Hα-helixtrans-66.8-43.1178.3-172.6161.8000111.1V51 Q53 A57 R58 Y59 L73 L129V51-L55 WeakPolarHBondContact O-CB 3.29Å; V51-L55 PolarHBondContact O-N 3.44Å; V51-L55 VanDerWaalsContact O-N 3.12Å; Q53-L55 VanDerWaalsContact C-N 3.32Å; Q53-L55 PolarHBondContact O-N 3.24Å; L55-A57 VanDerWaalsContact C-N 3.34Å; L55-R58 PolarHBondContact O-N 3.21Å; L55-Y59 HydrophobicContact CG-CD2 4.46Å; L55-Y59 PolarHBondContact O-N 3.31Å; L55-L73 HydrophobicContact CD1-CD2 4.33Å; L55-L73 HydrophobicContact CD2-CD2 3.65Å; L55-L73 HydrophobicContact CG-CD2 4.1Å; L55-L129 HydrophobicContact CD2-CD2 3.64Å
56L73.4Confident67.9Low10 Ų1071.1 Ų71.15%0.05239%0.385CS..Hα-helixtrans-68.1-29.4174.1-71.7169.4000113.4L52 Q53 G60 N62 I65 L129L52-L56 HydrophobicContact CD1-CD1 4.4Å; L52-L56 HydrophobicContact CG-CD1 4.27Å; L52-L56 WeakPolarHBondContact O-CG 3.39Å; L52-L56 PolarHBondContact O-N 3.26Å; Q53-L56 PolarHBondContact O-N 3.06Å; L56-G60 CarbonylContact O-C 3.54Å; L56-G60 WeakPolarHBondContact O-CA 3.23Å; L56-G60 PolarHBondContact O-N 3.13Å; L56-G60 VanDerWaalsContact O-N 3.1Å; L56-N62 WeakPolarHBondContact O-CA 3.46Å; L56-N62 PolarHBondContact O-N 3.44Å; L56-N62 VanDerWaalsContact O-N 3.16Å; L56-I65 HydrophobicContact CD2-CB 4.05Å; L56-I65 HydrophobicContact CD2-CG2 4.17Å; L56-L129 HydrophobicContact CD2-CD2 4.32Å
57A71.3Confident68.7Low47 Ų4766.2 Ų66.239%0.38836%0.362SS..Hα-helixtrans-78-31.3174.500000113.3Q53 D54 L55 N62Q53-A57 VanDerWaalsContact O-CB 3.27Å; Q53-A57 WeakPolarHBondContact O-CB 3.45Å; Q53-A57 PolarHBondContact O-N 2.86Å; D54-A57 PolarHBondContact O-N 2.88Å; L55-A57 VanDerWaalsContact C-N 3.34Å; A57-N62 WeakPolarHBondContact CA-OD1 3.34Å; A57-N62 VanDerWaalsContact CB-OD1 3.29Å; A57-N62 WeakPolarHBondContact CB-OD1 3.45Å
58R71.9Confident69.1Low175 Ų17564.6 Ų64.666%0.6636%0.358SS*.Hα-helixtrans-88.3-29.3-177.4-165.9177.8-59.4179.44.4113.7D54 L55D54-R58 WeakPolarHBondContact O-CB 3.15Å; D54-R58 PolarHBondContact O-N 3.15Å; L55-R58 PolarHBondContact O-N 3.21Å
59Y69.5Low69.5Low87 Ų8762 Ų6234%0.34134%0.336SS..Hα-helixtrans-126.60.4-175.4-59.4-78.4000114.7L55 Q69 L73 L76L55-Y59 HydrophobicContact CG-CD2 4.46Å; L55-Y59 PolarHBondContact O-N 3.31Å; Y59-Q69 WeakPolarHBondContact O-CB 3.35Å; Y59-L73 HydrophobicContact CD1-CD1 4.12Å; Y59-L73 HydrophobicContact CD2-CD1 3.81Å; Y59-L73 HydrophobicContact CD2-CD2 4.42Å; Y59-L73 HydrophobicContact CE1-CD1 4.18Å; Y59-L73 HydrophobicContact CE2-CD1 3.87Å; Y59-L73 HydrophobicContact CG-CD1 3.95Å; Y59-L73 HydrophobicContact CG-CD2 4.44Å; Y59-L76 HydrophobicContact CE1-CD1 3.89Å
60G70.3Confident69.9Low14 Ų1459 Ų5914%0.14431%0.311CS..SBendtrans-138.2-164.9178.300000112.4L56 N62L56-G60 CarbonylContact O-C 3.54Å; L56-G60 WeakPolarHBondContact O-CA 3.23Å; L56-G60 PolarHBondContact O-N 3.13Å; L56-G60 VanDerWaalsContact O-N 3.1Å; G60-N62 VanDerWaalsContact C-N 3.26Å; G60-N62 PolarHBondContact O-N 3.09Å
61D74.1Confident69.9Low67 Ų6760 Ų6036%0.35831%0.311SS..SBendtrans-91.544.1-175.8-62.19.9000111.2S63 T64 Q69 R123D61-S63 PolarHBondContact O-N 3.05Å; D61-T64 PolarHBondContact N-O 2.82Å; D61-Q69 PolarHBondContact OD1-NE2 2.89Å; D61-R123 IonicContact OD2-CZ 3.73Å; D61-R123 IonicContact OD2-NH1 3.86Å; D61-R123 PolarHBondContact OD2-NH1 3Å; D61-R123 IonicContact OD2-NH2 3.29Å; D61-R123 PolarHBondContact OD2-NH2 3.43Å
62N69.3Low69.7Low111 Ų11160 Ų6059%0.59431%0.314SS*.SBendtrans61.3-27.5-173.1-66.5-63.8000117.5L56 A57 G60L56-N62 WeakPolarHBondContact O-CA 3.46Å; L56-N62 PolarHBondContact O-N 3.44Å; L56-N62 VanDerWaalsContact O-N 3.16Å; A57-N62 WeakPolarHBondContact CA-OD1 3.34Å; A57-N62 VanDerWaalsContact CB-OD1 3.29Å; A57-N62 WeakPolarHBondContact CB-OD1 3.45Å; G60-N62 VanDerWaalsContact C-N 3.26Å; G60-N62 PolarHBondContact O-N 3.09Å
63S66.1Low69.6Low77 Ų7758.1 Ų58.154%0.53830%0.304SS..SBendtrans-124.5-26.6178.757.70000113.9D61D61-S63 PolarHBondContact O-N 3.05Å
64T73.1Confident69.5Low15 Ų1554 Ų549%0.09229%0.286CS..EExtended strand (participates in β ladder)trans-134.9141.3-17679.60000111.2D61 R123 L124 D125D61-T64 PolarHBondContact N-O 2.82Å; T64-R123 PolarHBondContact OG1-NH1 3.28Å; T64-L124 CarbonylContact C-O 3.56Å; T64-L124 WeakPolarHBondContact CA-O 3.34Å; T64-D125 WeakPolarHBondContact CG2-OD1 3.39Å
65I75.4Confident69Low0 Ų052.8 Ų52.80%029%0.286CS..EExtended strand (participates in β ladder)trans-108.8134.9169.5-165.8168.7000110.6L56 Q69 L70 L73 L124 L129L56-I65 HydrophobicContact CD2-CB 4.05Å; L56-I65 HydrophobicContact CD2-CG2 4.17Å; I65-Q69 HydrophobicContact CD1-CB 4.1Å; I65-Q69 HydrophobicContact CG1-CB 3.56Å; I65-L70 HydrophobicContact CD1-CB 4.08Å; I65-L70 HydrophobicContact CD1-CD1 4.37Å; I65-L70 HydrophobicContact CG1-CB 4.23Å; I65-L73 HydrophobicContact CD1-CD2 4.35Å; I65-L124 HydrophobicContact CG2-CB 3.96Å; I65-L124 PolarHBondContact N-O 2.97Å; I65-L124 PolarHBondContact O-N 2.9Å; I65-L129 HydrophobicContact CG2-CD2 4.46Å
66T76.1Confident68.6Low32 Ų3254.2 Ų54.220%0.19629%0.294CS..EExtended strand (participates in β ladder)trans-82.3156.6174.863.60000111.4P68 Q69 L70 R123T66-P68 VanDerWaalsContact C-N 3.35Å; T66-Q69 PolarHBondContact O-N 3.38Å; T66-Q69 VanDerWaalsContact O-N 3.17Å; T66-Q69 VanDerWaalsContact OG1-CD 3.27Å; T66-Q69 WeakPolarHBondContact OG1-CG 3.3Å; T66-Q69 PolarHBondContact OG1-N 2.95Å; T66-Q69 PolarHBondContact OG1-OE1 3.13Å; T66-L70 WeakPolarHBondContact O-CB 3.44Å; T66-L70 PolarHBondContact O-N 3.03Å; T66-R123 HydrophobicContact CG2-CG 4.1Å
67V66.6Low68.1Low3 Ų357.1 Ų57.12%0.01831%0.309CS..Hα-helixtrans-55.2-40.5177.8178.10000113.3L70 R71 L113 I118 S119 L124V67-L70 PolarHBondContact O-N 3.42Å; V67-R71 WeakPolarHBondContact O-CB 3.45Å; V67-R71 PolarHBondContact O-N 3.26Å; V67-L113 HydrophobicContact CG1-CD1 3.79Å; V67-L113 HydrophobicContact CG1-CD2 4.5Å; V67-L113 HydrophobicContact CG2-CD2 4.46Å; V67-I118 HydrophobicContact CG2-CG2 3.73Å; V67-S119 WeakPolarHBondContact CG2-O 3.37Å; V67-L124 HydrophobicContact CG2-CD1 4.16Å
68P65.1Low67.4Low73 Ų7357.1 Ų57.147%0.47431%0.306SS..Hα-helixtrans-65-41.9173.9-24.836.6000114.4T66 R71 S72T66-P68 VanDerWaalsContact C-N 3.35Å; P68-R71 PolarHBondContact O-N 2.95Å; P68-S72 PolarHBondContact O-N 3.45Å; P68-S72 VanDerWaalsContact O-N 3.09Å
69Q68.6Low66.5Low57 Ų5755.4 Ų55.427%0.26631%0.306SS..Hα-helixtrans-60.8-46.3174.5-80.4160.9-35.300110.9Y59 D61 I65 T66 R71 S72 L73Y59-Q69 WeakPolarHBondContact O-CB 3.35Å; D61-Q69 PolarHBondContact OD1-NE2 2.89Å; I65-Q69 HydrophobicContact CD1-CB 4.1Å; I65-Q69 HydrophobicContact CG1-CB 3.56Å; T66-Q69 PolarHBondContact O-N 3.38Å; T66-Q69 VanDerWaalsContact O-N 3.17Å; T66-Q69 VanDerWaalsContact OG1-CD 3.27Å; T66-Q69 WeakPolarHBondContact OG1-CG 3.3Å; T66-Q69 PolarHBondContact OG1-N 2.95Å; T66-Q69 PolarHBondContact OG1-OE1 3.13Å; Q69-R71 VanDerWaalsContact C-N 3.33Å; Q69-R71 PolarHBondContact O-N 3.46Å; Q69-S72 WeakPolarHBondContact O-CB 3.25Å; Q69-S72 PolarHBondContact O-N 3.38Å; Q69-S72 VanDerWaalsContact O-N 3.11Å; Q69-L73 PolarHBondContact O-N 2.94Å
70L67.8Low65.3Low5 Ų554.7 Ų54.73%0.02631%0.313CS..Hα-helixtrans-62.3-38.4177.7-179.562000112.4I65 T66 V67 S72 L73 L74 L124 L129 L132 M136I65-L70 HydrophobicContact CD1-CB 4.08Å; I65-L70 HydrophobicContact CD1-CD1 4.37Å; I65-L70 HydrophobicContact CG1-CB 4.23Å; T66-L70 WeakPolarHBondContact O-CB 3.44Å; T66-L70 PolarHBondContact O-N 3.03Å; V67-L70 PolarHBondContact O-N 3.42Å; L70-S72 VanDerWaalsContact C-N 3.31Å; L70-S72 PolarHBondContact O-N 3.32Å; L70-L73 PolarHBondContact O-N 3.26Å; L70-L74 HydrophobicContact CG-CD1 4.37Å; L70-L74 WeakPolarHBondContact O-CB 3.41Å; L70-L74 PolarHBondContact O-N 2.68Å; L70-L124 HydrophobicContact CD2-CD1 4.32Å; L70-L124 HydrophobicContact CD2-CD2 3.93Å; L70-L129 HydrophobicContact CD1-CD1 3.78Å; L70-L132 HydrophobicContact CD2-CD2 3.79Å; L70-M136 HydrophobicContact CD1-CE 3.91Å; L70-M136 HydrophobicContact CD1-SD 4.46Å
71R65.4Low64.2Low114 Ų11458.7 Ų58.743%0.4333%0.328SS..Hα-helixtrans-62.1-37.5173.4-172.9-179.4-69.7152.71.4111.6V67 P68 Q69 A75 E120V67-R71 WeakPolarHBondContact O-CB 3.45Å; V67-R71 PolarHBondContact O-N 3.26Å; P68-R71 PolarHBondContact O-N 2.95Å; Q69-R71 VanDerWaalsContact C-N 3.33Å; Q69-R71 PolarHBondContact O-N 3.46Å; R71-A75 PolarHBondContact O-N 2.88Å; R71-E120 IonicContact CZ-OE1 3.51Å; R71-E120 IonicContact NH1-OE1 3.91Å; R71-E120 PolarHBondContact NH1-OE1 3.45Å; R71-E120 IonicContact NH2-OE1 3.17Å; R71-E120 PolarHBondContact NH2-OE1 2.92Å
72S64.3Low62.7Low72 Ų7260.1 Ų60.150%0.50334%0.343SS..Hα-helixtrans-71.4-40.1174.8-174.40000112.8P68 Q69 L70 A75 L76P68-S72 PolarHBondContact O-N 3.45Å; P68-S72 VanDerWaalsContact O-N 3.09Å; Q69-S72 WeakPolarHBondContact O-CB 3.25Å; Q69-S72 PolarHBondContact O-N 3.38Å; Q69-S72 VanDerWaalsContact O-N 3.11Å; L70-S72 VanDerWaalsContact C-N 3.31Å; L70-S72 PolarHBondContact O-N 3.32Å; S72-A75 PolarHBondContact O-N 3.45Å; S72-L76 PolarHBondContact O-N 3.03Å
73L67Low61.3Low6 Ų663.2 Ų63.23%0.03135%0.354CS..Hα-helixtrans-62.7-43.3174.2175.660.2000111.9L55 Y59 I65 Q69 L70 A75 L76 L77L55-L73 HydrophobicContact CD1-CD2 4.33Å; L55-L73 HydrophobicContact CD2-CD2 3.65Å; L55-L73 HydrophobicContact CG-CD2 4.1Å; Y59-L73 HydrophobicContact CD1-CD1 4.12Å; Y59-L73 HydrophobicContact CD2-CD1 3.81Å; Y59-L73 HydrophobicContact CD2-CD2 4.42Å; Y59-L73 HydrophobicContact CE1-CD1 4.18Å; Y59-L73 HydrophobicContact CE2-CD1 3.87Å; Y59-L73 HydrophobicContact CG-CD1 3.95Å; Y59-L73 HydrophobicContact CG-CD2 4.44Å; I65-L73 HydrophobicContact CD1-CD2 4.35Å; Q69-L73 PolarHBondContact O-N 2.94Å; L70-L73 PolarHBondContact O-N 3.26Å; L73-A75 VanDerWaalsContact C-N 3.32Å; L73-A75 PolarHBondContact O-N 3.04Å; L73-L76 PolarHBondContact O-N 2.76Å; L73-L77 HydrophobicContact CD1-CD1 4.12Å; L73-L77 HydrophobicContact CD1-CG 4.17Å; L73-L77 HydrophobicContact CG-CD1 4.04Å; L73-L77 WeakPolarHBondContact O-CG 3.42Å; L73-L77 PolarHBondContact O-N 3.37Å
74L64.4Low59.9Low45 Ų4562.6 Ų62.624%0.23636%0.36CS..Hα-helixtrans-61.1-39.4176.2-83.1165.5000112.5L70 L77 S78 M136L70-L74 HydrophobicContact CG-CD1 4.37Å; L70-L74 WeakPolarHBondContact O-CB 3.41Å; L70-L74 PolarHBondContact O-N 2.68Å; L74-L77 PolarHBondContact O-N 3.18Å; L74-S78 WeakPolarHBondContact O-CB 3.28Å; L74-S78 PolarHBondContact O-N 3.36Å; L74-S78 PolarHBondContact O-OG 3.47Å; L74-M136 HydrophobicContact CD2-CB 4.15Å; L74-M136 HydrophobicContact CD2-CE 3.67Å; L74-M136 HydrophobicContact CD2-CG 4.05Å; L74-M136 HydrophobicContact CG-CE 3.99Å
75A59.2Low57.9Low47 Ų4766.7 Ų66.739%0.38839%0.389SS..Hα-helixtrans-60.5-48.3174.500000111.5R71 S72 L73 L77 S78 Q79R71-A75 PolarHBondContact O-N 2.88Å; S72-A75 PolarHBondContact O-N 3.45Å; L73-A75 VanDerWaalsContact C-N 3.32Å; L73-A75 PolarHBondContact O-N 3.04Å; A75-L77 PolarHBondContact O-N 3.25Å; A75-S78 PolarHBondContact O-N 3.5Å; A75-S78 PolarHBondContact O-OG 3.43Å; A75-Q79 PolarHBondContact O-N 3.06Å; A75-Q79 VanDerWaalsContact O-N 3.08Å
76L62.4Low55.9Low82 Ų8275 Ų7543%0.42943%0.433SS..Hα-helixtrans-59.6-44177.5-69.1169.2000112.4Y59 S72 L73 Q79 S80Y59-L76 HydrophobicContact CE1-CD1 3.89Å; S72-L76 PolarHBondContact O-N 3.03Å; L73-L76 PolarHBondContact O-N 2.76Å; L76-Q79 PolarHBondContact O-N 3.05Å; L76-S80 PolarHBondContact O-N 3.46Å
77L61.7Low53.7Low70 Ų7080 Ų8037%0.36646%0.459SS..Hα-helixtrans-65.1-40.2177.8-68.8171000112.2L73 L74 A75 Q79 S80 Q81 L140L73-L77 HydrophobicContact CD1-CD1 4.12Å; L73-L77 HydrophobicContact CD1-CG 4.17Å; L73-L77 HydrophobicContact CG-CD1 4.04Å; L73-L77 WeakPolarHBondContact O-CG 3.42Å; L73-L77 PolarHBondContact O-N 3.37Å; L74-L77 PolarHBondContact O-N 3.18Å; A75-L77 PolarHBondContact O-N 3.25Å; L77-Q79 PolarHBondContact O-N 3.35Å; L77-S80 PolarHBondContact O-N 2.99Å; L77-Q81 PolarHBondContact O-N 3.21Å; L77-L140 HydrophobicContact CB-CD1 4.24Å; L77-L140 HydrophobicContact CB-CD2 4.13Å
78S57.4Low52.2Low47 Ų4783.1 Ų83.133%0.32949%0.491SS..Hα-helixtrans-67.2-23.617671.30000113.5L74 A75L74-S78 WeakPolarHBondContact O-CB 3.28Å; L74-S78 PolarHBondContact O-N 3.36Å; L74-S78 PolarHBondContact O-OG 3.47Å; A75-S78 PolarHBondContact O-N 3.5Å; A75-S78 PolarHBondContact O-OG 3.43Å
79Q52.4Low50.4Low140 Ų14090.1 Ų90.165%0.65451%0.508SS*.Hα-helixtrans-81.5-44.1177.7-163166.75.800111.2A75 L76 L77 Q81 S82A75-Q79 PolarHBondContact O-N 3.06Å; A75-Q79 VanDerWaalsContact O-N 3.08Å; L76-Q79 PolarHBondContact O-N 3.05Å; L77-Q79 PolarHBondContact O-N 3.35Å; Q79-Q81 VanDerWaalsContact C-N 3.33Å; Q79-Q81 PolarHBondContact O-N 2.97Å; Q79-S82 WeakPolarHBondContact O-CB 3.05Å; Q79-S82 PolarHBondContact O-N 2.96Å; Q79-S82 VanDerWaalsContact O-N 3.16Å
80S43.6Very low48.9Very low72 Ų7295.1 Ų95.150%0.50354%0.537SS..Hα-helixtrans-60.9-34.2179.7174.80000113.9L76 L77 S82 E83L76-S80 PolarHBondContact O-N 3.46Å; L77-S80 PolarHBondContact O-N 2.99Å; S80-S82 PolarHBondContact O-N 3.23Å; S80-S82 VanDerWaalsContact O-N 3.14Å; S80-E83 PolarHBondContact O-N 3.49Å; S80-E83 VanDerWaalsContact O-N 3.11Å
81Q47.6Very low47Very low98 Ų98104.3 Ų104.346%0.45858%0.58SS.*G310 helixtrans-70.6-9-179.5-144.6-179.69.300113.4L77 Q79 E83 L140L77-Q81 PolarHBondContact O-N 3.21Å; Q79-Q81 VanDerWaalsContact C-N 3.33Å; Q79-Q81 PolarHBondContact O-N 2.97Å; Q81-E83 VanDerWaalsContact C-N 3.26Å; Q81-E83 PolarHBondContact O-N 3.48Å; Q81-L140 PolarHBondContact OE1-O 3.06Å
82S43.6Very low45.2Very low96 Ų96103 Ų10367%0.67159%0.593SS**G310 helixtrans-77.8-7.5171.5-161.70000113.8Q79 S80Q79-S82 WeakPolarHBondContact O-CB 3.05Å; Q79-S82 PolarHBondContact O-N 2.96Å; Q79-S82 VanDerWaalsContact O-N 3.16Å; S80-S82 PolarHBondContact O-N 3.23Å; S80-S82 VanDerWaalsContact O-N 3.14Å
83E38.8Very low43.7Very low177 Ų177108.9 Ų108.983%0.82761%0.61SS**G310 helixtrans-111.46.4-176.5-60.5-177.7131.600113.1S80 Q81S80-E83 PolarHBondContact O-N 3.49Å; S80-E83 VanDerWaalsContact O-N 3.11Å; Q81-E83 VanDerWaalsContact C-N 3.26Å; Q81-E83 PolarHBondContact O-N 3.48Å
84G36.9Very low41.6Very low63 Ų63114.7 Ų114.765%0.64965%0.645SS**SBendtrans-160.647.2-163.700000118
85S32.5Very low40.1Very low102 Ų102118.2 Ų118.271%0.71367%0.669SS**  trans-155.7104.3159.8-167.70000112.7
86N31.7Very low38.4Very low174 Ų174122.5 Ų122.593%0.9369%0.69SS**  trans-15945.2162.4-133.36.7000111.4
87D31.1Very low36.9Very low138 Ų138124.7 Ų124.774%0.73871%0.707SS**  trans-89.7119.9165.2-174.332.9000108.8
88G34.4Very low35.1Very low67 Ų67127.7 Ų127.769%0.69173%0.728SS**  trans-94.8125.3-17200000112.3
89R28.4Very low33.7Very low220 Ų220130.5 Ų130.583%0.8375%0.746SS**  trans-136.1127.5161.8-65-169.4-174.4-149-1.6111.1
90D36.1Very low32.7Very low163 Ų163129.1 Ų129.187%0.87275%0.749SS**  trans-62142.7166.5-54.2-91.3000110.9
91E29.1Very low31.9Very low197 Ų197135.8 Ų135.892%0.92177%0.769SS**  trans-150.8166.3139.6-126.9-174.116100113.9
92A27.5Very low31.1Very low86 Ų86136.5 Ų136.571%0.71178%0.78SS**  trans-77.4139.9-151.500000116.1T94A92-T94 PolarHBondContact O-N 3.35Å
93K31.3Very low30.4Very low197 Ų197139.4 Ų139.486%0.85779%0.788SS**  trans-44.7117.7157.5174.7-175-177.5177.30112.1
94T23.8Very low30.3Very low127 Ų127136.1 Ų136.178%0.77979%0.785SS**  trans-139.3137.4162.6-73.50000110.8A92A92-T94 PolarHBondContact O-N 3.35Å
95T31.7Very low30.2Very low119 Ų119137.4 Ų137.473%0.7378%0.783SS**  trans-98.5121-168.7-44.70000112.3
96T25.3Very low30.5Very low137 Ų137141.1 Ų141.184%0.8479%0.787SS**  trans-138.6148.9161.146.70000110.9
97V30.7Very low31.1Very low128 Ų128135.8 Ų135.878%0.77676%0.762SS**  trans-112.1124.2-164.9174.50000111.7
98T24.4Very low32Very low133 Ų133133.6 Ų133.682%0.81675%0.75SS**  trans-176.9164.9153.811.10000111.5
99P27.1Very low32.6Very low107 Ų107134.1 Ų134.170%0.69574%0.742SS**  -88.9-176.4-99.744.5-30.6000112.3K101P99-K101 PolarHBondContact O-N 3.29Å
100P30.3Very low33.5Very low110 Ų110126.5 Ų126.571%0.71473%0.725SS**  trans-71.5124-16828.8-33.9000112.7T102P100-T102 PolarHBondContact O-N 3.45Å
101K28.4Very low33.8Very low212 Ų212124.4 Ų124.492%0.92271%0.714SS**  trans-76.269169.6-72.3-174.5177.8177.80111.2P99 N103P99-K101 PolarHBondContact O-N 3.29Å; K101-N103 PolarHBondContact O-N 3.1Å
102T30.1Very low34.9Very low113 Ų113116.5 Ų116.569%0.69368%0.679SS**  trans-7095.7163.650.50000109.5P100P100-T102 PolarHBondContact O-N 3.45Å
103N29.7Very low36Very low157 Ų157114.1 Ų114.184%0.8466%0.655SS**  trans-178.4122.3146.8-91.7-26.1000108.6K101 S105K101-N103 PolarHBondContact O-N 3.1Å; N103-S105 PolarHBondContact O-N 3.19Å
104S34.9Very low36.9Very low109 Ų109107.9 Ų107.976%0.76264%0.64SS**  trans-72.7115.1169.645.60000109.1K106S104-K106 VanDerWaalsContact C-N 3.25Å; S104-K106 PolarHBondContact O-N 3.47Å
105S36.3Very low38.2Very low89 Ų89108.2 Ų108.262%0.62264%0.635SS**  trans-70.981.2175.249.70000110.2N103 T144N103-S105 PolarHBondContact O-N 3.19Å; S105-T144 VanDerWaalsContact O-CG2 3.23Å; S105-T144 WeakPolarHBondContact O-CG2 3.39Å
106K38Very low39.3Very low180 Ų180107 Ų10778%0.78362%0.618SS**  trans-55.1152.7158.7-69.9-178.9175.6179.80108.7S104 L108S104-K106 VanDerWaalsContact C-N 3.25Å; S104-K106 PolarHBondContact O-N 3.47Å; K106-L108 PolarHBondContact O-N 3.01Å; K106-L108 VanDerWaalsContact O-N 3.14Å
107C45.3Very low40.5Very low62 Ų62105.8 Ų105.842%0.41962%0.615SS.*  trans-46.6126167.6-82.20000110.3P109 T144 C145C107-P109 WeakPolarHBondContact O-CD 3.19Å; C107-T144 PolarHBondContact SG-O 3.21Å; C107-C145 WeakPolarHBondContact CA-SG 3.24Å; C107-C145 HydrophobicContact CB-CB 4.47Å; C107-C145 WeakPolarHBondContact CB-SG 3.35Å; C107-C145 WeakPolarHBondContact SG-CA 3.23Å; C107-C145 WeakPolarHBondContact SG-CB 3.28Å; C107-C145 CovalentContact SG-SG 2.05Å; C107-C145 PolarHBondContact SG-SG 3.26Å
108L49.3Very low41.9Very low92 Ų92101.2 Ų101.248%0.48259%0.586SS.*  trans-63.9115.1179.4-82.1162000108.2K106 T112K106-L108 PolarHBondContact O-N 3.01Å; K106-L108 VanDerWaalsContact O-N 3.14Å; L108-T112 HydrophobicContact CB-CG2 4.33Å; L108-T112 WeakPolarHBondContact CB-OG1 3.27Å; L108-T112 HydrophobicContact CD1-CG2 4.35Å; L108-T112 HydrophobicContact CD2-CG2 3.97Å; L108-T112 HydrophobicContact CG-CG2 4.44Å
109P47.1Very low43.3Very low79 Ų7997.4 Ų97.451%0.51357%0.565SS.*  trans-67.3166.8-179.329.6-34.8000110.5C107 D111 T112C107-P109 WeakPolarHBondContact O-CD 3.19Å; P109-D111 PolarHBondContact O-N 3.31Å; P109-T112 WeakPolarHBondContact O-CB 3.22Å; P109-T112 PolarHBondContact O-N 2.8Å; P109-T112 PolarHBondContact O-OG1 3.15Å
110A46Very low44.5Very low59 Ų5997.9 Ų97.949%0.48856%0.558SS.*THydrogen-bonded Turntrans-52.3-29-174.900000113.5T112 L113A110-T112 PolarHBondContact O-N 3.05Å; A110-L113 PolarHBondContact O-N 3.22Å
111D43.6Very low45.6Very low120 Ų120100.5 Ų100.564%0.64256%0.561SS**THydrogen-bonded Turntrans-60.8-14.9178.6-45.6-69.7000114.1P109 L113 A114P109-D111 PolarHBondContact O-N 3.31Å; D111-L113 PolarHBondContact O-N 3.03Å; D111-A114 WeakPolarHBondContact O-CB 3.35Å; D111-A114 PolarHBondContact O-N 3.44Å
112T51.5Low47.1Very low30 Ų3092 Ų9218%0.18453%0.528CS..Hα-helixtrans-62.7-26.9176.8-48.10000112.3L108 P109 A110 A114 I115L108-T112 HydrophobicContact CB-CG2 4.33Å; L108-T112 WeakPolarHBondContact CB-OG1 3.27Å; L108-T112 HydrophobicContact CD1-CG2 4.35Å; L108-T112 HydrophobicContact CD2-CG2 3.97Å; L108-T112 HydrophobicContact CG-CG2 4.44Å; P109-T112 WeakPolarHBondContact O-CB 3.22Å; P109-T112 PolarHBondContact O-N 2.8Å; P109-T112 PolarHBondContact O-OG1 3.15Å; A110-T112 PolarHBondContact O-N 3.05Å; T112-A114 PolarHBondContact O-N 3.33Å; T112-I115 HydrophobicContact CG2-CD1 4.25Å; T112-I115 WeakPolarHBondContact O-CB 3.48Å; T112-I115 PolarHBondContact O-N 2.92Å; T112-I115 VanDerWaalsContact O-N 3.14Å
113L52Low48.7Very low37 Ų3793.3 Ų93.319%0.19452%0.52CS..Hα-helixtrans-61.2-29.5171.9-77.9141.9000112.1V67 A110 D111 I115 Y116 S117 I118V67-L113 HydrophobicContact CG1-CD1 3.79Å; V67-L113 HydrophobicContact CG1-CD2 4.5Å; V67-L113 HydrophobicContact CG2-CD2 4.46Å; A110-L113 PolarHBondContact O-N 3.22Å; D111-L113 PolarHBondContact O-N 3.03Å; L113-I115 VanDerWaalsContact C-N 3.27Å; L113-I115 PolarHBondContact O-N 3.29Å; L113-Y116 CarbonylContact O-C 3.4Å; L113-Y116 PolarHBondContact O-N 3.4Å; L113-Y116 VanDerWaalsContact O-N 3.15Å; L113-S117 PolarHBondContact O-N 3.44Å; L113-I118 CarbonylContact C-O 3.57Å; L113-I118 HydrophobicContact CB-CB 4.24Å; L113-I118 HydrophobicContact CD2-CB 4.08Å; L113-I118 HydrophobicContact CD2-CD1 4.28Å; L113-I118 HydrophobicContact CD2-CG2 3.85Å; L113-I118 PolarHBondContact O-N 3.25Å
114A49.1Very low50.6Low66 Ų6686.2 Ų86.255%0.54548%0.482SS..Hα-helixtrans-67.6-24.9176.600000113.1D111 T112 Y116 S117D111-A114 WeakPolarHBondContact O-CB 3.35Å; D111-A114 PolarHBondContact O-N 3.44Å; T112-A114 PolarHBondContact O-N 3.33Å; A114-Y116 PolarHBondContact O-N 3.02Å; A114-S117 WeakPolarHBondContact O-CA 3.44Å; A114-S117 PolarHBondContact O-N 2.9Å
115I51.3Low52.3Low133 Ų13385.4 Ų85.468%0.68247%0.469SS*.Hα-helixtrans-65.3-31.6174.6-56.1-180000110.7T112 L113 S117T112-I115 HydrophobicContact CG2-CD1 4.25Å; T112-I115 WeakPolarHBondContact O-CB 3.48Å; T112-I115 PolarHBondContact O-N 2.92Å; T112-I115 VanDerWaalsContact O-N 3.14Å; L113-I115 VanDerWaalsContact C-N 3.27Å; L113-I115 PolarHBondContact O-N 3.29Å; I115-S117 VanDerWaalsContact C-N 3.3Å
116Y55.4Low53.7Low95 Ų9581.5 Ų81.537%0.37344%0.443SS..THydrogen-bonded Turntrans-89.57.8171.3-70.6-92.4000113.1L113 A114 I118 L132 T135L113-Y116 CarbonylContact O-C 3.4Å; L113-Y116 PolarHBondContact O-N 3.4Å; L113-Y116 VanDerWaalsContact O-N 3.15Å; A114-Y116 PolarHBondContact O-N 3.02Å; Y116-I118 VanDerWaalsContact C-N 3.29Å; Y116-I118 PolarHBondContact O-N 3.46Å; Y116-L132 HydrophobicContact CD2-CD1 4.33Å; Y116-L132 HydrophobicContact CE2-CD1 4.3Å; Y116-T135 PolarHBondContact OH-OG1 3.3Å; Y116-T135 VanDerWaalsContact OH-OG1 3.11Å
117S50.8Low55.2Low111 Ų11177.6 Ų77.678%0.77644%0.436SS*.THydrogen-bonded Turntrans60.330.4-174.7-54.60000114.8L113 A114 I115L113-S117 PolarHBondContact O-N 3.44Å; A114-S117 WeakPolarHBondContact O-CA 3.44Å; A114-S117 PolarHBondContact O-N 2.9Å; I115-S117 VanDerWaalsContact C-N 3.3Å
118I58.4Low56.3Low31 Ų3176.1 Ų76.116%0.15943%0.432CS..  trans-100118.9179.4-55.3177.1000109.1V67 L113 Y116 L124V67-I118 HydrophobicContact CG2-CG2 3.73Å; L113-I118 CarbonylContact C-O 3.57Å; L113-I118 HydrophobicContact CB-CB 4.24Å; L113-I118 HydrophobicContact CD2-CB 4.08Å; L113-I118 HydrophobicContact CD2-CD1 4.28Å; L113-I118 HydrophobicContact CD2-CG2 3.85Å; L113-I118 PolarHBondContact O-N 3.25Å; Y116-I118 VanDerWaalsContact C-N 3.29Å; Y116-I118 PolarHBondContact O-N 3.46Å; I118-L124 HydrophobicContact CD1-CD1 4.38Å; I118-L124 HydrophobicContact CD1-CD2 3.92Å; I118-L124 HydrophobicContact CD1-CG 4.14Å; I118-L124 HydrophobicContact CG2-CD1 3.95Å
119S54Low57.3Low54 Ų5472.2 Ų72.238%0.37841%0.411SS..  trans-92.8167173.476.90000112.1V67 Q121 S122V67-S119 WeakPolarHBondContact CG2-O 3.37Å; S119-Q121 PolarHBondContact O-N 3.16Å; S119-Q121 PolarHBondContact OG-N 3.39Å; S119-Q121 PolarHBondContact OG-OE1 2.84Å; S119-S122 PolarHBondContact N-OG 2.86Å; S119-S122 WeakPolarHBondContact O-CB 3.24Å; S119-S122 PolarHBondContact O-N 2.62Å; S119-S122 PolarHBondContact O-OG 2.73Å; S119-S122 PolarHBondContact OG-OG 3.08Å
120E53.7Low58.5Low116 Ų11675 Ų7554%0.54242%0.418SS..THydrogen-bonded Turntrans-64.4-18.5176-70.4-147.9131.300114.4R71 S122R71-E120 IonicContact CZ-OE1 3.51Å; R71-E120 IonicContact NH1-OE1 3.91Å; R71-E120 PolarHBondContact NH1-OE1 3.45Å; R71-E120 IonicContact NH2-OE1 3.17Å; R71-E120 PolarHBondContact NH2-OE1 2.92Å; E120-S122 VanDerWaalsContact C-N 3.33Å
121Q53.4Low59.6Low166 Ų16679.5 Ų79.578%0.77643%0.426SS*.THydrogen-bonded Turntrans-85.9-2.4170.9-52.184.98.800113.5S119S119-Q121 PolarHBondContact O-N 3.16Å; S119-Q121 PolarHBondContact OG-N 3.39Å; S119-Q121 PolarHBondContact OG-OE1 2.84Å
122S60Low60.9Low34 Ų3474.7 Ų74.724%0.23840%0.4CS..PPolyproline II helixtrans-79.5139.9-174.5-60.60000112S119 E120S119-S122 PolarHBondContact N-OG 2.86Å; S119-S122 WeakPolarHBondContact O-CB 3.24Å; S119-S122 PolarHBondContact O-N 2.62Å; S119-S122 PolarHBondContact O-OG 2.73Å; S119-S122 PolarHBondContact OG-OG 3.08Å; E120-S122 VanDerWaalsContact C-N 3.33Å
123R63Low61.9Low139 Ų13975.9 Ų75.953%0.52541%0.409SS..EExtended strand (participates in β ladder)trans-100133.5168.4-77.7176.1170.2-109-7.8108.8D61 T64 T66D61-R123 IonicContact OD2-CZ 3.73Å; D61-R123 IonicContact OD2-NH1 3.86Å; D61-R123 PolarHBondContact OD2-NH1 3Å; D61-R123 IonicContact OD2-NH2 3.29Å; D61-R123 PolarHBondContact OD2-NH2 3.43Å; T64-R123 PolarHBondContact OG1-NH1 3.28Å; T66-R123 HydrophobicContact CG2-CG 4.1Å
124L69.1Low62.8Low8 Ų878.1 Ų78.14%0.04243%0.426CS..EExtended strand (participates in β ladder)trans-98.2117.9174.1-71.481.6000109.5T64 I65 V67 L70 I118 L132T64-L124 CarbonylContact C-O 3.56Å; T64-L124 WeakPolarHBondContact CA-O 3.34Å; I65-L124 HydrophobicContact CG2-CB 3.96Å; I65-L124 PolarHBondContact N-O 2.97Å; I65-L124 PolarHBondContact O-N 2.9Å; V67-L124 HydrophobicContact CG2-CD1 4.16Å; L70-L124 HydrophobicContact CD2-CD1 4.32Å; L70-L124 HydrophobicContact CD2-CD2 3.93Å; I118-L124 HydrophobicContact CD1-CD1 4.38Å; I118-L124 HydrophobicContact CD1-CD2 3.92Å; I118-L124 HydrophobicContact CD1-CG 4.14Å; I118-L124 HydrophobicContact CG2-CD1 3.95Å; L124-L132 HydrophobicContact CD2-CD2 4.16Å
125D70.1Confident63.6Low92 Ų9276.4 Ų76.449%0.49241%0.409SS..EExtended strand (participates in β ladder)trans-76.2164.1166.7-54.6-22.9000110.3T64 G128 L129T64-D125 WeakPolarHBondContact CG2-OD1 3.39Å; D125-G128 WeakPolarHBondContact O-CA 3.38Å; D125-G128 PolarHBondContact O-N 3.08Å; D125-L129 PolarHBondContact O-N 2.92Å; D125-L129 VanDerWaalsContact O-N 3.11Å
126G66Low64.3Low8 Ų870.9 Ų70.98%0.08238%0.38CS..Hα-helixtrans-45-46.8179.100000116.1G128 L129 Q130G126-G128 VanDerWaalsContact C-N 3.29Å; G126-G128 PolarHBondContact O-N 3.08Å; G126-L129 PolarHBondContact O-N 2.64Å; G126-Q130 PolarHBondContact O-N 3.33Å
127P69.8Low64.9Low97 Ų9771.3 Ų71.363%0.6339%0.388SS*.Hα-helixtrans-63.4-30.3176.3-24.135.2000114.2K131P127-K131 PolarHBondContact O-N 2.99Å
128G68.3Low65.5Low32 Ų3272.8 Ų72.833%0.3338%0.383SS..Hα-helixtrans-69.7-43.3173.900000111.6D125 G126 K131 L132D125-G128 WeakPolarHBondContact O-CA 3.38Å; D125-G128 PolarHBondContact O-N 3.08Å; G126-G128 VanDerWaalsContact C-N 3.29Å; G126-G128 PolarHBondContact O-N 3.08Å; G128-K131 PolarHBondContact O-N 3.09Å; G128-L132 PolarHBondContact O-N 3.2Å
129L70.4Confident65.7Low10 Ų1074.3 Ų74.35%0.05239%0.39CS..Hα-helixtrans-66.3-39.3175.9-171.759.9000112L52 L55 L56 I65 L70 D125 G126 K131 L132 C133 M136L52-L129 HydrophobicContact CD1-CB 4.44Å; L52-L129 HydrophobicContact CD1-CD2 4.02Å; L52-L129 HydrophobicContact CD1-CG 4.44Å; L55-L129 HydrophobicContact CD2-CD2 3.64Å; L56-L129 HydrophobicContact CD2-CD2 4.32Å; I65-L129 HydrophobicContact CG2-CD2 4.46Å; L70-L129 HydrophobicContact CD1-CD1 3.78Å; D125-L129 PolarHBondContact O-N 2.92Å; D125-L129 VanDerWaalsContact O-N 3.11Å; G126-L129 PolarHBondContact O-N 2.64Å; L129-K131 VanDerWaalsContact C-N 3.26Å; L129-K131 PolarHBondContact O-N 3.04Å; L129-L132 PolarHBondContact O-N 3.18Å; L129-L132 VanDerWaalsContact O-N 3.11Å; L129-C133 PolarHBondContact O-N 3.45Å; L129-M136 HydrophobicContact CD1-CE 4.41Å; L129-M136 HydrophobicContact CD1-SD 3.99Å
130Q72.4Confident66Low137 Ų13773.2 Ų73.264%0.6438%0.379SS*.Hα-helixtrans-59.4-37173.6-169.6-179.119.800112.2G126 L132G126-Q130 PolarHBondContact O-N 3.33Å; Q130-L132 VanDerWaalsContact C-N 3.34Å
131K70Confident66.1Low154 Ų15474.3 Ų74.367%0.6739%0.389SS*.Hα-helixtrans-72.9-24.2177.1-166.9176.3-178.4-176.80113.4P127 G128 L129P127-K131 PolarHBondContact O-N 2.99Å; G128-K131 PolarHBondContact O-N 3.09Å; L129-K131 VanDerWaalsContact C-N 3.26Å; L129-K131 PolarHBondContact O-N 3.04Å
132L71.1Confident66.3Low18 Ų1869 Ų699%0.09437%0.374CS..Hα-helixtrans-89.1-26.7177.9-167.467.7000112.8L70 Y116 L124 G128 L129 Q130 P134 T135 M136L70-L132 HydrophobicContact CD2-CD2 3.79Å; Y116-L132 HydrophobicContact CD2-CD1 4.33Å; Y116-L132 HydrophobicContact CE2-CD1 4.3Å; L124-L132 HydrophobicContact CD2-CD2 4.16Å; G128-L132 PolarHBondContact O-N 3.2Å; L129-L132 PolarHBondContact O-N 3.18Å; L129-L132 VanDerWaalsContact O-N 3.11Å; Q130-L132 VanDerWaalsContact C-N 3.34Å; L132-P134 VanDerWaalsContact C-CD 3.48Å; L132-T135 WeakPolarHBondContact O-CB 3.41Å; L132-T135 PolarHBondContact O-N 3.06Å; L132-M136 HydrophobicContact CB-SD 4.3Å; L132-M136 HydrophobicContact CD2-CG 4.36Å; L132-M136 HydrophobicContact CD2-SD 3.96Å; L132-M136 HydrophobicContact CG-CG 4.02Å; L132-M136 HydrophobicContact CG-SD 3.96Å; L132-M136 PolarHBondContact O-N 3.25Å; L132-M136 VanDerWaalsContact O-N 3.12Å
133C72Confident65.9Low55 Ų5569.8 Ų69.837%0.37239%0.387SS..Hα-helixtrans-48.2-44.9-176.5-1780000115L129 T135 M136 L137L129-C133 PolarHBondContact O-N 3.45Å; C133-T135 VanDerWaalsContact C-N 3.29Å; C133-T135 PolarHBondContact O-N 2.97Å; C133-M136 PolarHBondContact O-N 2.57Å; C133-L137 WeakPolarHBondContact O-CG 3.49Å; C133-L137 PolarHBondContact O-N 3.15Å
134P70.6Confident65.2Low84 Ų8466 Ų6655%0.54538%0.379SS..Hα-helixtrans-60.5-36.1177.3-23.835.1000113.5L132 Q138L132-P134 VanDerWaalsContact C-CD 3.48Å; P134-Q138 WeakPolarHBondContact O-CB 3.28Å; P134-Q138 PolarHBondContact O-N 3.01Å
135T65.2Low64.3Low31 Ų3168.2 Ų68.219%0.1940%0.395CS..Hα-helixtrans-71.5-38.5177.3-50.40000111.4Y116 L132 C133 Q138 Q139Y116-T135 PolarHBondContact OH-OG1 3.3Å; Y116-T135 VanDerWaalsContact OH-OG1 3.11Å; L132-T135 WeakPolarHBondContact O-CB 3.41Å; L132-T135 PolarHBondContact O-N 3.06Å; C133-T135 VanDerWaalsContact C-N 3.29Å; C133-T135 PolarHBondContact O-N 2.97Å; T135-Q138 PolarHBondContact O-N 3.11Å; T135-Q139 WeakPolarHBondContact O-CG 3.45Å; T135-Q139 PolarHBondContact O-N 2.84Å; T135-Q139 VanDerWaalsContact O-N 3.08Å
136M67.4Low63.2Low17 Ų1772.3 Ų72.38%0.08441%0.408CS..Hα-helixtrans-64.6-45.3175.9-61.616765.300111.2L70 L74 L129 L132 C133 Q138 Q139 L140L70-M136 HydrophobicContact CD1-CE 3.91Å; L70-M136 HydrophobicContact CD1-SD 4.46Å; L74-M136 HydrophobicContact CD2-CB 4.15Å; L74-M136 HydrophobicContact CD2-CE 3.67Å; L74-M136 HydrophobicContact CD2-CG 4.05Å; L74-M136 HydrophobicContact CG-CE 3.99Å; L129-M136 HydrophobicContact CD1-CE 4.41Å; L129-M136 HydrophobicContact CD1-SD 3.99Å; L132-M136 HydrophobicContact CB-SD 4.3Å; L132-M136 HydrophobicContact CD2-CG 4.36Å; L132-M136 HydrophobicContact CD2-SD 3.96Å; L132-M136 HydrophobicContact CG-CG 4.02Å; L132-M136 HydrophobicContact CG-SD 3.96Å; L132-M136 PolarHBondContact O-N 3.25Å; L132-M136 VanDerWaalsContact O-N 3.12Å; C133-M136 PolarHBondContact O-N 2.57Å; M136-Q138 PolarHBondContact O-N 2.91Å; M136-Q139 PolarHBondContact O-N 2.88Å; M136-L140 WeakPolarHBondContact O-CG 3.17Å; M136-L140 PolarHBondContact O-N 3.28Å; M136-L140 VanDerWaalsContact O-N 3.12Å
137L66.6Low62Low103 Ų10377.7 Ų77.754%0.53944%0.44SS..Hα-helixtrans-61.4-43.7176.1-71.2169.1000111.8C133 Q139 L140 D141C133-L137 WeakPolarHBondContact O-CG 3.49Å; C133-L137 PolarHBondContact O-N 3.15Å; L137-Q139 VanDerWaalsContact C-N 3.28Å; L137-Q139 PolarHBondContact O-N 3.49Å; L137-L140 PolarHBondContact O-N 3.28Å; L137-D141 WeakPolarHBondContact O-CB 3.19Å; L137-D141 PolarHBondContact O-N 2.9Å
138Q63.8Low60.4Low142 Ų14282.9 Ų82.966%0.66445%0.452SS*.Hα-helixtrans-63.4-30.9176.7-171.3-179.94.300113.1P134 T135 M136 A142P134-Q138 WeakPolarHBondContact O-CB 3.28Å; P134-Q138 PolarHBondContact O-N 3.01Å; T135-Q138 PolarHBondContact O-N 3.11Å; M136-Q138 PolarHBondContact O-N 2.91Å; Q138-A142 VanDerWaalsContact O-CB 3.3Å; Q138-A142 WeakPolarHBondContact O-CB 3.43Å; Q138-A142 PolarHBondContact O-N 3.38Å
139Q62.7Low58.7Low64 Ų6488.6 Ų88.630%0.29947%0.468SS..Hα-helixtrans-74.9-33.4175.7-75.7177.9-42.600113.2T135 M136 L137T135-Q139 WeakPolarHBondContact O-CG 3.45Å; T135-Q139 PolarHBondContact O-N 2.84Å; T135-Q139 VanDerWaalsContact O-N 3.08Å; M136-Q139 PolarHBondContact O-N 2.88Å; L137-Q139 VanDerWaalsContact C-N 3.28Å; L137-Q139 PolarHBondContact O-N 3.49Å
140L61Low56.9Low31 Ų3190.9 Ų90.916%0.16249%0.494CS..Hα-helixtrans-70.4-53.8176.3-71.3165.5000110.4L77 Q81 M136 L137 A142 G143L77-L140 HydrophobicContact CB-CD1 4.24Å; L77-L140 HydrophobicContact CB-CD2 4.13Å; Q81-L140 PolarHBondContact OE1-O 3.06Å; M136-L140 WeakPolarHBondContact O-CG 3.17Å; M136-L140 PolarHBondContact O-N 3.28Å; M136-L140 VanDerWaalsContact O-N 3.12Å; L137-L140 PolarHBondContact O-N 3.28Å; L140-A142 VanDerWaalsContact C-N 3.28Å; L140-A142 PolarHBondContact O-N 3.26Å; L140-G143 WeakPolarHBondContact O-CA 3.45Å; L140-G143 PolarHBondContact O-N 3.12Å
141D54.9Low55.1Low138 Ų13893 Ų9374%0.73850%0.504SS*.Hα-helixtrans-54.8-39.4178.2-175.665.4000113.2L137 G143L137-D141 WeakPolarHBondContact O-CB 3.19Å; L137-D141 PolarHBondContact O-N 2.9Å; D141-G143 PolarHBondContact O-N 3.34Å
142A58.1Low53.8Low56 Ų5694.9 Ų94.946%0.46352%0.515SS..THydrogen-bonded Turntrans-74.1-2.6177.300000114.6Q138 L140 T144Q138-A142 VanDerWaalsContact O-CB 3.3Å; Q138-A142 WeakPolarHBondContact O-CB 3.43Å; Q138-A142 PolarHBondContact O-N 3.38Å; L140-A142 VanDerWaalsContact C-N 3.28Å; L140-A142 PolarHBondContact O-N 3.26Å; A142-T144 VanDerWaalsContact C-OG1 3.32Å; A142-T144 VanDerWaalsContact CB-OG1 3.28Å; A142-T144 WeakPolarHBondContact CB-OG1 3.28Å; A142-T144 PolarHBondContact O-N 3.19Å; A142-T144 PolarHBondContact O-OG1 3.47Å
143G51.3Low52.1Low49 Ų49101.2 Ų101.251%0.50555%0.548SS..THydrogen-bonded Turntrans58.211.417500000116L140 D141 C145L140-G143 WeakPolarHBondContact O-CA 3.45Å; L140-G143 PolarHBondContact O-N 3.12Å; D141-G143 PolarHBondContact O-N 3.34Å; G143-C145 PolarHBondContact O-N 2.89Å
144T47.7Very low50.4Low61 Ų61103.3 Ų103.337%0.37455%0.554SS.*  trans-84.5-13.7-153-28.30000114.1S105 C107 A142S105-T144 VanDerWaalsContact O-CG2 3.23Å; S105-T144 WeakPolarHBondContact O-CG2 3.39Å; C107-T144 PolarHBondContact SG-O 3.21Å; A142-T144 VanDerWaalsContact C-OG1 3.32Å; A142-T144 VanDerWaalsContact CB-OG1 3.28Å; A142-T144 WeakPolarHBondContact CB-OG1 3.28Å; A142-T144 PolarHBondContact O-N 3.19Å; A142-T144 PolarHBondContact O-OG1 3.47Å
145C51.3Low48.7Very low54 Ų54106.3 Ų106.337%0.36557%0.571SS.*  trans-115.361-177.2-65.40000113.8C107 G143 T147C107-C145 WeakPolarHBondContact CA-SG 3.24Å; C107-C145 HydrophobicContact CB-CB 4.47Å; C107-C145 WeakPolarHBondContact CB-SG 3.35Å; C107-C145 WeakPolarHBondContact SG-CA 3.23Å; C107-C145 WeakPolarHBondContact SG-CB 3.28Å; C107-C145 CovalentContact SG-SG 2.05Å; C107-C145 PolarHBondContact SG-SG 3.26Å; G143-C145 PolarHBondContact O-N 2.89Å; C145-T147 PolarHBondContact O-N 3.21Å
146K46.9Very low47Very low177 Ų177110.2 Ų110.277%0.7759%0.591SS**  trans-67.1113156.4-64.9-168.2176.1-168.10109.1K148K146-K148 PolarHBondContact O-N 2.91Å; K146-K148 VanDerWaalsContact O-N 3.13Å
147T39.6Very low46Very low122 Ų122114.8 Ų114.875%0.74862%0.622SS**  trans-64.8108.9177.56.70000110.4C145 K149C145-T147 PolarHBondContact O-N 3.21Å; T147-K149 VanDerWaalsContact C-N 3.31Å; T147-K149 PolarHBondContact O-N 3.34Å
148K36.3Very low45.4Very low206 Ų206113.7 Ų113.790%0.89663%0.628SS**  trans-67.492.8160.7-76.5-165.5172.4-165.60108.8K146 G150K146-K148 PolarHBondContact O-N 2.91Å; K146-K148 VanDerWaalsContact O-N 3.13Å; K148-G150 PolarHBondContact O-N 3.47Å
149K32.9Very low45.2Very low152 Ų152112 Ų11266%0.66163%0.629SS**  trans-62.8118.8156.7-88-172.7168.1-170.50107.6T147T147-K149 VanDerWaalsContact C-N 3.31Å; T147-K149 PolarHBondContact O-N 3.34Å
150G32.7Very low45.5Very low57 Ų57116.2 Ų116.259%0.58864%0.643SS**  trans-82.8143.5154.500000108.7K148K148-G150 PolarHBondContact O-N 3.47Å
151E36Very low46.5Very low182 Ų182115.4 Ų115.485%0.8564%0.639SS**SBendtrans56.3121.3169-71.8135.6113.100118.8
152E41.4Very low48.1Very low194 Ų194111.9 Ų111.991%0.90763%0.625SS**SBendtrans47.875.3147.1-56.3-168.8150.500118.4
153L35.1Very low49.5Very low150 Ų150113.7 Ų113.779%0.78563%0.627SS**  -176.388.6114.4-173.165.3000108.7
154I35.9Very low51.3Low99 Ų99115 Ų11551%0.50863%0.633SS.*  trans-127.9142.2167.7-58.9179.2000105.4D156I154-D156 WeakPolarHBondContact CB-OD1 3.42Å; I154-D156 WeakPolarHBondContact CG2-OD1 3.49Å; I154-D156 PolarHBondContact O-N 3.04Å; I154-D156 VanDerWaalsContact O-N 3.13Å
155T36.5Very low53.2Low147 Ų147116.1 Ų116.190%0.90263%0.634SS**  trans-80.186163-56.30000105.8
156D30Very low55.2Low113 Ų113113.7 Ų113.760%0.60462%0.617SS**PPolyproline II helixtrans-62.4135.7-166.5-69.8-55.3000111.9I154I154-D156 WeakPolarHBondContact CB-OD1 3.42Å; I154-D156 WeakPolarHBondContact CG2-OD1 3.49Å; I154-D156 PolarHBondContact O-N 3.04Å; I154-D156 VanDerWaalsContact O-N 3.13Å
157P46.3Very low57.5Low113 Ų113109.9 Ų109.973%0.73460%0.598SS**SBendtrans-59.1138.515429.8-32.6000107.3
158A53.7Low60.1Low81 Ų81105.9 Ų105.967%0.66958%0.582SS**PPolyproline II helixtrans-47132.4-161.100000113.2R160A158-R160 PolarHBondContact O-N 3.4Å
159P58.8Low62.9Low106 Ų106100.5 Ų100.569%0.68856%0.556SS**PPolyproline II helixtrans-57.8136.9-17524-34000110.7
160R69.6Low65.9Low153 Ų15393.2 Ų93.258%0.57753%0.525SS*.PPolyproline II helixtrans-58.3124.4177.3-175.6179.6-179.3132.8-0.8108.4A158 T378 G438 N439A158-R160 PolarHBondContact O-N 3.4Å; R160-T378 PolarHBondContact NE-O 2.98Å; R160-G438 PolarHBondContact NH2-O 2.84Å; R160-N439 PolarHBondContact NH2-OD1 2.86Å
161P82.1Confident68.9Low14 Ų1494 Ų949%0.09152%0.515CS..PPolyproline II helixtrans-61.4152.4-174.321.1-32000112.7E165 V166 F377 V381P161-E165 HydrophobicContact CB-CB 4.24Å; P161-V166 HydrophobicContact CB-CG2 3.97Å; P161-V166 HydrophobicContact CG-CG2 3.69Å; P161-F377 VanDerWaalsContact CG-O 3.23Å; P161-F377 WeakPolarHBondContact CG-O 3.3Å; P161-V381 HydrophobicContact CB-CG2 3.69Å; P161-V381 HydrophobicContact CG-CG2 4Å
162S87.5Confident71.8Confident63 Ų6389.9 Ų89.944%0.44150%0.498SS..PPolyproline II helixtrans-60.6145.5172-178.60000110.6A164 E165 V166S162-A164 PolarHBondContact O-N 2.77Å; S162-A164 VanDerWaalsContact O-N 3.08Å; S162-E165 WeakPolarHBondContact CB-OE2 3.38Å; S162-E165 PolarHBondContact N-OE2 3.39Å; S162-E165 WeakPolarHBondContact O-CA 3.41Å; S162-E165 WeakPolarHBondContact O-CB 3.44Å; S162-E165 PolarHBondContact O-N 3.31Å; S162-V166 WeakPolarHBondContact O-CG2 3.15Å; S162-V166 PolarHBondContact O-N 2.93Å
163D87.3Confident74.3Confident94 Ų9481.6 Ų81.650%0.50346%0.461SS..Hα-helixtrans-53-35.1174.5-70.6-51.7000111.6E165 V166 W167 N439D163-E165 VanDerWaalsContact C-N 3.31Å; D163-E165 PolarHBondContact O-N 2.94Å; D163-V166 PolarHBondContact O-N 3.41Å; D163-W167 VanDerWaalsContact O-CD1 3.22Å; D163-W167 PolarHBondContact O-N 2.72Å; D163-N439 PolarHBondContact OD1-ND2 3.23Å
164A89Confident77.2Confident76 Ų7674.4 Ų74.463%0.62842%0.424SS*.Hα-helixtrans-66.1-31176.600000113.4S162 G168S162-A164 PolarHBondContact O-N 2.77Å; S162-A164 VanDerWaalsContact O-N 3.08Å; A164-G168 WeakPolarHBondContact O-CA 3.18Å; A164-G168 PolarHBondContact O-N 3.1Å
165E89Confident80Confident86 Ų8672.2 Ų72.240%0.40242%0.415SS..Hα-helixtrans-80-41.9176.5-67.3161.4160.700110.4P161 S162 D163 G168 Y169P161-E165 HydrophobicContact CB-CB 4.24Å; S162-E165 WeakPolarHBondContact CB-OE2 3.38Å; S162-E165 PolarHBondContact N-OE2 3.39Å; S162-E165 WeakPolarHBondContact O-CA 3.41Å; S162-E165 WeakPolarHBondContact O-CB 3.44Å; S162-E165 PolarHBondContact O-N 3.31Å; D163-E165 VanDerWaalsContact C-N 3.31Å; D163-E165 PolarHBondContact O-N 2.94Å; E165-G168 PolarHBondContact O-N 3.13Å; E165-Y169 HydrophobicContact CB-CD2 4.03Å; E165-Y169 HydrophobicContact CB-CE2 3.97Å; E165-Y169 HydrophobicContact CG-CE2 4.36Å; E165-Y169 WeakPolarHBondContact O-CB 3.48Å; E165-Y169 WeakPolarHBondContact O-CD2 3.35Å; E165-Y169 PolarHBondContact O-N 3.15Å
166V92.7Very high82.6Confident2 Ų269.5 Ų69.51%0.01240%0.395CS..Hα-helixtrans-56.7-51.6173.9174.80000111P161 S162 D163 G170 F377 T378 I435P161-V166 HydrophobicContact CB-CG2 3.97Å; P161-V166 HydrophobicContact CG-CG2 3.69Å; S162-V166 WeakPolarHBondContact O-CG2 3.15Å; S162-V166 PolarHBondContact O-N 2.93Å; D163-V166 PolarHBondContact O-N 3.41Å; V166-G170 PolarHBondContact O-N 2.66Å; V166-F377 HydrophobicContact CG1-CB 4.02Å; V166-T378 HydrophobicContact CG1-CG2 3.81Å; V166-I435 HydrophobicContact CG1-CB 4.35Å; V166-I435 HydrophobicContact CG1-CD1 3.96Å; V166-I435 HydrophobicContact CG1-CG1 3.74Å; V166-I435 HydrophobicContact CG1-CG2 3.76Å
167W94.7Very high85.5Confident97 Ų9764.3 Ų64.337%0.36737%0.367SS..Hα-helixtrans-68.5-38.1175.9-79.196.7000112.3D163 L171 M431 I435D163-W167 VanDerWaalsContact O-CD1 3.22Å; D163-W167 PolarHBondContact O-N 2.72Å; W167-L171 VanDerWaalsContact O-CB 3.25Å; W167-L171 WeakPolarHBondContact O-CB 3.28Å; W167-L171 WeakPolarHBondContact O-CD1 3.25Å; W167-L171 WeakPolarHBondContact O-CG 3.2Å; W167-L171 PolarHBondContact O-N 3.36Å; W167-M431 HydrophobicContact CE3-CE 3.75Å; W167-M431 HydrophobicContact CZ3-CE 3.52Å; W167-I435 HydrophobicContact CD2-CD1 3.76Å; W167-I435 HydrophobicContact CE3-CD1 3.92Å; W167-I435 HydrophobicContact CG-CD1 4.13Å; W167-I435 HydrophobicContact CZ2-CB 4.33Å; W167-I435 HydrophobicContact CZ2-CD1 4.4Å; W167-I435 HydrophobicContact CZ2-CG2 4.14Å; W167-I435 HydrophobicContact CZ3-CD1 4.32Å
168G95Very high87.5Confident39 Ų3959.1 Ų59.140%0.40233%0.333SS..Hα-helixtrans-66.2-52-178.900000113.4A164 E165 L172A164-G168 WeakPolarHBondContact O-CA 3.18Å; A164-G168 PolarHBondContact O-N 3.1Å; E165-G168 PolarHBondContact O-N 3.13Å; G168-L172 WeakPolarHBondContact O-CB 3.4Å; G168-L172 PolarHBondContact O-N 3.35Å
169Y94.4Very high89Confident92 Ų9259.6 Ų59.636%0.36132%0.324SS..Hα-helixtrans-70.5-39.1177-66.1-58.4000111.9E165 L172 C173 F377 V381E165-Y169 HydrophobicContact CB-CD2 4.03Å; E165-Y169 HydrophobicContact CB-CE2 3.97Å; E165-Y169 HydrophobicContact CG-CE2 4.36Å; E165-Y169 WeakPolarHBondContact O-CB 3.48Å; E165-Y169 WeakPolarHBondContact O-CD2 3.35Å; E165-Y169 PolarHBondContact O-N 3.15Å; Y169-L172 PolarHBondContact O-N 2.62Å; Y169-C173 WeakPolarHBondContact O-CB 3.41Å; Y169-C173 PolarHBondContact O-N 3.48Å; Y169-C173 PolarHBondContact O-SG 3.49Å; Y169-F377 HydrophobicContact CD2-CE1 4.48Å; Y169-F377 HydrophobicContact CG-CE1 4.16Å; Y169-V381 HydrophobicContact CD2-CG1 4.02Å; Y169-V381 HydrophobicContact CE2-CG1 3.98Å; Y169-V381 HydrophobicContact CE2-CG2 4.44Å
170G95.6Very high90Very high0 Ų056 Ų560%030%0.301CS..Hα-helixtrans-56.8-53.217400000112.1V166 L172 C173 V174V166-G170 PolarHBondContact O-N 2.66Å; G170-L172 VanDerWaalsContact C-N 3.33Å; G170-L172 PolarHBondContact O-N 2.94Å; G170-C173 PolarHBondContact O-N 2.87Å; G170-V174 WeakPolarHBondContact O-CG2 3.2Å; G170-V174 PolarHBondContact O-N 3.37Å
171L96.4Very high90.1Very high72 Ų7248.9 Ų48.938%0.37728%0.275SS..Hα-helixtrans-62.1-38.6177.4-74.1170.2000112.2W167 T175 Y428 M431W167-L171 VanDerWaalsContact O-CB 3.25Å; W167-L171 WeakPolarHBondContact O-CB 3.28Å; W167-L171 WeakPolarHBondContact O-CD1 3.25Å; W167-L171 WeakPolarHBondContact O-CG 3.2Å; W167-L171 PolarHBondContact O-N 3.36Å; L171-T175 VanDerWaalsContact O-CB 3.24Å; L171-T175 WeakPolarHBondContact O-CB 3.45Å; L171-T175 PolarHBondContact O-N 3.48Å; L171-T175 PolarHBondContact O-OG1 3.26Å; L171-Y428 HydrophobicContact CD2-CD1 3.96Å; L171-Y428 HydrophobicContact CD2-CE1 4.29Å; L171-M431 HydrophobicContact CD2-CE 3.75Å; L171-M431 HydrophobicContact CD2-SD 4.02Å; L171-M431 HydrophobicContact CG-CE 4.1Å; L171-M431 HydrophobicContact CG-SD 4.1Å; L171-M431 PolarHBondContact N-SD 2.89Å
172L95.9Very high89.8Confident96 Ų9651.6 Ų51.650%0.50329%0.288SS..Hα-helixtrans-63.3-47.3176.517861.9000111.8G168 Y169 G170 T175 L176G168-L172 WeakPolarHBondContact O-CB 3.4Å; G168-L172 PolarHBondContact O-N 3.35Å; Y169-L172 PolarHBondContact O-N 2.62Å; G170-L172 VanDerWaalsContact C-N 3.33Å; G170-L172 PolarHBondContact O-N 2.94Å; L172-T175 PolarHBondContact O-N 2.92Å; L172-L176 HydrophobicContact CD1-CD1 4.3Å; L172-L176 HydrophobicContact CD1-CG 4.47Å; L172-L176 HydrophobicContact CG-CD1 4.26Å; L172-L176 WeakPolarHBondContact O-CG 3.33Å; L172-L176 PolarHBondContact O-N 3.35Å
173C95.6Very high89.1Confident20 Ų2052.1 Ų52.114%0.13529%0.285CS..Hα-helixtrans-63.9-49.6179-75.90000111.8Y169 G170 T175 L176 I177 F377 S388Y169-C173 WeakPolarHBondContact O-CB 3.41Å; Y169-C173 PolarHBondContact O-N 3.48Å; Y169-C173 PolarHBondContact O-SG 3.49Å; G170-C173 PolarHBondContact O-N 2.87Å; C173-T175 VanDerWaalsContact C-N 3.29Å; C173-T175 PolarHBondContact O-N 3.39Å; C173-L176 PolarHBondContact O-N 2.83Å; C173-L176 VanDerWaalsContact O-N 3.13Å; C173-I177 VanDerWaalsContact O-CG1 3.31Å; C173-I177 WeakPolarHBondContact O-CG1 3.5Å; C173-I177 PolarHBondContact O-N 3.14Å; C173-F377 HydrophobicContact CB-CE2 4.22Å; C173-S388 WeakPolarHBondContact CB-OG 3.43Å
174V95.3Very high88.1Confident0 Ų048 Ų480%026%0.264CS..Hα-helixtrans-59.4-40.8175.1176.40000111G170 L176 I177 S178 I373 C427 Y428 M431G170-V174 WeakPolarHBondContact O-CG2 3.2Å; G170-V174 PolarHBondContact O-N 3.37Å; V174-L176 VanDerWaalsContact C-N 3.35Å; V174-L176 PolarHBondContact O-N 3.06Å; V174-I177 PolarHBondContact O-N 3.09Å; V174-S178 PolarHBondContact O-N 3.18Å; V174-S178 PolarHBondContact O-OG 2.88Å; V174-S178 VanDerWaalsContact O-OG 3.09Å; V174-I373 HydrophobicContact CG2-CD1 4.05Å; V174-I373 HydrophobicContact CG2-CG2 4.29Å; V174-C427 HydrophobicContact CG1-CB 4.02Å; V174-Y428 HydrophobicContact CB-CE1 4.44Å; V174-Y428 HydrophobicContact CG1-CD1 3.85Å; V174-Y428 HydrophobicContact CG1-CD2 3.64Å; V174-Y428 HydrophobicContact CG1-CE1 3.86Å; V174-Y428 HydrophobicContact CG1-CE2 3.65Å; V174-Y428 HydrophobicContact CG1-CG 3.75Å; V174-M431 HydrophobicContact CG2-CB 3.95Å; V174-M431 HydrophobicContact CG2-CG 4.03Å; V174-M431 HydrophobicContact CG2-SD 4.1Å
175T93.9Very high87Confident53 Ų5346 Ų4633%0.32525%0.249SC..Hα-helixtrans-61.4-41.1175.6-57.20000112.3L171 L172 C173 L179 Y428L171-T175 VanDerWaalsContact O-CB 3.24Å; L171-T175 WeakPolarHBondContact O-CB 3.45Å; L171-T175 PolarHBondContact O-N 3.48Å; L171-T175 PolarHBondContact O-OG1 3.26Å; L172-T175 PolarHBondContact O-N 2.92Å; C173-T175 VanDerWaalsContact C-N 3.29Å; C173-T175 PolarHBondContact O-N 3.39Å; T175-L179 HydrophobicContact CG2-CD1 3.97Å; T175-L179 HydrophobicContact CG2-CG 4.34Å; T175-L179 VanDerWaalsContact O-CB 3.31Å; T175-L179 WeakPolarHBondContact O-CB 3.46Å; T175-L179 WeakPolarHBondContact O-CG 3.44Å; T175-L179 PolarHBondContact O-N 3.14Å; T175-Y428 WeakPolarHBondContact CA-OH 3.46Å; T175-Y428 PolarHBondContact OG1-OH 3.04Å
176L91.8Very high86.2Confident90 Ų9045.8 Ų45.847%0.47126%0.256SS..Hα-helixtrans-66.2-38.2177.6-71.1168000111.9L172 C173 V174 L179 C180L172-L176 HydrophobicContact CD1-CD1 4.3Å; L172-L176 HydrophobicContact CD1-CG 4.47Å; L172-L176 HydrophobicContact CG-CD1 4.26Å; L172-L176 WeakPolarHBondContact O-CG 3.33Å; L172-L176 PolarHBondContact O-N 3.35Å; C173-L176 PolarHBondContact O-N 2.83Å; C173-L176 VanDerWaalsContact O-N 3.13Å; V174-L176 VanDerWaalsContact C-N 3.35Å; V174-L176 PolarHBondContact O-N 3.06Å; L176-L179 PolarHBondContact O-N 3.3Å; L176-C180 PolarHBondContact O-N 3.44Å
177I91.1Very high85Confident3 Ų346.7 Ų46.72%0.01526%0.262CS..Hα-helixtrans-66.6-53.6176.4-63.2165.1000110.2C173 V174 L179 C180 I373 I391 L392 E395C173-I177 VanDerWaalsContact O-CG1 3.31Å; C173-I177 WeakPolarHBondContact O-CG1 3.5Å; C173-I177 PolarHBondContact O-N 3.14Å; V174-I177 PolarHBondContact O-N 3.09Å; I177-L179 PolarHBondContact O-N 3.19Å; I177-L179 VanDerWaalsContact O-N 3.13Å; I177-C180 WeakPolarHBondContact O-CB 3.42Å; I177-C180 PolarHBondContact O-N 3.14Å; I177-I373 HydrophobicContact CD1-CD1 3.57Å; I177-I391 HydrophobicContact CD1-CB 4.3Å; I177-I391 HydrophobicContact CD1-CG2 3.92Å; I177-I391 HydrophobicContact CG2-CG2 4.35Å; I177-L392 HydrophobicContact CB-CD1 4.46Å; I177-L392 HydrophobicContact CG1-CB 4.12Å; I177-L392 HydrophobicContact CG1-CD1 3.91Å; I177-E395 HydrophobicContact CG2-CB 3.95Å; I177-E395 HydrophobicContact CG2-CG 3.66Å
178S88.4Confident83.7Confident4 Ų444 Ų443%0.02826%0.256CS..Hα-helixtrans-66-14.8177.4-47.60000114.3V174 S181 Y428V174-S178 PolarHBondContact O-N 3.18Å; V174-S178 PolarHBondContact O-OG 2.88Å; V174-S178 VanDerWaalsContact O-OG 3.09Å; S178-S181 PolarHBondContact O-OG 3.35Å; S178-Y428 WeakPolarHBondContact OG-CE2 3.21Å
179L85.8Confident82.6Confident92 Ų9246.8 Ų46.848%0.48227%0.267SS..Hα-helixtrans-80-27.3169.1-78.8172000112.1T175 L176 I177 L182 I183T175-L179 HydrophobicContact CG2-CD1 3.97Å; T175-L179 HydrophobicContact CG2-CG 4.34Å; T175-L179 VanDerWaalsContact O-CB 3.31Å; T175-L179 WeakPolarHBondContact O-CB 3.46Å; T175-L179 WeakPolarHBondContact O-CG 3.44Å; T175-L179 PolarHBondContact O-N 3.14Å; L176-L179 PolarHBondContact O-N 3.3Å; I177-L179 PolarHBondContact O-N 3.19Å; I177-L179 VanDerWaalsContact O-N 3.13Å; L179-L182 HydrophobicContact CD2-CD1 4.35Å; L179-L182 PolarHBondContact O-N 2.86Å; L179-I183 PolarHBondContact O-N 2.92Å
180C79Confident81.5Confident29 Ų2947.8 Ų47.820%0.19627%0.273CS..Hα-helixtrans-67.9-32.9176.9-87.20000112.8L176 I177 L182 I183 L392 F396L176-C180 PolarHBondContact O-N 3.44Å; I177-C180 WeakPolarHBondContact O-CB 3.42Å; I177-C180 PolarHBondContact O-N 3.14Å; C180-L182 PolarHBondContact O-N 2.83Å; C180-I183 VanDerWaalsContact O-CB 3.24Å; C180-I183 WeakPolarHBondContact O-CB 3.32Å; C180-I183 PolarHBondContact O-N 3.44Å; C180-L392 HydrophobicContact CB-CD1 4.32Å; C180-F396 HydrophobicContact CB-CD2 4.46Å
181S71.4Confident80.1Confident4 Ų450.4 Ų50.43%0.02829%0.286CS..Hα-helixtrans-66.8-37175.562.50000113.7S178 I183 G184 E399S178-S181 PolarHBondContact O-OG 3.35Å; S181-I183 PolarHBondContact O-N 3.42Å; S181-G184 PolarHBondContact O-N 3.33Å; S181-E399 WeakPolarHBondContact CB-OE1 3.37Å; S181-E399 VanDerWaalsContact CB-OE2 3.23Å; S181-E399 WeakPolarHBondContact CB-OE2 3.15Å; S181-E399 PolarHBondContact OG-OE1 3.05Å
182L75.8Confident78.6Confident72 Ų7256.7 Ų56.738%0.37731%0.311SS..Hα-helixtrans-63.6-18.6171.1-59.9-179.2000113.3L179 C180 G184 F421L179-L182 HydrophobicContact CD2-CD1 4.35Å; L179-L182 PolarHBondContact O-N 2.86Å; C180-L182 PolarHBondContact O-N 2.83Å; L182-G184 VanDerWaalsContact C-N 3.27Å; L182-G184 PolarHBondContact O-N 3.05Å; L182-F421 HydrophobicContact CD1-CD2 4.42Å; L182-F421 HydrophobicContact CD2-CB 4.39Å; L182-F421 HydrophobicContact CD2-CD2 4.12Å
183I73.7Confident77.6Confident74 Ų7458 Ų5838%0.37931%0.312SS..Hα-helixtrans-69.3-26173.7-60.6175000111.1L179 C180 S181 A185 S186 V187 F396L179-I183 PolarHBondContact O-N 2.92Å; C180-I183 VanDerWaalsContact O-CB 3.24Å; C180-I183 WeakPolarHBondContact O-CB 3.32Å; C180-I183 PolarHBondContact O-N 3.44Å; S181-I183 PolarHBondContact O-N 3.42Å; I183-A185 PolarHBondContact O-N 3.18Å; I183-S186 WeakPolarHBondContact O-CA 3.42Å; I183-S186 WeakPolarHBondContact O-CB 3.49Å; I183-S186 PolarHBondContact O-N 2.86Å; I183-V187 HydrophobicContact CG2-CG2 3.95Å; I183-V187 WeakPolarHBondContact O-CG2 3.38Å; I183-V187 PolarHBondContact O-N 3.26Å; I183-F396 HydrophobicContact CG2-CE2 4.49Å
184G65.9Low76.7Confident6 Ų660.6 Ų60.66%0.06233%0.328CS..Hα-helixtrans-50.7-42.7177.300000113.1S181 L182 S186 V187 V188S181-G184 PolarHBondContact O-N 3.33Å; L182-G184 VanDerWaalsContact C-N 3.27Å; L182-G184 PolarHBondContact O-N 3.05Å; G184-S186 VanDerWaalsContact C-N 3.26Å; G184-S186 PolarHBondContact O-N 3.24Å; G184-V187 PolarHBondContact O-N 3.17Å; G184-V188 WeakPolarHBondContact O-CG2 3.39Å; G184-V188 PolarHBondContact O-N 2.96Å
185A66.7Low75.9Confident36 Ų3667.7 Ų67.730%0.29836%0.359SS..Hα-helixtrans-53.8-39.4173.600000113.8I183 V187 L417I183-A185 PolarHBondContact O-N 3.18Å; A185-V187 VanDerWaalsContact C-N 3.34Å; A185-L417 HydrophobicContact CB-CD1 3.61Å; A185-L417 HydrophobicContact CB-CD2 3.77Å; A185-L417 HydrophobicContact CB-CG 4.31Å
186S70.4Confident75.3Confident81 Ų8166 Ų6657%0.56635%0.347SS*.Hα-helixtrans-79.9-18.1-178.2-59.70000112.7I183 G184 P189I183-S186 WeakPolarHBondContact O-CA 3.42Å; I183-S186 WeakPolarHBondContact O-CB 3.49Å; I183-S186 PolarHBondContact O-N 2.86Å; G184-S186 VanDerWaalsContact C-N 3.26Å; G184-S186 PolarHBondContact O-N 3.24Å; S186-P189 WeakPolarHBondContact O-CD 3.23Å
187V68.1Low74.8Confident21 Ų2165.8 Ų65.813%0.12734%0.342CS..Hα-helixtrans-87.7-27.5-177.3174.50000112.4I183 G184 A185 P189 F190 M191 Y196 L400I183-V187 HydrophobicContact CG2-CG2 3.95Å; I183-V187 WeakPolarHBondContact O-CG2 3.38Å; I183-V187 PolarHBondContact O-N 3.26Å; G184-V187 PolarHBondContact O-N 3.17Å; A185-V187 VanDerWaalsContact C-N 3.34Å; V187-P189 VanDerWaalsContact C-CD 3.49Å; V187-F190 WeakPolarHBondContact O-CA 3.42Å; V187-F190 WeakPolarHBondContact O-CB 3.21Å; V187-F190 PolarHBondContact O-N 3.21Å; V187-M191 HydrophobicContact CG1-CG 4.33Å; V187-M191 PolarHBondContact O-N 2.85Å; V187-Y196 HydrophobicContact CG1-CD2 3.98Å; V187-Y196 HydrophobicContact CG1-CE1 4.45Å; V187-Y196 HydrophobicContact CG1-CE2 3.19Å; V187-L400 HydrophobicContact CB-CD1 4.04Å; V187-L400 HydrophobicContact CG1-CD1 3.78Å; V187-L400 HydrophobicContact CG2-CD1 4.42Å
188V67.8Low74.5Confident41 Ų4168 Ų6825%0.24835%0.35CS..G310 helixtrans-40.5-51.6176.3-170.60000115G184 F190 M191 F403G184-V188 WeakPolarHBondContact O-CG2 3.39Å; G184-V188 PolarHBondContact O-N 2.96Å; V188-F190 PolarHBondContact O-N 3.38Å; V188-F190 VanDerWaalsContact O-N 3.12Å; V188-M191 PolarHBondContact O-N 3.07Å; V188-F403 HydrophobicContact CG2-CD1 4.43Å; V188-F403 HydrophobicContact CG2-CE1 3.42Å; V188-F403 VanDerWaalsContact CG2-CE1 3.42Å; V188-F403 HydrophobicContact CG2-CZ 3.85Å
189P72.8Confident74.4Confident96 Ų9670.8 Ų70.862%0.62336%0.364SS*.G310 helixtrans-64-16.8179.624.7-35.2000114.6S186 V187S186-P189 WeakPolarHBondContact O-CD 3.23Å; V187-P189 VanDerWaalsContact C-CD 3.49Å
190F69.4Low74.4Confident113 Ų11367.8 Ų67.850%0.49635%0.348SS..G310 helixtrans-97.8-16.9-179.7-59.2-75000114V187 V188 K192 K193V187-F190 WeakPolarHBondContact O-CA 3.42Å; V187-F190 WeakPolarHBondContact O-CB 3.21Å; V187-F190 PolarHBondContact O-N 3.21Å; V188-F190 PolarHBondContact O-N 3.38Å; V188-F190 VanDerWaalsContact O-N 3.12Å; F190-K192 PolarHBondContact O-N 3.39Å; F190-K193 PolarHBondContact O-N 3.04Å
191M66.6Low75Confident56 Ų5666.4 Ų66.428%0.27634%0.339SS..THydrogen-bonded Turntrans-54.7-28.1-175.2-69.8-173.678.100114.9V187 V188 K193 Y196 V404V187-M191 HydrophobicContact CG1-CG 4.33Å; V187-M191 PolarHBondContact O-N 2.85Å; V188-M191 PolarHBondContact O-N 3.07Å; M191-K193 PolarHBondContact O-N 3.16Å; M191-K193 VanDerWaalsContact O-N 3.11Å; M191-Y196 HydrophobicContact CB-CD1 4.09Å; M191-Y196 HydrophobicContact CB-CE1 4.45Å; M191-Y196 HydrophobicContact CE-CE1 4.2Å; M191-Y196 HydrophobicContact CG-CD1 4.02Å; M191-Y196 HydrophobicContact CG-CE1 3.91Å; M191-V404 HydrophobicContact CE-CG2 3.35Å; M191-V404 HydrophobicContact SD-CG2 4.07Å
192K65.1Low76Confident204 Ų20469.3 Ų69.389%0.88735%0.35SS*.THydrogen-bonded Turntrans-70.7-0.9-177.5-62.4-175.6178.5-178.50114.8F190F190-K192 PolarHBondContact O-N 3.39Å
193K74.9Confident76.8Confident123 Ų12368.3 Ų68.354%0.53534%0.343SS..SBendtrans-97.6139.2-178.5-64.1179.6179.8179.40111F190 M191 F195 Y196F190-K193 PolarHBondContact O-N 3.04Å; M191-K193 PolarHBondContact O-N 3.16Å; M191-K193 VanDerWaalsContact O-N 3.11Å; K193-F195 PolarHBondContact O-N 2.73Å; K193-F195 VanDerWaalsContact O-N 3.15Å; K193-Y196 WeakPolarHBondContact O-CA 3.46Å; K193-Y196 WeakPolarHBondContact O-CB 3.12Å; K193-Y196 PolarHBondContact O-N 3.22Å
194T76.1Confident77.8Confident75 Ų7565 Ų6546%0.4633%0.326SS..Hα-helixtrans-59.1-27.2173.2-43.30000113.1Y196 R198T194-Y196 PolarHBondContact O-N 3.12Å; T194-R198 WeakPolarHBondContact O-CD 3.43Å; T194-R198 WeakPolarHBondContact O-CG 3.23Å; T194-R198 PolarHBondContact O-N 2.97Å
195F79.9Confident79.2Confident149 Ų14964.8 Ų64.865%0.65432%0.323SS*.Hα-helixtrans-58-33.2169.5178.2-99.2000112.5K193 L199K193-F195 PolarHBondContact O-N 2.73Å; K193-F195 VanDerWaalsContact O-N 3.15Å; F195-L199 HydrophobicContact CE1-CD2 4.07Å; F195-L199 WeakPolarHBondContact O-CB 3.32Å; F195-L199 PolarHBondContact O-N 3.33Å
196Y80.4Confident80.6Confident18 Ų1863.7 Ų63.77%0.07131%0.312CS..Hα-helixtrans-71.1-50.9-176.4-173.8-97.6000112.8V187 M191 K193 T194 R198 L199 L200 L400V187-Y196 HydrophobicContact CG1-CD2 3.98Å; V187-Y196 HydrophobicContact CG1-CE1 4.45Å; V187-Y196 HydrophobicContact CG1-CE2 3.19Å; M191-Y196 HydrophobicContact CB-CD1 4.09Å; M191-Y196 HydrophobicContact CB-CE1 4.45Å; M191-Y196 HydrophobicContact CE-CE1 4.2Å; M191-Y196 HydrophobicContact CG-CD1 4.02Å; M191-Y196 HydrophobicContact CG-CE1 3.91Å; K193-Y196 WeakPolarHBondContact O-CA 3.46Å; K193-Y196 WeakPolarHBondContact O-CB 3.12Å; K193-Y196 PolarHBondContact O-N 3.22Å; T194-Y196 PolarHBondContact O-N 3.12Å; Y196-R198 PolarHBondContact O-N 2.87Å; Y196-L199 PolarHBondContact O-N 3.25Å; Y196-L200 HydrophobicContact CE1-CB 4.31Å; Y196-L200 HydrophobicContact CE1-CD2 4.22Å; Y196-L200 PolarHBondContact O-N 3.38Å; Y196-L400 HydrophobicContact CE1-CD2 4.3Å; Y196-L400 WeakPolarHBondContact OH-CD1 3.21Å; Y196-L400 WeakPolarHBondContact OH-CD2 3.18Å
197K81.1Confident81.8Confident85 Ų8559.8 Ų59.837%0.3729%0.285SS..Hα-helixtrans-54.3-38174.6-77.8-156.3169.6-165.70112.1L200 L201 E472K197-L200 PolarHBondContact O-N 3.21Å; K197-L201 WeakPolarHBondContact O-CB 3.36Å; K197-L201 PolarHBondContact O-N 3.35Å; K197-E472 IonicContact NZ-OE1 3.33Å; K197-E472 IonicContact NZ-OE2 2.72Å; K197-E472 PolarHBondContact NZ-OE2 2.99Å
198R85.6Confident83.1Confident50 Ų5058.8 Ų58.819%0.18928%0.279CS..Hα-helixtrans-69.2-37177.3-71.1171.3174-131.3-26.4113.8T194 Y196 Y202 E473 I487T194-R198 WeakPolarHBondContact O-CD 3.43Å; T194-R198 WeakPolarHBondContact O-CG 3.23Å; T194-R198 PolarHBondContact O-N 2.97Å; Y196-R198 PolarHBondContact O-N 2.87Å; R198-Y202 PolarHBondContact O-N 3.49Å; R198-Y202 VanDerWaalsContact O-N 3.1Å; R198-E473 IonicContact CZ-OE2 3.31Å; R198-E473 VanDerWaalsContact CZ-OE2 3.31Å; R198-E473 IonicContact NE-OE1 3.44Å; R198-E473 PolarHBondContact NE-OE1 2.81Å; R198-E473 IonicContact NE-OE2 2.89Å; R198-E473 PolarHBondContact NE-OE2 2.62Å; R198-E473 IonicContact NH2-OE2 2.82Å; R198-E473 PolarHBondContact NH2-OE2 2.82Å; R198-I487 HydrophobicContact CB-CD1 3.85Å; R198-I487 HydrophobicContact CG-CD1 3.9Å
199L86.5Confident84.5Confident62 Ų6256.9 Ų56.933%0.32527%0.267SS..Hα-helixtrans-70-42174.5-175.462.3000110.9F195 Y196 Y202 F203F195-L199 HydrophobicContact CE1-CD2 4.07Å; F195-L199 WeakPolarHBondContact O-CB 3.32Å; F195-L199 PolarHBondContact O-N 3.33Å; Y196-L199 PolarHBondContact O-N 3.25Å; L199-Y202 WeakPolarHBondContact O-CB 3.33Å; L199-Y202 PolarHBondContact O-N 3.36Å; L199-F203 HydrophobicContact CD1-CD2 4.11Å; L199-F203 HydrophobicContact CD1-CE2 3.61Å; L199-F203 HydrophobicContact CD1-CZ 4.49Å; L199-F203 HydrophobicContact CD2-CE2 4.35Å; L199-F203 HydrophobicContact CG-CD2 4Å; L199-F203 HydrophobicContact CG-CE2 3.74Å; L199-F203 WeakPolarHBondContact O-CD2 3.47Å; L199-F203 PolarHBondContact O-N 2.8Å
200L86.2Confident85.6Confident28 Ų2852.3 Ų52.315%0.14724%0.237CC..Hα-helixtrans-62.7-45.9174.9-175.858.6000111.5Y196 K197 Y202 F203 I204 P397 L400Y196-L200 HydrophobicContact CE1-CB 4.31Å; Y196-L200 HydrophobicContact CE1-CD2 4.22Å; Y196-L200 PolarHBondContact O-N 3.38Å; K197-L200 PolarHBondContact O-N 3.21Å; L200-Y202 VanDerWaalsContact C-N 3.26Å; L200-Y202 PolarHBondContact O-N 3.31Å; L200-F203 PolarHBondContact O-N 3.31Å; L200-I204 HydrophobicContact CD1-CD1 4.44Å; L200-I204 HydrophobicContact CD1-CG1 4.44Å; L200-I204 HydrophobicContact CG-CD1 4.02Å; L200-I204 HydrophobicContact CG-CG1 4.49Å; L200-I204 WeakPolarHBondContact O-CG1 3.28Å; L200-I204 PolarHBondContact O-N 3.14Å; L200-P397 HydrophobicContact CD1-CB 4.06Å; L200-L400 HydrophobicContact CD1-CD2 4.2Å; L200-L400 HydrophobicContact CD2-CD2 4.1Å
201L90.4Very high86.9Confident1 Ų146.9 Ų46.91%0.00521%0.214CC..Hα-helixtrans-58.8-35.9174.4-178.266.8000112.7K197 A205 M466 V469 T484 I487 Q488K197-L201 WeakPolarHBondContact O-CB 3.36Å; K197-L201 PolarHBondContact O-N 3.35Å; L201-A205 VanDerWaalsContact O-CB 3.25Å; L201-A205 WeakPolarHBondContact O-CB 3.44Å; L201-A205 PolarHBondContact O-N 3.41Å; L201-A205 VanDerWaalsContact O-N 3.09Å; L201-M466 HydrophobicContact CD1-CG 3.82Å; L201-M466 WeakPolarHBondContact CD1-O 3.46Å; L201-V469 HydrophobicContact CB-CG1 4.29Å; L201-V469 HydrophobicContact CD1-CB 4.29Å; L201-V469 HydrophobicContact CD1-CG1 4.17Å; L201-T484 HydrophobicContact CD2-CG2 3.51Å; L201-I487 HydrophobicContact CB-CG2 4.26Å; L201-I487 HydrophobicContact CD2-CG2 4.1Å; L201-I487 HydrophobicContact CG-CG2 4.04Å; L201-Q488 HydrophobicContact CD1-CG 4.11Å; L201-Q488 HydrophobicContact CD2-CG 4.3Å; L201-Q488 HydrophobicContact CG-CG 4.26Å
202Y93.3Very high88.3Confident64 Ų6445.2 Ų45.225%0.25120%0.204SC..Hα-helixtrans-64.2-43.2172.2176.2-94.2000111.6R198 L199 L200 A205 L206 A490R198-Y202 PolarHBondContact O-N 3.49Å; R198-Y202 VanDerWaalsContact O-N 3.1Å; L199-Y202 WeakPolarHBondContact O-CB 3.33Å; L199-Y202 PolarHBondContact O-N 3.36Å; L200-Y202 VanDerWaalsContact C-N 3.26Å; L200-Y202 PolarHBondContact O-N 3.31Å; Y202-A205 PolarHBondContact O-N 3.2Å; Y202-L206 HydrophobicContact CE1-CD2 4.33Å; Y202-L206 WeakPolarHBondContact O-CB 3.47Å; Y202-L206 PolarHBondContact O-N 3.32Å; Y202-A490 HydrophobicContact CD2-CB 4.36Å; Y202-A490 HydrophobicContact CE2-CB 4.13Å
203F92.5Very high89.8Confident52 Ų5235.5 Ų35.523%0.22816%0.162CC..Hα-helixtrans-69.9-40.2179.3-79.1-65.9000113.3L199 L200 A205 L206 A207 F396 P397L199-F203 HydrophobicContact CD1-CD2 4.11Å; L199-F203 HydrophobicContact CD1-CE2 3.61Å; L199-F203 HydrophobicContact CD1-CZ 4.49Å; L199-F203 HydrophobicContact CD2-CE2 4.35Å; L199-F203 HydrophobicContact CG-CD2 4Å; L199-F203 HydrophobicContact CG-CE2 3.74Å; L199-F203 WeakPolarHBondContact O-CD2 3.47Å; L199-F203 PolarHBondContact O-N 2.8Å; L200-F203 PolarHBondContact O-N 3.31Å; F203-A205 VanDerWaalsContact C-N 3.31Å; F203-A205 PolarHBondContact O-N 2.94Å; F203-L206 HydrophobicContact CD1-CD2 3.94Å; F203-L206 HydrophobicContact CE1-CD2 4.19Å; F203-L206 WeakPolarHBondContact O-CB 3.3Å; F203-L206 PolarHBondContact O-N 3.31Å; F203-L206 VanDerWaalsContact O-N 3.14Å; F203-A207 PolarHBondContact O-N 3.04Å; F203-F396 HydrophobicContact CB-CD1 4.15Å; F203-F396 AromaticContact CD1-CD1 3.94Å; F203-F396 HydrophobicContact CD1-CD1 3.94Å; F203-F396 HydrophobicContact CD1-CE1 4.38Å; F203-F396 AromaticContact CD2-CD1 3.81Å; F203-F396 HydrophobicContact CD2-CD1 3.81Å; F203-F396 AromaticContact CD2-CE1 3.48Å; F203-F396 HydrophobicContact CD2-CE1 3.48Å; F203-F396 VanDerWaalsContact CD2-CE1 3.48Å; F203-F396 HydrophobicContact CE1-CD1 4.27Å; F203-F396 HydrophobicContact CE1-CE1 4.49Å; F203-F396 HydrophobicContact CE2-CD1 4.14Å; F203-F396 AromaticContact CE2-CE1 3.6Å; F203-F396 HydrophobicContact CE2-CE1 3.6Å; F203-F396 HydrophobicContact CE2-CZ 4.42Å; F203-F396 AromaticContact CG-CD1 3.71Å; F203-F396 HydrophobicContact CG-CD1 3.71Å; F203-F396 AromaticContact CG-CE1 3.91Å; F203-F396 HydrophobicContact CG-CE1 3.91Å; F203-F396 HydrophobicContact CZ-CD1 4.36Å; F203-F396 HydrophobicContact CZ-CE1 4.13Å; F203-P397 HydrophobicContact CB-CB 4.39Å; F203-P397 HydrophobicContact CB-CG 4.36Å
204I93.4Very high90.8Very high5 Ų529.6 Ų29.63%0.02614%0.137CC..Hα-helixtrans-60.9-43.6172.5-58.9160.3000109.9L200 L206 A207 I208 P397 M462 E465 M466 V469L200-I204 HydrophobicContact CD1-CD1 4.44Å; L200-I204 HydrophobicContact CD1-CG1 4.44Å; L200-I204 HydrophobicContact CG-CD1 4.02Å; L200-I204 HydrophobicContact CG-CG1 4.49Å; L200-I204 WeakPolarHBondContact O-CG1 3.28Å; L200-I204 PolarHBondContact O-N 3.14Å; I204-L206 VanDerWaalsContact C-N 3.32Å; I204-L206 PolarHBondContact O-N 2.8Å; I204-A207 WeakPolarHBondContact O-CB 3.41Å; I204-A207 PolarHBondContact O-N 3.29Å; I204-I208 HydrophobicContact CG2-CD1 4.22Å; I204-I208 WeakPolarHBondContact O-CD1 3.31Å; I204-I208 WeakPolarHBondContact O-CG1 3.45Å; I204-I208 PolarHBondContact O-N 2.87Å; I204-I208 VanDerWaalsContact O-N 3.14Å; I204-P397 HydrophobicContact CG1-CB 3.7Å; I204-M462 HydrophobicContact CG2-CB 4.21Å; I204-M462 WeakPolarHBondContact CG2-O 3.34Å; I204-M462 HydrophobicContact CG2-SD 4.03Å; I204-E465 HydrophobicContact CD1-CG 4.23Å; I204-M466 HydrophobicContact CG2-CB 3.79Å; I204-M466 HydrophobicContact CG2-CG 4.39Å; I204-V469 HydrophobicContact CD1-CG2 4.46Å
205A95.8Very high91.7Very high0 Ų026 Ų260%012%0.115CC..Hα-helixtrans-64.2-35.1174.900000113L201 Y202 F203 G209 M466 G491 L492L201-A205 VanDerWaalsContact O-CB 3.25Å; L201-A205 WeakPolarHBondContact O-CB 3.44Å; L201-A205 PolarHBondContact O-N 3.41Å; L201-A205 VanDerWaalsContact O-N 3.09Å; Y202-A205 PolarHBondContact O-N 3.2Å; F203-A205 VanDerWaalsContact C-N 3.31Å; F203-A205 PolarHBondContact O-N 2.94Å; A205-G209 PolarHBondContact O-N 3.03Å; A205-M466 HydrophobicContact CB-CG 4.42Å; A205-M466 HydrophobicContact CB-SD 3.72Å; A205-G491 CarbonylContact O-C 3.57Å; A205-L492 HydrophobicContact CB-CG 4.31Å; A205-L492 VanDerWaalsContact O-CA 3.28Å; A205-L492 WeakPolarHBondContact O-CA 3.2Å; A205-L492 WeakPolarHBondContact O-CD2 3.42Å; A205-L492 PolarHBondContact O-N 3.07Å
206L96.4Very high92.4Very high13 Ų1320.1 Ų20.17%0.0689%0.09CC..Hα-helixtrans-65.3-46.5174.3-173.772.2000111.2Y202 F203 I204 G209 T210 C393 T494 I498Y202-L206 HydrophobicContact CE1-CD2 4.33Å; Y202-L206 WeakPolarHBondContact O-CB 3.47Å; Y202-L206 PolarHBondContact O-N 3.32Å; F203-L206 HydrophobicContact CD1-CD2 3.94Å; F203-L206 HydrophobicContact CE1-CD2 4.19Å; F203-L206 WeakPolarHBondContact O-CB 3.3Å; F203-L206 PolarHBondContact O-N 3.31Å; F203-L206 VanDerWaalsContact O-N 3.14Å; I204-L206 VanDerWaalsContact C-N 3.32Å; I204-L206 PolarHBondContact O-N 2.8Å; L206-G209 CarbonylContact O-C 3.53Å; L206-G209 WeakPolarHBondContact O-CA 3.37Å; L206-G209 PolarHBondContact O-N 2.9Å; L206-G209 VanDerWaalsContact O-N 3.09Å; L206-T210 PolarHBondContact O-N 3.28Å; L206-T210 PolarHBondContact O-OG1 2.95Å; L206-C393 HydrophobicContact CD2-CB 4.33Å; L206-C393 HydrophobicContact CG-CB 4.39Å; L206-T494 HydrophobicContact CD1-CG2 3.88Å; L206-I498 HydrophobicContact CD1-CD1 4.34Å
207A95.4Very high93Very high0 Ų019.3 Ų19.30%09%0.086CC..Hα-helixtrans-55.2-55.2177.300000111.8F203 I204 G209 T210 L211 C393 E394 P397F203-A207 PolarHBondContact O-N 3.04Å; I204-A207 WeakPolarHBondContact O-CB 3.41Å; I204-A207 PolarHBondContact O-N 3.29Å; A207-G209 PolarHBondContact O-N 3.28Å; A207-T210 PolarHBondContact O-N 3.13Å; A207-T210 PolarHBondContact O-OG1 2.76Å; A207-L211 WeakPolarHBondContact O-CB 3.03Å; A207-L211 VanDerWaalsContact O-CG 3.23Å; A207-L211 WeakPolarHBondContact O-CG 3.05Å; A207-L211 PolarHBondContact O-N 2.84Å; A207-C393 WeakPolarHBondContact CB-O 3.48Å; A207-E394 HydrophobicContact CB-CB 4.01Å; A207-P397 HydrophobicContact CB-CG 4.1Å
208I96.4Very high93.4Very high0 Ų015.8 Ų15.80%07%0.072CC..Hα-helixtrans-54.7-41.2176.2-58.8156000110.3I204 Y212 F244 A458 M462 F463 M466 L492I204-I208 HydrophobicContact CG2-CD1 4.22Å; I204-I208 WeakPolarHBondContact O-CD1 3.31Å; I204-I208 WeakPolarHBondContact O-CG1 3.45Å; I204-I208 PolarHBondContact O-N 2.87Å; I204-I208 VanDerWaalsContact O-N 3.14Å; I208-Y212 VanDerWaalsContact O-CB 3.28Å; I208-Y212 WeakPolarHBondContact O-CB 3.38Å; I208-Y212 PolarHBondContact O-N 3.17Å; I208-F244 HydrophobicContact CG2-CZ 4.45Å; I208-A458 HydrophobicContact CG2-CB 4.48Å; I208-M462 HydrophobicContact CD1-CB 4.22Å; I208-M462 HydrophobicContact CG1-CB 3.64Å; I208-F463 HydrophobicContact CD1-CB 4.07Å; I208-F463 HydrophobicContact CD1-CD2 4.39Å; I208-F463 HydrophobicContact CG1-CB 4.47Å; I208-F463 HydrophobicContact CG2-CD2 4.49Å; I208-M466 HydrophobicContact CD1-CB 3.82Å; I208-M466 HydrophobicContact CD1-CE 3.95Å; I208-M466 HydrophobicContact CD1-CG 4.18Å; I208-M466 HydrophobicContact CD1-SD 3.64Å; I208-L492 HydrophobicContact CB-CD2 3.71Å; I208-L492 HydrophobicContact CG2-CD2 3.55Å
209G96.6Very high93.8Very high0 Ų013.4 Ų13.40%06%0.063CC..Hα-helixtrans-63-42.9176.800000113.7A205 L206 A207 S213 G495 F496A205-G209 PolarHBondContact O-N 3.03Å; L206-G209 CarbonylContact O-C 3.53Å; L206-G209 WeakPolarHBondContact O-CA 3.37Å; L206-G209 PolarHBondContact O-N 2.9Å; L206-G209 VanDerWaalsContact O-N 3.09Å; A207-G209 PolarHBondContact O-N 3.28Å; G209-S213 WeakPolarHBondContact O-CB 3.37Å; G209-S213 PolarHBondContact O-OG 3.1Å; G209-G495 CarbonylContact O-C 3.56Å; G209-F496 PolarHBondContact O-N 3.22Å
210T96.6Very high94.1Very high0 Ų012.8 Ų12.80%06%0.059CC..Hα-helixtrans-76.4-47.4179.849.40000112.3L206 A207 S213 N214 A390 C393 M499L206-T210 PolarHBondContact O-N 3.28Å; L206-T210 PolarHBondContact O-OG1 2.95Å; A207-T210 PolarHBondContact O-N 3.13Å; A207-T210 PolarHBondContact O-OG1 2.76Å; T210-S213 CarbonylContact O-C 3.55Å; T210-S213 PolarHBondContact O-N 3.41Å; T210-N214 WeakPolarHBondContact O-CB 3.2Å; T210-N214 PolarHBondContact O-N 3.34Å; T210-A390 PolarHBondContact OG1-O 2.98Å; T210-C393 HydrophobicContact CG2-CB 3.99Å; T210-C393 WeakPolarHBondContact OG1-CB 3.31Å; T210-M499 HydrophobicContact CG2-CG 4.32Å; T210-M499 HydrophobicContact CG2-SD 4.37Å; T210-M499 WeakPolarHBondContact O-CG 3.38Å
211L95Very high94.3Very high0 Ų011.8 Ų11.80%05%0.054CC..Hα-helixtrans-65.6-54.2-173.3-63.7173.4000113.8A207 S213 N214 A215 E394 F454 I457 A458A207-L211 WeakPolarHBondContact O-CB 3.03Å; A207-L211 VanDerWaalsContact O-CG 3.23Å; A207-L211 WeakPolarHBondContact O-CG 3.05Å; A207-L211 PolarHBondContact O-N 2.84Å; L211-S213 PolarHBondContact O-N 3.23Å; L211-N214 PolarHBondContact O-N 2.96Å; L211-A215 PolarHBondContact O-N 3Å; L211-E394 HydrophobicContact CD1-CB 3.67Å; L211-E394 HydrophobicContact CD1-CG 4.3Å; L211-E394 WeakPolarHBondContact CD1-OE2 3.26Å; L211-E394 HydrophobicContact CD2-CB 3.95Å; L211-E394 HydrophobicContact CD2-CG 4.11Å; L211-E394 WeakPolarHBondContact CD2-OE1 3.42Å; L211-E394 VanDerWaalsContact CD2-OE2 3.28Å; L211-E394 WeakPolarHBondContact CD2-OE2 3.47Å; L211-E394 HydrophobicContact CG-CB 4.02Å; L211-F454 HydrophobicContact CD2-CD2 3.77Å; L211-F454 HydrophobicContact CD2-CE2 4.02Å; L211-F454 HydrophobicContact CD2-CG 4.36Å; L211-I457 HydrophobicContact CD1-CB 4.46Å; L211-I457 HydrophobicContact CD1-CG2 3.99Å; L211-A458 HydrophobicContact CB-CB 3.9Å; L211-A458 HydrophobicContact CD1-CB 4.24Å
212Y96.5Very high94.2Very high20 Ų2014.6 Ų14.68%0.0787%0.067CC..Hα-helixtrans-60.6-34.8179.7178-84.5000110.3I208 L216 F241 F244 L455 L459I208-Y212 VanDerWaalsContact O-CB 3.28Å; I208-Y212 WeakPolarHBondContact O-CB 3.38Å; I208-Y212 PolarHBondContact O-N 3.17Å; Y212-L216 HydrophobicContact CD1-CD1 3.88Å; Y212-L216 HydrophobicContact CE1-CD1 3.26Å; Y212-L216 HydrophobicContact CE1-CG 4.24Å; Y212-L216 WeakPolarHBondContact O-CB 3.28Å; Y212-L216 WeakPolarHBondContact O-CG 3.29Å; Y212-L216 PolarHBondContact O-N 2.94Å; Y212-L216 VanDerWaalsContact O-N 3.14Å; Y212-F241 AromaticContact CD1-CD2 3.49Å; Y212-F241 HydrophobicContact CD1-CD2 3.49Å; Y212-F241 VanDerWaalsContact CD1-CD2 3.49Å; Y212-F241 AromaticContact CD1-CE2 3.91Å; Y212-F241 HydrophobicContact CD1-CE2 3.91Å; Y212-F241 HydrophobicContact CD1-CG 4.49Å; Y212-F241 HydrophobicContact CE1-CB 4.18Å; Y212-F241 AromaticContact CE1-CD2 3.65Å; Y212-F241 HydrophobicContact CE1-CD2 3.65Å; Y212-F241 HydrophobicContact CE1-CE2 4.37Å; Y212-F241 HydrophobicContact CE1-CG 4.23Å; Y212-F244 HydrophobicContact CE1-CB 4.48Å; Y212-F244 HydrophobicContact CE1-CD1 4.3Å; Y212-L455 HydrophobicContact CD2-CD2 3.38Å; Y212-L455 HydrophobicContact CE2-CD2 3.75Å; Y212-L455 HydrophobicContact CG-CD2 4.09Å; Y212-L459 HydrophobicContact CD2-CD1 4.05Å; Y212-L459 HydrophobicContact CD2-CD2 3.72Å; Y212-L459 HydrophobicContact CD2-CG 3.93Å; Y212-L459 HydrophobicContact CE2-CD1 3.92Å; Y212-L459 HydrophobicContact CE2-CD2 3.89Å; Y212-L459 HydrophobicContact CE2-CG 4.22Å
213S96.2Very high94Very high0 Ų012.6 Ų12.60%06%0.064CC..Hα-helixtrans-72-39.6173.2-56.80000112.9G209 T210 L211 A215 L216 F217G209-S213 WeakPolarHBondContact O-CB 3.37Å; G209-S213 PolarHBondContact O-OG 3.1Å; T210-S213 CarbonylContact O-C 3.55Å; T210-S213 PolarHBondContact O-N 3.41Å; L211-S213 PolarHBondContact O-N 3.23Å; S213-A215 VanDerWaalsContact C-N 3.34Å; S213-L216 PolarHBondContact O-N 3.47Å; S213-F217 WeakPolarHBondContact O-CB 3.45Å; S213-F217 WeakPolarHBondContact O-CD2 3.29Å; S213-F217 WeakPolarHBondContact O-CG 3.35Å; S213-F217 PolarHBondContact O-N 3.15Å
214N95.5Very high93.8Very high0 Ų017.4 Ų17.40%09%0.085CC..Hα-helixtrans-63.6-41.8176.8-165.847.1000111.3T210 L211 Q218 L219 A390 F454 M499T210-N214 WeakPolarHBondContact O-CB 3.2Å; T210-N214 PolarHBondContact O-N 3.34Å; L211-N214 PolarHBondContact O-N 2.96Å; N214-Q218 WeakPolarHBondContact O-CA 3.28Å; N214-Q218 WeakPolarHBondContact O-CB 3.39Å; N214-Q218 PolarHBondContact O-N 3.3Å; N214-Q218 PolarHBondContact OD1-OE1 3.43Å; N214-L219 PolarHBondContact O-N 2.89Å; N214-A390 HydrophobicContact CB-CB 3.75Å; N214-F454 HydrophobicContact CB-CD2 4.32Å; N214-F454 WeakPolarHBondContact ND2-CE2 3.43Å; N214-M499 HydrophobicContact CB-CE 3.84Å; N214-M499 WeakPolarHBondContact OD1-CE 3.36Å
215A95.8Very high93.3Very high0 Ų019.5 Ų19.50%011%0.108CC..Iπ-helixtrans-59.3-51.2172.900000111.7L211 S213 I220 F454 L455L211-A215 PolarHBondContact O-N 3Å; S213-A215 VanDerWaalsContact C-N 3.34Å; A215-I220 HydrophobicContact CB-CD1 4.13Å; A215-I220 VanDerWaalsContact O-CB 3.22Å; A215-I220 WeakPolarHBondContact O-CB 3.34Å; A215-I220 VanDerWaalsContact O-CG1 3.28Å; A215-I220 WeakPolarHBondContact O-CG1 3.36Å; A215-I220 PolarHBondContact O-N 3Å; A215-F454 HydrophobicContact CB-CB 4.18Å; A215-L455 HydrophobicContact CB-CD2 3.97Å; A215-L455 HydrophobicContact CB-CG 3.76Å
216L94.6Very high92.6Very high24 Ų2423.9 Ų23.913%0.12613%0.127CC..Iπ-helixtrans-74.4-26.9-177.1-71.4-175.6000115.5Y212 S213 P221 S237 V240Y212-L216 HydrophobicContact CD1-CD1 3.88Å; Y212-L216 HydrophobicContact CE1-CD1 3.26Å; Y212-L216 HydrophobicContact CE1-CG 4.24Å; Y212-L216 WeakPolarHBondContact O-CB 3.28Å; Y212-L216 WeakPolarHBondContact O-CG 3.29Å; Y212-L216 PolarHBondContact O-N 2.94Å; Y212-L216 VanDerWaalsContact O-N 3.14Å; S213-L216 PolarHBondContact O-N 3.47Å; L216-P221 VanDerWaalsContact O-CG 3.31Å; L216-P221 WeakPolarHBondContact O-CG 3.48Å; L216-S237 VanDerWaalsContact O-CB 3.29Å; L216-S237 WeakPolarHBondContact O-CB 3.23Å; L216-S237 PolarHBondContact O-OG 3.46Å; L216-V240 HydrophobicContact CD1-CB 4.02Å; L216-V240 HydrophobicContact CD1-CG1 3.7Å; L216-V240 HydrophobicContact CD2-CG1 4.16Å
217F92.1Very high91.3Very high1 Ų126.7 Ų26.70%0.00414%0.143CC..Iπ-helixtrans-102.9-20.1-175.7-68-48.3000114.4S213 Y233 V234 A238 F496 M499 L500 T503S213-F217 WeakPolarHBondContact O-CB 3.45Å; S213-F217 WeakPolarHBondContact O-CD2 3.29Å; S213-F217 WeakPolarHBondContact O-CG 3.35Å; S213-F217 PolarHBondContact O-N 3.15Å; F217-Y233 WeakPolarHBondContact O-CE2 3.28Å; F217-Y233 PolarHBondContact O-OH 3.16Å; F217-Y233 VanDerWaalsContact O-OH 3.06Å; F217-V234 HydrophobicContact CD1-CG1 4.03Å; F217-V234 HydrophobicContact CE1-CG1 4Å; F217-V234 WeakPolarHBondContact CE1-O 3.4Å; F217-A238 HydrophobicContact CE1-CB 4.1Å; F217-A238 HydrophobicContact CZ-CB 4.11Å; F217-F496 AromaticContact CE2-CD2 3.98Å; F217-F496 HydrophobicContact CE2-CD2 3.98Å; F217-F496 AromaticContact CE2-CE2 3.71Å; F217-F496 HydrophobicContact CE2-CE2 3.71Å; F217-F496 HydrophobicContact CZ-CD2 4.24Å; F217-F496 AromaticContact CZ-CE2 3.51Å; F217-F496 HydrophobicContact CZ-CE2 3.51Å; F217-F496 HydrophobicContact CZ-CZ 4.1Å; F217-M499 HydrophobicContact CD2-CB 4.17Å; F217-L500 HydrophobicContact CE1-CD1 4.17Å; F217-L500 HydrophobicContact CE2-CB 4.01Å; F217-L500 HydrophobicContact CE2-CD1 4.35Å; F217-L500 HydrophobicContact CZ-CB 4.25Å; F217-L500 HydrophobicContact CZ-CD1 3.81Å; F217-T503 HydrophobicContact CB-CG2 4.12Å; F217-T503 WeakPolarHBondContact CB-OG1 3.45Å
218Q90.9Very high89.9Confident12 Ų1228.2 Ų28.26%0.05615%0.152CC..Iπ-helixtrans-133.8-65-172-56.2-173.5600111.2N214 I220 P221 E222 S386 T503N214-Q218 WeakPolarHBondContact O-CA 3.28Å; N214-Q218 WeakPolarHBondContact O-CB 3.39Å; N214-Q218 PolarHBondContact O-N 3.3Å; N214-Q218 PolarHBondContact OD1-OE1 3.43Å; Q218-I220 PolarHBondContact O-N 3.35Å; Q218-P221 WeakPolarHBondContact O-CD 3.18Å; Q218-E222 WeakPolarHBondContact O-CB 3.4Å; Q218-E222 PolarHBondContact O-N 3.09Å; Q218-S386 PolarHBondContact NE2-OG 3.01Å; Q218-S386 VanDerWaalsContact OE1-CB 3.24Å; Q218-S386 PolarHBondContact OE1-OG 2.96Å; Q218-T503 PolarHBondContact NE2-OG1 3.14Å
219L92.8Very high88.3Confident0 Ų033.2 Ų33.20%018%0.177CC..Iπ-helixtrans-64.7-48.3-170.7-56.7176.6000113.2N214 A223 F447 A450 F454N214-L219 PolarHBondContact O-N 2.89Å; L219-A223 VanDerWaalsContact O-CB 3.28Å; L219-A223 WeakPolarHBondContact O-CB 3.43Å; L219-A223 PolarHBondContact O-N 2.89Å; L219-F447 HydrophobicContact CD2-CD1 3.95Å; L219-F447 WeakPolarHBondContact O-CB 3.19Å; L219-A450 HydrophobicContact CD1-CB 3.96Å; L219-F454 HydrophobicContact CD1-CD1 4.25Å; L219-F454 HydrophobicContact CD1-CD2 3.68Å; L219-F454 HydrophobicContact CD1-CE1 4.34Å; L219-F454 HydrophobicContact CD1-CE2 3.83Å; L219-F454 HydrophobicContact CD1-CG 3.91Å; L219-F454 HydrophobicContact CD1-CZ 4.14Å
220I93.8Very high86.7Confident48 Ų4837.7 Ų37.725%0.24620%0.204CC..Hα-helixtrans-71.8-44.4-178.9-60.7169.7000111.7A215 Q218 A223 F224 L455A215-I220 HydrophobicContact CB-CD1 4.13Å; A215-I220 VanDerWaalsContact O-CB 3.22Å; A215-I220 WeakPolarHBondContact O-CB 3.34Å; A215-I220 VanDerWaalsContact O-CG1 3.28Å; A215-I220 WeakPolarHBondContact O-CG1 3.36Å; A215-I220 PolarHBondContact O-N 3Å; Q218-I220 PolarHBondContact O-N 3.35Å; I220-A223 WeakPolarHBondContact O-CB 3.2Å; I220-A223 PolarHBondContact O-N 2.91Å; I220-F224 HydrophobicContact CG2-CD2 3.98Å; I220-F224 HydrophobicContact CG2-CE2 3.69Å; I220-F224 WeakPolarHBondContact O-CD2 3.28Å; I220-F224 PolarHBondContact O-N 2.86Å; I220-L455 HydrophobicContact CD1-CD1 3.6Å; I220-L455 HydrophobicContact CD1-CG 4.37Å
221P90.4Very high85.5Confident8 Ų840.7 Ų40.75%0.05222%0.22CC..Hα-helixtrans-61.1-43.8174.6-25.935.8000113.9L216 Q218 A223 F224 G225 F226 Y233L216-P221 VanDerWaalsContact O-CG 3.31Å; L216-P221 WeakPolarHBondContact O-CG 3.48Å; Q218-P221 WeakPolarHBondContact O-CD 3.18Å; P221-A223 VanDerWaalsContact C-N 3.33Å; P221-A223 PolarHBondContact O-N 3.21Å; P221-F224 CarbonylContact O-C 3.56Å; P221-F224 PolarHBondContact O-N 3Å; P221-F224 VanDerWaalsContact O-N 3.17Å; P221-G225 PolarHBondContact O-N 2.84Å; P221-F226 HydrophobicContact CB-CB 4.35Å; P221-F226 PolarHBondContact O-N 2.95Å; P221-Y233 HydrophobicContact CB-CD1 4.23Å; P221-Y233 HydrophobicContact CB-CD2 3.96Å; P221-Y233 HydrophobicContact CB-CE1 3.7Å; P221-Y233 HydrophobicContact CB-CE2 3.48Å; P221-Y233 VanDerWaalsContact CB-CE2 3.48Å; P221-Y233 HydrophobicContact CB-CG 4.35Å; P221-Y233 HydrophobicContact CG-CD2 3.76Å; P221-Y233 HydrophobicContact CG-CE1 4.49Å; P221-Y233 HydrophobicContact CG-CE2 3.37Å
222E87.3Confident84.5Confident60 Ų6047.5 Ų47.528%0.2825%0.25SS..Hα-helixtrans-65.7-37177.9-167.368.4-151.500111.1Q218 F224 G225 N444 F447Q218-E222 WeakPolarHBondContact O-CB 3.4Å; Q218-E222 PolarHBondContact O-N 3.09Å; E222-F224 VanDerWaalsContact C-N 3.26Å; E222-F224 PolarHBondContact O-N 2.85Å; E222-G225 PolarHBondContact O-N 3.1Å; E222-N444 PolarHBondContact O-ND2 2.86Å; E222-F447 HydrophobicContact CB-CD2 3.89Å; E222-F447 HydrophobicContact CB-CE2 4.35Å; E222-F447 HydrophobicContact CG-CD2 3.41Å; E222-F447 VanDerWaalsContact CG-CD2 3.41Å; E222-F447 HydrophobicContact CG-CE2 3.44Å; E222-F447 VanDerWaalsContact CG-CE2 3.44Å; E222-F447 HydrophobicContact CG-CG 4.42Å; E222-F447 HydrophobicContact CG-CZ 4.45Å
223A90.5Very high83.9Confident21 Ų2147.4 Ų47.417%0.17425%0.25CC..Hα-helixtrans-57.3-37.717300000112.9L219 I220 P221 N444 F447 A448L219-A223 VanDerWaalsContact O-CB 3.28Å; L219-A223 WeakPolarHBondContact O-CB 3.43Å; L219-A223 PolarHBondContact O-N 2.89Å; I220-A223 WeakPolarHBondContact O-CB 3.2Å; I220-A223 PolarHBondContact O-N 2.91Å; P221-A223 VanDerWaalsContact C-N 3.33Å; P221-A223 PolarHBondContact O-N 3.21Å; A223-N444 WeakPolarHBondContact CB-O 3.37Å; A223-N444 PolarHBondContact O-ND2 2.97Å; A223-F447 HydrophobicContact CB-CB 4.09Å; A223-A448 HydrophobicContact CB-CB 3.91Å
224F88.1Confident83.5Confident153 Ų15348.2 Ų48.267%0.67126%0.255SS*.Hα-helixtrans-84.6-9.6173.7-68.4-62.8000114.2I220 P221 E222 F226I220-F224 HydrophobicContact CG2-CD2 3.98Å; I220-F224 HydrophobicContact CG2-CE2 3.69Å; I220-F224 WeakPolarHBondContact O-CD2 3.28Å; I220-F224 PolarHBondContact O-N 2.86Å; P221-F224 CarbonylContact O-C 3.56Å; P221-F224 PolarHBondContact O-N 3Å; P221-F224 VanDerWaalsContact O-N 3.17Å; E222-F224 VanDerWaalsContact C-N 3.26Å; E222-F224 PolarHBondContact O-N 2.85Å; F224-F226 HydrophobicContact CB-CD2 3.73Å; F224-F226 HydrophobicContact CB-CE2 3.5Å; F224-F226 HydrophobicContact CB-CG 4.48Å; F224-F226 HydrophobicContact CB-CZ 4.09Å; F224-F226 HydrophobicContact CD2-CE2 4.23Å; F224-F226 HydrophobicContact CG-CE2 4.09Å
225G81.7Confident83.2Confident50 Ų5051.7 Ų51.752%0.51528%0.279SS..THydrogen-bonded Turntrans77.630.2-179.500000114.5P221 E222P221-G225 PolarHBondContact O-N 2.84Å; E222-G225 PolarHBondContact O-N 3.1Å
226F81.4Confident82.9Confident91 Ų9157.8 Ų57.840%0.39931%0.305SS..  trans-84.4136.2175.4-62.7-52.8000112.1P221 F224 D231 Y233P221-F226 HydrophobicContact CB-CB 4.35Å; P221-F226 PolarHBondContact O-N 2.95Å; F224-F226 HydrophobicContact CB-CD2 3.73Å; F224-F226 HydrophobicContact CB-CE2 3.5Å; F224-F226 HydrophobicContact CB-CG 4.48Å; F224-F226 HydrophobicContact CB-CZ 4.09Å; F224-F226 HydrophobicContact CD2-CE2 4.23Å; F224-F226 HydrophobicContact CG-CE2 4.09Å; F226-D231 VanDerWaalsContact CA-OD2 3.31Å; F226-D231 WeakPolarHBondContact CA-OD2 3.26Å; F226-D231 HydrophobicContact CB-CB 4.47Å; F226-D231 WeakPolarHBondContact CB-OD2 3.49Å; F226-Y233 HydrophobicContact CB-CD1 3.64Å; F226-Y233 HydrophobicContact CB-CE1 3.82Å; F226-Y233 WeakPolarHBondContact O-CE1 3.21Å
227D69.4Low82.8Confident73 Ų7357.4 Ų57.439%0.3931%0.305SS..  trans-93.5124.7178.2-174.7-41.8000110.4M229 V230 D231D227-M229 PolarHBondContact O-N 3.22Å; D227-M229 WeakPolarHBondContact OD1-CA 3.16Å; D227-M229 VanDerWaalsContact OD1-CB 3.31Å; D227-M229 WeakPolarHBondContact OD1-CB 3.49Å; D227-M229 PolarHBondContact OD1-N 3.04Å; D227-V230 HydrophobicContact CB-CB 4.11Å; D227-V230 HydrophobicContact CB-CG2 3.99Å; D227-V230 PolarHBondContact O-N 3.16Å; D227-V230 VanDerWaalsContact O-N 3.13Å; D227-D231 PolarHBondContact N-OD2 3.36Å; D227-D231 PolarHBondContact O-N 2.84Å
228P65.4Low82.9Confident32 Ų3258.6 Ų58.621%0.20832%0.315CS..THydrogen-bonded Turntrans-61.9-23.4-178.123.7-32.7000114Y233 V234 T503P228-Y233 VanDerWaalsContact CA-CE1 3.41Å; P228-Y233 HydrophobicContact CB-CE1 3.92Å; P228-Y233 VanDerWaalsContact N-CE1 3.33Å; P228-V234 HydrophobicContact CB-CG2 3.74Å; P228-T503 HydrophobicContact CB-CG2 4.33Å
229M63.3Low83Confident104 Ų10463.1 Ų63.151%0.51234%0.343SS..THydrogen-bonded Turntrans-86.3-19.3179.2-58.6-65.315400113D227D227-M229 PolarHBondContact O-N 3.22Å; D227-M229 WeakPolarHBondContact OD1-CA 3.16Å; D227-M229 VanDerWaalsContact OD1-CB 3.31Å; D227-M229 WeakPolarHBondContact OD1-CB 3.49Å; D227-M229 PolarHBondContact OD1-N 3.04Å
230V63.3Low83.1Confident95 Ų9566.8 Ų66.858%0.57637%0.365SS*.THydrogen-bonded Turntrans-107.6-51-174.1-174.70000112.3D227 F232D227-V230 HydrophobicContact CB-CB 4.11Å; D227-V230 HydrophobicContact CB-CG2 3.99Å; D227-V230 PolarHBondContact O-N 3.16Å; D227-V230 VanDerWaalsContact O-N 3.13Å; V230-F232 VanDerWaalsContact C-N 3.26Å; V230-F232 VanDerWaalsContact O-CD2 3.28Å; V230-F232 WeakPolarHBondContact O-CD2 3.43Å; V230-F232 PolarHBondContact O-N 3.45Å
231D70.7Confident83.2Confident63 Ų6364.8 Ų64.834%0.33736%0.355SS..SBendtrans-82.7-0.9-167.5-67.5-57.8000114.4F226 D227 Y233 K236F226-D231 VanDerWaalsContact CA-OD2 3.31Å; F226-D231 WeakPolarHBondContact CA-OD2 3.26Å; F226-D231 HydrophobicContact CB-CB 4.47Å; F226-D231 WeakPolarHBondContact CB-OD2 3.49Å; D227-D231 PolarHBondContact N-OD2 3.36Å; D227-D231 PolarHBondContact O-N 2.84Å; D231-Y233 HydrophobicContact CB-CD1 4.18Å; D231-Y233 PolarHBondContact O-N 3.42Å; D231-K236 PolarHBondContact O-NZ 3.49Å
232F75Confident83.4Confident143 Ų14366 Ų6663%0.62737%0.369SS*.  trans51.617.7-172.1-69.3-92.7000114.1V230 V234 S235V230-F232 VanDerWaalsContact C-N 3.26Å; V230-F232 VanDerWaalsContact O-CD2 3.28Å; V230-F232 WeakPolarHBondContact O-CD2 3.43Å; V230-F232 PolarHBondContact O-N 3.45Å; F232-V234 VanDerWaalsContact C-N 3.26Å; F232-V234 PolarHBondContact O-N 2.97Å; F232-S235 PolarHBondContact O-N 3.47Å; F232-S235 PolarHBondContact O-OG 2.89Å
233Y84.5Confident83.8Confident17 Ų1764.6 Ų64.67%0.06737%0.371CS..Hα-helixtrans-64-30.3-168.175.6-109.2000112.9F217 P221 F226 P228 D231 S235 K236 S237F217-Y233 WeakPolarHBondContact O-CE2 3.28Å; F217-Y233 PolarHBondContact O-OH 3.16Å; F217-Y233 VanDerWaalsContact O-OH 3.06Å; P221-Y233 HydrophobicContact CB-CD1 4.23Å; P221-Y233 HydrophobicContact CB-CD2 3.96Å; P221-Y233 HydrophobicContact CB-CE1 3.7Å; P221-Y233 HydrophobicContact CB-CE2 3.48Å; P221-Y233 VanDerWaalsContact CB-CE2 3.48Å; P221-Y233 HydrophobicContact CB-CG 4.35Å; P221-Y233 HydrophobicContact CG-CD2 3.76Å; P221-Y233 HydrophobicContact CG-CE1 4.49Å; P221-Y233 HydrophobicContact CG-CE2 3.37Å; F226-Y233 HydrophobicContact CB-CD1 3.64Å; F226-Y233 HydrophobicContact CB-CE1 3.82Å; F226-Y233 WeakPolarHBondContact O-CE1 3.21Å; P228-Y233 VanDerWaalsContact CA-CE1 3.41Å; P228-Y233 HydrophobicContact CB-CE1 3.92Å; P228-Y233 VanDerWaalsContact N-CE1 3.33Å; D231-Y233 HydrophobicContact CB-CD1 4.18Å; D231-Y233 PolarHBondContact O-N 3.42Å; Y233-S235 PolarHBondContact O-N 3.43Å; Y233-S235 VanDerWaalsContact O-N 3.12Å; Y233-K236 CarbonylContact O-C 3.08Å; Y233-K236 WeakPolarHBondContact O-CA 3.36Å; Y233-K236 WeakPolarHBondContact O-CB 3.03Å; Y233-K236 PolarHBondContact O-N 3.3Å; Y233-S237 PolarHBondContact O-N 3.49Å
234V87.1Confident84Confident18 Ų1865.5 Ų65.511%0.10937%0.37CS..Hα-helixtrans-53-38.7179.7-171.50000110.9F217 P228 F232 K236 A238 L500 T503F217-V234 HydrophobicContact CD1-CG1 4.03Å; F217-V234 HydrophobicContact CE1-CG1 4Å; F217-V234 WeakPolarHBondContact CE1-O 3.4Å; P228-V234 HydrophobicContact CB-CG2 3.74Å; F232-V234 VanDerWaalsContact C-N 3.26Å; F232-V234 PolarHBondContact O-N 2.97Å; V234-K236 PolarHBondContact O-N 3.04Å; V234-A238 WeakPolarHBondContact O-CB 3.45Å; V234-A238 PolarHBondContact O-N 3.1Å; V234-L500 HydrophobicContact CG1-CD1 3.82Å; V234-T503 HydrophobicContact CG1-CG2 4.23Å; V234-T503 HydrophobicContact CG2-CG2 3.8Å
235S88.2Confident84.3Confident72 Ų7260.5 Ų60.550%0.50335%0.348SS..Hα-helixtrans-67-33.9175.569.50000113.7F232 Y233 V239F232-S235 PolarHBondContact O-N 3.47Å; F232-S235 PolarHBondContact O-OG 2.89Å; Y233-S235 PolarHBondContact O-N 3.43Å; Y233-S235 VanDerWaalsContact O-N 3.12Å; S235-V239 WeakPolarHBondContact O-CG2 3.49Å; S235-V239 PolarHBondContact O-N 3.25Å
236K90.7Very high84.9Confident128 Ų12863 Ų6356%0.55735%0.349SS*.Hα-helixtrans-74.5-47178.3-53.9169.1-171.6150.90110D231 Y233 V234 A238 V239 V240D231-K236 PolarHBondContact O-NZ 3.49Å; Y233-K236 CarbonylContact O-C 3.08Å; Y233-K236 WeakPolarHBondContact O-CA 3.36Å; Y233-K236 WeakPolarHBondContact O-CB 3.03Å; Y233-K236 PolarHBondContact O-N 3.3Å; V234-K236 PolarHBondContact O-N 3.04Å; K236-A238 VanDerWaalsContact C-N 3.31Å; K236-A238 PolarHBondContact O-N 3.46Å; K236-V239 WeakPolarHBondContact O-CB 3.32Å; K236-V239 PolarHBondContact O-N 3.17Å; K236-V240 PolarHBondContact O-N 3.04Å
237S92Very high85.5Confident17 Ų1766.5 Ų66.512%0.11936%0.364CS..Hα-helixtrans-59.5-38174.1-64.40000112.5L216 Y233 V239 V240 F241L216-S237 VanDerWaalsContact O-CB 3.29Å; L216-S237 WeakPolarHBondContact O-CB 3.23Å; L216-S237 PolarHBondContact O-OG 3.46Å; Y233-S237 PolarHBondContact O-N 3.49Å; S237-V239 VanDerWaalsContact C-N 3.29Å; S237-V239 PolarHBondContact O-N 2.86Å; S237-V240 WeakPolarHBondContact O-CB 3.39Å; S237-V240 PolarHBondContact O-N 3.24Å; S237-V240 VanDerWaalsContact O-N 3.16Å; S237-F241 PolarHBondContact O-N 2.97Å
238A93.6Very high86.5Confident25 Ų2563.2 Ų63.221%0.20735%0.346CS..Hα-helixtrans-64.3-32.117400000112.8F217 V234 K236 G242 F496F217-A238 HydrophobicContact CE1-CB 4.1Å; F217-A238 HydrophobicContact CZ-CB 4.11Å; V234-A238 WeakPolarHBondContact O-CB 3.45Å; V234-A238 PolarHBondContact O-N 3.1Å; K236-A238 VanDerWaalsContact C-N 3.31Å; K236-A238 PolarHBondContact O-N 3.46Å; A238-G242 PolarHBondContact O-N 2.74Å; A238-F496 HydrophobicContact CB-CZ 4.16Å
239V94.4Very high87.8Confident108 Ų10865.6 Ų65.666%0.65535%0.354SS*.Hα-helixtrans-72.9-33.6172.6171.90000111.7S235 K236 S237 G242 G243S235-V239 WeakPolarHBondContact O-CG2 3.49Å; S235-V239 PolarHBondContact O-N 3.25Å; K236-V239 WeakPolarHBondContact O-CB 3.32Å; K236-V239 PolarHBondContact O-N 3.17Å; S237-V239 VanDerWaalsContact C-N 3.29Å; S237-V239 PolarHBondContact O-N 2.86Å; V239-G242 PolarHBondContact O-N 3.26Å; V239-G243 PolarHBondContact O-N 3.02Å
240V95.2Very high89.1Confident76 Ų7664.1 Ų64.146%0.46135%0.35SS..Hα-helixtrans-61.7-47.9172.2178.40000110.5L216 K236 S237 G242 G243 F244L216-V240 HydrophobicContact CD1-CB 4.02Å; L216-V240 HydrophobicContact CD1-CG1 3.7Å; L216-V240 HydrophobicContact CD2-CG1 4.16Å; K236-V240 PolarHBondContact O-N 3.04Å; S237-V240 WeakPolarHBondContact O-CB 3.39Å; S237-V240 PolarHBondContact O-N 3.24Å; S237-V240 VanDerWaalsContact O-N 3.16Å; V240-G242 VanDerWaalsContact C-N 3.35Å; V240-G242 PolarHBondContact O-N 3.13Å; V240-G243 PolarHBondContact O-N 2.77Å; V240-F244 PolarHBondContact O-N 2.94Å
241F94.4Very high90.3Very high6 Ų663.6 Ų63.63%0.02634%0.341CS..Hα-helixtrans-58.7-45.5171.3-170.7-76.3000112.1Y212 S237 G243 F244 Y245 F496Y212-F241 AromaticContact CD1-CD2 3.49Å; Y212-F241 HydrophobicContact CD1-CD2 3.49Å; Y212-F241 VanDerWaalsContact CD1-CD2 3.49Å; Y212-F241 AromaticContact CD1-CE2 3.91Å; Y212-F241 HydrophobicContact CD1-CE2 3.91Å; Y212-F241 HydrophobicContact CD1-CG 4.49Å; Y212-F241 HydrophobicContact CE1-CB 4.18Å; Y212-F241 AromaticContact CE1-CD2 3.65Å; Y212-F241 HydrophobicContact CE1-CD2 3.65Å; Y212-F241 HydrophobicContact CE1-CE2 4.37Å; Y212-F241 HydrophobicContact CE1-CG 4.23Å; S237-F241 PolarHBondContact O-N 2.97Å; F241-G243 PolarHBondContact O-N 3.17Å; F241-F244 PolarHBondContact O-N 2.93Å; F241-Y245 HydrophobicContact CE1-CD2 4.39Å; F241-Y245 HydrophobicContact CE1-CG 4.34Å; F241-Y245 WeakPolarHBondContact O-CB 3.1Å; F241-Y245 PolarHBondContact O-N 2.89Å; F241-F496 HydrophobicContact CB-CD2 3.95Å; F241-F496 HydrophobicContact CB-CE2 3.56Å; F241-F496 HydrophobicContact CB-CZ 4.46Å; F241-F496 AromaticContact CD1-CD2 3.52Å; F241-F496 HydrophobicContact CD1-CD2 3.52Å; F241-F496 AromaticContact CD1-CE2 3.71Å; F241-F496 HydrophobicContact CD1-CE2 3.71Å; F241-F496 AromaticContact CD1-CG 3.95Å; F241-F496 HydrophobicContact CD1-CG 3.95Å; F241-F496 HydrophobicContact CD1-CZ 4.32Å; F241-F496 HydrophobicContact CD2-CB 4.43Å; F241-F496 AromaticContact CD2-CD2 3.35Å; F241-F496 HydrophobicContact CD2-CD2 3.35Å; F241-F496 AromaticContact CD2-CE2 3.91Å; F241-F496 HydrophobicContact CD2-CE2 3.91Å; F241-F496 HydrophobicContact CD2-CG 4.2Å; F241-F496 HydrophobicContact CE1-CB 3.96Å; F241-F496 HydrophobicContact CE1-CD1 4.5Å; F241-F496 AromaticContact CE1-CD2 3.83Å; F241-F496 HydrophobicContact CE1-CD2 3.83Å; F241-F496 HydrophobicContact CE1-CE2 4.43Å; F241-F496 AromaticContact CE1-CG 3.84Å; F241-F496 HydrophobicContact CE1-CG 3.84Å; F241-F496 HydrophobicContact CE2-CB 3.87Å; F241-F496 AromaticContact CE2-CD2 3.69Å; F241-F496 HydrophobicContact CE2-CD2 3.69Å; F241-F496 HydrophobicContact CE2-CG 4.12Å; F241-F496 AromaticContact CG-CD2 3.3Å; F241-F496 HydrophobicContact CG-CD2 3.3Å; F241-F496 AromaticContact CG-CE2 3.44Å; F241-F496 HydrophobicContact CG-CE2 3.44Å; F241-F496 VanDerWaalsContact CG-CE2 3.44Å; F241-F496 HydrophobicContact CG-CG 4.17Å; F241-F496 HydrophobicContact CG-CZ 4.41Å; F241-F496 HydrophobicContact CZ-CB 3.63Å; F241-F496 AromaticContact CZ-CD2 3.93Å; F241-F496 HydrophobicContact CZ-CD2 3.93Å; F241-F496 AromaticContact CZ-CG 3.95Å; F241-F496 HydrophobicContact CZ-CG 3.95Å
242G95.1Very high91Very high34 Ų3460.8 Ų60.835%0.35133%0.326SS..Hα-helixtrans-56.9-35.4177.200000113.2A238 V239 V240 L246A238-G242 PolarHBondContact O-N 2.74Å; V239-G242 PolarHBondContact O-N 3.26Å; V240-G242 VanDerWaalsContact C-N 3.35Å; V240-G242 PolarHBondContact O-N 3.13Å; G242-L246 WeakPolarHBondContact O-CB 3.46Å; G242-L246 PolarHBondContact O-N 2.9Å
243G95.9Very high91.5Very high31 Ų3156.3 Ų56.332%0.3231%0.311SS..Hα-helixtrans-64.3-53.4172.900000112.7V239 V240 F241 Y245 L246 F247V239-G243 PolarHBondContact O-N 3.02Å; V240-G243 PolarHBondContact O-N 2.77Å; F241-G243 PolarHBondContact O-N 3.17Å; G243-Y245 PolarHBondContact O-N 3.06Å; G243-L246 PolarHBondContact O-N 3.19Å; G243-F247 WeakPolarHBondContact O-CD2 3.48Å; G243-F247 PolarHBondContact O-N 3.35Å; G243-F247 VanDerWaalsContact O-N 3.16Å
244F94.1Very high91.6Very high39 Ų3960.2 Ų60.217%0.17133%0.332CS..Hα-helixtrans-55.1-51175.2162.2-107000111.8I208 Y212 V240 F241 L246 F247 F248 L459 F463I208-F244 HydrophobicContact CG2-CZ 4.45Å; Y212-F244 HydrophobicContact CE1-CB 4.48Å; Y212-F244 HydrophobicContact CE1-CD1 4.3Å; V240-F244 PolarHBondContact O-N 2.94Å; F241-F244 PolarHBondContact O-N 2.93Å; F244-L246 VanDerWaalsContact C-N 3.35Å; F244-L246 PolarHBondContact O-N 3.33Å; F244-F247 PolarHBondContact O-N 2.96Å; F244-F248 PolarHBondContact O-N 2.82Å; F244-L459 HydrophobicContact CD2-CD2 4.23Å; F244-L459 HydrophobicContact CE2-CD2 3.74Å; F244-L459 HydrophobicContact CZ-CD2 4.1Å; F244-F463 HydrophobicContact CE2-CD2 4.27Å; F244-F463 AromaticContact CE2-CE2 3.99Å; F244-F463 HydrophobicContact CE2-CE2 3.99Å; F244-F463 HydrophobicContact CE2-CZ 4.37Å; F244-F463 AromaticContact CZ-CD2 3.83Å; F244-F463 HydrophobicContact CZ-CD2 3.83Å; F244-F463 AromaticContact CZ-CE2 3.73Å; F244-F463 HydrophobicContact CZ-CE2 3.73Å
245Y95Very high91.4Very high49 Ų4964.3 Ų64.319%0.19235%0.348CS..Hα-helixtrans-62.6-37.9179.8178.3-95.3000112.6F241 G243 F248 F249 N489 L493F241-Y245 HydrophobicContact CE1-CD2 4.39Å; F241-Y245 HydrophobicContact CE1-CG 4.34Å; F241-Y245 WeakPolarHBondContact O-CB 3.1Å; F241-Y245 PolarHBondContact O-N 2.89Å; G243-Y245 PolarHBondContact O-N 3.06Å; Y245-F248 HydrophobicContact CD2-CD1 4.24Å; Y245-F248 HydrophobicContact CE2-CD1 4.39Å; Y245-F248 PolarHBondContact O-N 2.99Å; Y245-F249 HydrophobicContact CE1-CB 4.43Å; Y245-F249 HydrophobicContact CE1-CD2 4.47Å; Y245-F249 WeakPolarHBondContact O-CB 3.48Å; Y245-F249 PolarHBondContact O-N 3.06Å; Y245-N489 WeakPolarHBondContact CE2-OD1 3.22Å; Y245-N489 PolarHBondContact OH-OD1 3.38Å; Y245-L493 HydrophobicContact CD2-CD2 4.12Å; Y245-L493 HydrophobicContact CE1-CD2 4.44Å; Y245-L493 HydrophobicContact CE2-CD1 4.32Å; Y245-L493 HydrophobicContact CE2-CD2 3.75Å; Y245-L493 HydrophobicContact CE2-CG 3.96Å
246L94.9Very high90.9Very high103 Ų10362.5 Ų62.554%0.53933%0.334SS..Hα-helixtrans-62.6-42.6176177.663.3000112G242 G243 F244 T250G242-L246 WeakPolarHBondContact O-CB 3.46Å; G242-L246 PolarHBondContact O-N 2.9Å; G243-L246 PolarHBondContact O-N 3.19Å; F244-L246 VanDerWaalsContact C-N 3.35Å; F244-L246 PolarHBondContact O-N 3.33Å; L246-T250 VanDerWaalsContact O-CB 3.25Å; L246-T250 WeakPolarHBondContact O-CB 3.36Å; L246-T250 PolarHBondContact O-N 3.48Å; L246-T250 PolarHBondContact O-OG1 3.15Å
247F93.2Very high90.5Very high163 Ų16361.3 Ų61.372%0.71533%0.333SS*.Hα-helixtrans-66.5-47.8176.3-86.8-80.4000111.6G243 F244 F249 T250 E251G243-F247 WeakPolarHBondContact O-CD2 3.48Å; G243-F247 PolarHBondContact O-N 3.35Å; G243-F247 VanDerWaalsContact O-N 3.16Å; F244-F247 PolarHBondContact O-N 2.96Å; F247-F249 PolarHBondContact O-N 2.68Å; F247-T250 PolarHBondContact O-N 3.38Å; F247-E251 WeakPolarHBondContact O-CB 3.4Å; F247-E251 PolarHBondContact O-N 3.16Å
248F91.1Very high89.9Confident5 Ų565.3 Ų65.32%0.02235%0.353CS..Hα-helixtrans-53.4-51.3173.6163.1-99.5000112.2F244 Y245 T250 E251 K252 F463 M466 Q488 L492F244-F248 PolarHBondContact O-N 2.82Å; Y245-F248 HydrophobicContact CD2-CD1 4.24Å; Y245-F248 HydrophobicContact CE2-CD1 4.39Å; Y245-F248 PolarHBondContact O-N 2.99Å; F248-T250 PolarHBondContact O-N 2.91Å; F248-E251 PolarHBondContact O-N 3.23Å; F248-K252 HydrophobicContact CD2-CG 4.22Å; F248-K252 HydrophobicContact CE2-CD 4.33Å; F248-K252 HydrophobicContact CE2-CG 3.99Å; F248-K252 HydrophobicContact CZ-CG 4.22Å; F248-K252 WeakPolarHBondContact O-CB 3.47Å; F248-K252 VanDerWaalsContact O-CG 3.22Å; F248-K252 WeakPolarHBondContact O-CG 3.4Å; F248-K252 PolarHBondContact O-N 3.26Å; F248-F463 AromaticContact CD2-CE2 3.58Å; F248-F463 HydrophobicContact CD2-CE2 3.58Å; F248-F463 AromaticContact CD2-CZ 3.79Å; F248-F463 HydrophobicContact CD2-CZ 3.79Å; F248-F463 HydrophobicContact CE2-CE2 4.08Å; F248-F463 HydrophobicContact CG-CE2 4.38Å; F248-M466 HydrophobicContact CE2-CE 3.84Å; F248-M466 HydrophobicContact CZ-CE 4.41Å; F248-Q488 HydrophobicContact CZ-CB 4.13Å; F248-L492 HydrophobicContact CD1-CD1 4.13Å; F248-L492 HydrophobicContact CE1-CD1 3.58Å; F248-L492 HydrophobicContact CE2-CD1 4.16Å; F248-L492 HydrophobicContact CZ-CD1 3.59Å
249F91.7Very high88.7Confident82 Ų8268.5 Ų68.536%0.3636%0.362SS..Hα-helixtrans-62-43.1180-176-90000111.5Y245 F247 K252 V253 F485Y245-F249 HydrophobicContact CE1-CB 4.43Å; Y245-F249 HydrophobicContact CE1-CD2 4.47Å; Y245-F249 WeakPolarHBondContact O-CB 3.48Å; Y245-F249 PolarHBondContact O-N 3.06Å; F247-F249 PolarHBondContact O-N 2.68Å; F249-K252 PolarHBondContact O-N 3.36Å; F249-V253 HydrophobicContact CD1-CG2 3.98Å; F249-V253 HydrophobicContact CE1-CG2 3.68Å; F249-V253 HydrophobicContact CE2-CG2 4.49Å; F249-V253 HydrophobicContact CZ-CG2 3.96Å; F249-V253 WeakPolarHBondContact O-CB 3.08Å; F249-V253 WeakPolarHBondContact O-CG2 3.37Å; F249-V253 PolarHBondContact O-N 3.1Å; F249-F485 AromaticContact CD2-CZ 3.79Å; F249-F485 HydrophobicContact CD2-CZ 3.79Å; F249-F485 HydrophobicContact CE2-CE1 4.32Å; F249-F485 AromaticContact CE2-CZ 3.78Å; F249-F485 HydrophobicContact CE2-CZ 3.78Å
250T90.1Very high87.3Confident72 Ų7269.9 Ų69.944%0.44236%0.362SS..Hα-helixtrans-64.8-43.7178.8-590000111.8L246 F247 F248 V253 L254L246-T250 VanDerWaalsContact O-CB 3.25Å; L246-T250 WeakPolarHBondContact O-CB 3.36Å; L246-T250 PolarHBondContact O-N 3.48Å; L246-T250 PolarHBondContact O-OG1 3.15Å; F247-T250 PolarHBondContact O-N 3.38Å; F248-T250 PolarHBondContact O-N 2.91Å; T250-V253 PolarHBondContact O-N 3.39Å; T250-L254 VanDerWaalsContact O-CB 3.3Å; T250-L254 WeakPolarHBondContact O-CB 3.22Å; T250-L254 PolarHBondContact O-N 3.37Å
251E88.9Confident85.5Confident84 Ų8474 Ų7439%0.39337%0.373SS..Hα-helixtrans-61.6-45.8177.2-168.7-152.2113.700111.4F247 F248 L254 K255F247-E251 WeakPolarHBondContact O-CB 3.4Å; F247-E251 PolarHBondContact O-N 3.16Å; F248-E251 PolarHBondContact O-N 3.23Å; E251-L254 PolarHBondContact O-N 3.29Å; E251-K255 WeakPolarHBondContact O-CG 3.19Å; E251-K255 PolarHBondContact O-N 3.14Å; E251-K255 VanDerWaalsContact OE1-CE 3.28Å; E251-K255 WeakPolarHBondContact OE1-CE 3.4Å; E251-K255 IonicContact OE1-NZ 2.72Å; E251-K255 PolarHBondContact OE1-NZ 2.88Å
252K85.2Confident83.6Confident5 Ų581.4 Ų81.42%0.02241%0.408CS..Hα-helixtrans-65.1-43.9178.2-67.6-81.7174.2156.50112F248 F249 K255 V256 N467 F485F248-K252 HydrophobicContact CD2-CG 4.22Å; F248-K252 HydrophobicContact CE2-CD 4.33Å; F248-K252 HydrophobicContact CE2-CG 3.99Å; F248-K252 HydrophobicContact CZ-CG 4.22Å; F248-K252 WeakPolarHBondContact O-CB 3.47Å; F248-K252 VanDerWaalsContact O-CG 3.22Å; F248-K252 WeakPolarHBondContact O-CG 3.4Å; F248-K252 PolarHBondContact O-N 3.26Å; F249-K252 PolarHBondContact O-N 3.36Å; K252-K255 WeakPolarHBondContact O-CB 3.25Å; K252-K255 PolarHBondContact O-N 3.31Å; K252-V256 WeakPolarHBondContact O-CG2 3.21Å; K252-V256 PolarHBondContact O-N 3Å; K252-N467 VanDerWaalsContact CE-OD1 3.23Å; K252-N467 WeakPolarHBondContact CE-OD1 3.43Å; K252-N467 PolarHBondContact NZ-OD1 3.33Å; K252-F485 HydrophobicContact CB-CD2 3.71Å; K252-F485 HydrophobicContact CB-CE2 3.34Å; K252-F485 HydrophobicContact CB-CZ 4.3Å; K252-F485 HydrophobicContact CD-CD2 4.22Å; K252-F485 HydrophobicContact CG-CD2 4.06Å; K252-F485 HydrophobicContact CG-CE2 3.91Å
253V86.5Confident81.5Confident49 Ų4983 Ų8330%0.29743%0.425SS..Hα-helixtrans-64.1-39.9175.7168.50000111.3F249 T250 K255 V256 L257 F485F249-V253 HydrophobicContact CD1-CG2 3.98Å; F249-V253 HydrophobicContact CE1-CG2 3.68Å; F249-V253 HydrophobicContact CE2-CG2 4.49Å; F249-V253 HydrophobicContact CZ-CG2 3.96Å; F249-V253 WeakPolarHBondContact O-CB 3.08Å; F249-V253 WeakPolarHBondContact O-CG2 3.37Å; F249-V253 PolarHBondContact O-N 3.1Å; T250-V253 PolarHBondContact O-N 3.39Å; V253-K255 PolarHBondContact O-N 3.09Å; V253-V256 WeakPolarHBondContact O-CB 3.38Å; V253-V256 PolarHBondContact O-N 2.87Å; V253-L257 HydrophobicContact CG1-CD1 3.95Å; V253-L257 HydrophobicContact CG1-CG 4.43Å; V253-L257 WeakPolarHBondContact O-CG 3.5Å; V253-L257 PolarHBondContact O-N 3.24Å; V253-F485 HydrophobicContact CG2-CZ 4.45Å
254L86.5Confident78.8Confident98 Ų9885.6 Ų85.651%0.51344%0.438SS..Hα-helixtrans-62.4-42.7174.3-178.460.1000111.4T250 E251 V256 L257 L258T250-L254 VanDerWaalsContact O-CB 3.3Å; T250-L254 WeakPolarHBondContact O-CB 3.22Å; T250-L254 PolarHBondContact O-N 3.37Å; E251-L254 PolarHBondContact O-N 3.29Å; L254-V256 PolarHBondContact O-N 2.68Å; L254-L257 PolarHBondContact O-N 2.99Å; L254-L258 HydrophobicContact CD1-CD1 3.99Å; L254-L258 HydrophobicContact CD1-CG 4.12Å; L254-L258 HydrophobicContact CG-CD1 3.94Å; L254-L258 HydrophobicContact CG-CG 4.48Å; L254-L258 WeakPolarHBondContact O-CB 3.4Å; L254-L258 VanDerWaalsContact O-CG 3.31Å; L254-L258 WeakPolarHBondContact O-CG 3.26Å; L254-L258 PolarHBondContact O-N 3.41Å
255K81.8Confident76.2Confident104 Ų10491.8 Ų91.845%0.45247%0.467SS..Hα-helixtrans-58.1-43.6172.7-76.5171.2172.6175.40112E251 K252 V253 K259E251-K255 WeakPolarHBondContact O-CG 3.19Å; E251-K255 PolarHBondContact O-N 3.14Å; E251-K255 VanDerWaalsContact OE1-CE 3.28Å; E251-K255 WeakPolarHBondContact OE1-CE 3.4Å; E251-K255 IonicContact OE1-NZ 2.72Å; E251-K255 PolarHBondContact OE1-NZ 2.88Å; K252-K255 WeakPolarHBondContact O-CB 3.25Å; K252-K255 PolarHBondContact O-N 3.31Å; V253-K255 PolarHBondContact O-N 3.09Å; K255-K259 VanDerWaalsContact O-CB 3.25Å; K255-K259 WeakPolarHBondContact O-CB 3.42Å; K255-K259 PolarHBondContact O-N 2.68Å
256V78Confident73.2Confident35 Ų3594.3 Ų94.321%0.21249%0.492CS..Hα-helixtrans-57.3-54.1173.4176.20000111.5K252 V253 L254 L258 K259 Q260 F481K252-V256 WeakPolarHBondContact O-CG2 3.21Å; K252-V256 PolarHBondContact O-N 3Å; V253-V256 WeakPolarHBondContact O-CB 3.38Å; V253-V256 PolarHBondContact O-N 2.87Å; L254-V256 PolarHBondContact O-N 2.68Å; V256-L258 VanDerWaalsContact C-N 3.32Å; V256-L258 PolarHBondContact O-N 2.99Å; V256-K259 PolarHBondContact O-N 3.13Å; V256-Q260 WeakPolarHBondContact O-CB 3.48Å; V256-Q260 PolarHBondContact O-N 3.01Å; V256-F481 HydrophobicContact CG2-CD1 3.64Å; V256-F481 HydrophobicContact CG2-CE1 3.11Å; V256-F481 HydrophobicContact CG2-CE2 4.48Å; V256-F481 HydrophobicContact CG2-CZ 3.62Å
257L81.9Confident70.7Confident102 Ų10298.6 Ų98.653%0.53451%0.509SS..Hα-helixtrans-63.9-36.5-172.9-68.4170.6000112.3V253 L254 K261V253-L257 HydrophobicContact CG1-CD1 3.95Å; V253-L257 HydrophobicContact CG1-CG 4.43Å; V253-L257 WeakPolarHBondContact O-CG 3.5Å; V253-L257 PolarHBondContact O-N 3.24Å; L254-L257 PolarHBondContact O-N 2.99Å; L257-K261 PolarHBondContact O-N 3.13Å
258L80.6Confident68Low102 Ų10296.2 Ų96.253%0.53451%0.512SS..Hα-helixtrans-71.5-44.9175.6-66.6172.7000112L254 V256 Q260 K261 Q262L254-L258 HydrophobicContact CD1-CD1 3.99Å; L254-L258 HydrophobicContact CD1-CG 4.12Å; L254-L258 HydrophobicContact CG-CD1 3.94Å; L254-L258 HydrophobicContact CG-CG 4.48Å; L254-L258 WeakPolarHBondContact O-CB 3.4Å; L254-L258 VanDerWaalsContact O-CG 3.31Å; L254-L258 WeakPolarHBondContact O-CG 3.26Å; L254-L258 PolarHBondContact O-N 3.41Å; V256-L258 VanDerWaalsContact C-N 3.32Å; V256-L258 PolarHBondContact O-N 2.99Å; L258-Q260 VanDerWaalsContact C-N 3.33Å; L258-Q260 PolarHBondContact O-N 3.43Å; L258-K261 PolarHBondContact O-N 2.97Å; L258-K261 VanDerWaalsContact O-N 3.15Å; L258-Q262 PolarHBondContact O-N 3.41Å
259K69.3Low65.7Low92 Ų92104.9 Ų104.940%0.455%0.553SS.*Hα-helixtrans-63.2-38.6178.7-159.9159.9-178.91650110.9K255 V256 Q262 G263 E474K255-K259 VanDerWaalsContact O-CB 3.25Å; K255-K259 WeakPolarHBondContact O-CB 3.42Å; K255-K259 PolarHBondContact O-N 2.68Å; V256-K259 PolarHBondContact O-N 3.13Å; K259-Q262 PolarHBondContact O-N 3.37Å; K259-G263 PolarHBondContact O-N 3.02Å; K259-E474 IonicContact NZ-OE2 2.7Å; K259-E474 PolarHBondContact NZ-OE2 3.18Å
260Q63.4Low62.7Low137 Ų137112 Ų11264%0.6458%0.579SS**Hα-helixtrans-65.1-37173.4-171.8176.51.100113V256 L258 Q262 G263V256-Q260 WeakPolarHBondContact O-CB 3.48Å; V256-Q260 PolarHBondContact O-N 3.01Å; L258-Q260 VanDerWaalsContact C-N 3.33Å; L258-Q260 PolarHBondContact O-N 3.43Å; Q260-Q262 PolarHBondContact O-N 2.87Å; Q260-G263 PolarHBondContact O-N 3.31Å
261K57.9Low60.1Low162 Ų162114 Ų11470%0.70460%0.595SS**Hα-helixtrans-66.8-34.7179.7-169.8178179.8-176.30112.8L257 L258L257-K261 PolarHBondContact O-N 3.13Å; L258-K261 PolarHBondContact O-N 2.97Å; L258-K261 VanDerWaalsContact O-N 3.15Å
262Q55.2Low57.3Low161 Ų161113.4 Ų113.475%0.75261%0.612SS**Hα-helixtrans-70.6-34.3175.4-72.2178.6-26.600112.5L258 K259 Q260 S264L258-Q262 PolarHBondContact O-N 3.41Å; K259-Q262 PolarHBondContact O-N 3.37Å; Q260-Q262 PolarHBondContact O-N 2.87Å; Q262-S264 PolarHBondContact O-N 3.36Å
263G50.5Low54.9Low68 Ų68117.3 Ų117.370%0.70165%0.645SS**THydrogen-bonded Turntrans-67.7-11.3-179.900000116K259 Q260K259-G263 PolarHBondContact O-N 3.02Å; Q260-G263 PolarHBondContact O-N 3.31Å
264S40.2Very low52.4Low85 Ų85122.6 Ų122.659%0.59467%0.672SS**THydrogen-bonded Turntrans-91.1-5.2-171.5-166.90000115.6Q262Q262-S264 PolarHBondContact O-N 3.36Å
265H39.4Very low49.8Very low169 Ų169125.5 Ų125.578%0.78268%0.682SS**  trans-140.659.9-170.9-68.4-56.9000113.6
266S31.3Very low47.3Very low103 Ų103130.4 Ų130.472%0.7270%0.7SS**  trans-12965.3171.3-157.30000112.7
267H42.9Very low45Very low193 Ų193134.3 Ų134.389%0.89473%0.729SS**  trans-135.974170.1-74.3-38.6000110.3
268S35.6Very low42.5Very low113 Ų113134 Ų13479%0.7974%0.741SS**  trans-122.4105.1168.455.40000109.3Y270S268-Y270 PolarHBondContact O-N 2.87Å
269H42Very low40.6Very low187 Ų187134.6 Ų134.687%0.86675%0.751SS**  trans-68.7128.6171.5-69.8-101.5000109.9
270Y30.2Very low38.8Very low231 Ų231135.9 Ų135.991%0.90676%0.762SS**  trans-143.4157.2145.9-143.7-97.7000110.2S268S268-Y270 PolarHBondContact O-N 2.87Å
271S34.2Very low37.2Very low113 Ų113139 Ų13979%0.7977%0.768SS**  trans-146.6148.1-173.2-173.50000109.6
272G31.3Very low35.9Very low73 Ų73138 Ų13875%0.75377%0.771SS**  trans122.2134.117900000112.9
273A35.3Very low34.7Very low87 Ų87134.7 Ų134.772%0.71977%0.771SS**  trans-75.3162.7175.700000111.6
274D32.1Very low33.8Very low160 Ų160140.8 Ų140.886%0.85678%0.781SS**  -175.2-174.592.7-105.3-45.1000113.8
275H32.8Very low33.3Very low158 Ų158145.8 Ų145.873%0.73180%0.795SS**  trans-77.4150.9-162.2-109.1-114000117.6
276Y29.9Very low32.7Very low207 Ų207141.3 Ų141.381%0.81280%0.795SS**  trans51.2120.9144.9-100.8-116.3000120.9
277S29.1Very low32.7Very low118 Ų118144.6 Ų144.683%0.82580%0.799SS**  173.6150.7107.6-73.70000113
278A29.7Very low32Very low95 Ų95143.9 Ų143.979%0.78579%0.793SS**  trans-124.9161.516100000107.6
279P41Very low31.6Very low115 Ų115146.1 Ų146.175%0.74780%0.795SS**  -15217573.241-21.5000117.9
280D30.2Very low31Very low119 Ų119145 Ų14564%0.63679%0.79SS**  trans65.4125.2148-89.4-48.9000123.5
281R30.5Very low30.9Very low201 Ų201142.5 Ų142.576%0.75879%0.787SS**  trans72.5147.1138.1-72165.2-151.5-126.5-0.9119.8
282D29.9Very low30.7Very low143 Ų143144.8 Ų144.877%0.76579%0.79SS**  cis-130.5144.11.6-77.9-56.8000108.3
283A30.3Very low30.5Very low91 Ų91144.9 Ų144.975%0.75279%0.791SS**  84.5101.163.800000115.6
284E31.3Very low30.2Very low195 Ų195150.1 Ų150.191%0.91180%0.801SS**  trans160.898.1158.5-97.4-175.9175.300105.7
285E29.9Very low30.1Very low190 Ų190147.8 Ų147.889%0.88880%0.803SS**  89.2136.757.2-164.9160.7-103.600113.5
286G27.6Very low29.8Very low76 Ų76144 Ų14478%0.78481%0.807SS**  trans158.894.5-167.100000110.3
287E30.3Very low29.5Very low172 Ų172137.8 Ų137.880%0.80481%0.806SS**  trans-78.3150.4-153.6-63.1171.295.300116.1
288K29.3Very low29.3Very low177 Ų177140.6 Ų140.677%0.7781%0.811SS**  trans-89.1148.6151-71-177.7174.6-173.90108.8
289L26.6Very low29.1Very low160 Ų160140.3 Ų140.384%0.83881%0.809SS**  trans-127.5113.4150.4-139.976.2000110.1
290Q29.3Very low28.3Very low165 Ų165144.3 Ų144.377%0.77182%0.817SS**  trans-122.3110.2175.4-173.7171.54.200106.3N292Q290-N292 PolarHBondContact O-N 3.13Å
291Q27.6Very low28Very low177 Ų177142.2 Ų142.283%0.82782%0.824SS**  trans-93.290.3-157-167.717042.300112.6
292N29.8Very low27.6Very low162 Ų162142.1 Ų142.187%0.86683%0.829SS**  trans-71.6138.2156.1-90.111.7000109.3Q290Q290-N292 PolarHBondContact O-N 3.13Å
293G28.6Very low27.2Very low75 Ų75140.7 Ų140.777%0.77383%0.825SS**  trans-122.6100.8178.500000112.3
294E29Very low27Very low197 Ų197143.1 Ų143.192%0.92183%0.825SS**  trans-128.7123.1164.2-74.6-165.8105.800110.4
295A28.3Very low26.6Very low110 Ų110142.2 Ų142.291%0.90982%0.821SS**  trans-156.2134168.200000108.6
296G27.3Very low26.3Very low79 Ų79137.3 Ų137.381%0.81481%0.813SS**  cis-161.8164.1-6.200000110.6
297G23.5Very low26.2Very low76 Ų76138.7 Ų138.778%0.78481%0.811SS**  trans-96.8178.8-174.300000115.1
298L24.2Very low26Very low177 Ų177139.6 Ų139.693%0.92782%0.815SS**  trans-157.7167.5158.5-139.379.5000110.9
299A25.8Very low25.9Very low89 Ų89135 Ų13574%0.73682%0.817SS**  trans73.549.7164.700000119.8
300Q24.2Very low25.9Very low200 Ų200136.6 Ų136.694%0.93582%0.821SS**  22.6123.6118.3-178.8179.5-1.600119.4
301G23.7Very low25.7Very low74 Ų74136.7 Ų136.776%0.76383%0.825SS**  trans-178.793.2163.400000118
302K22.6Very low25.5Very low200 Ų200136.1 Ų136.187%0.8783%0.825SS**  trans43.7120.5156.7-79.4-167.8163.5-167.80120.3
303V23Very low25.2Very low112 Ų112136.7 Ų136.768%0.67983%0.827SS**  103.7149.454.4153.60000111.5
304D24.3Very low24.9Very low142 Ų142138.4 Ų138.476%0.75983%0.827SS**  trans73.9141.4-178.5-49.2-33.1000116.2
305E24.1Very low25.2Very low177 Ų177134.8 Ų134.883%0.82782%0.821SS**  cis-161.5161-31.4-146.9-171.6131.400110.6
306A24.3Very low25Very low86 Ų86133.1 Ų133.171%0.71181%0.814SS**  trans68.8139.9150.700000124.3
307S24.4Very low24.9Very low106 Ų106139 Ų13974%0.74182%0.821SS**  trans86.290.3143.7-149.90000122
308E26.1Very low24.9Very low191 Ų191139.8 Ų139.889%0.89382%0.819SS**  30.6132.4122.4-55.7-174.8131.900121.8
309G26.5Very low25.3Very low80 Ų80136.9 Ų136.983%0.82581%0.811SS**  trans174.6101.9161.900000114.3
310E26.9Very low25.3Very low193 Ų193142.2 Ų142.290%0.90282%0.821SS**  trans-72.1138.2167-69178.774.300111.5
311L25.6Very low25.2Very low167 Ų167141.3 Ų141.387%0.87482%0.817SS**  -165.6149.1120.2-137.368000112.6
312M22.7Very low25.2Very low166 Ų166143.2 Ų143.282%0.81882%0.818SS**  trans-99.7171.8164.2-63.9-169.18000111.2
313L23.7Very low25.4Very low173 Ų173142.6 Ų142.691%0.90682%0.818SS**  trans99.4132160.5-55.6169.1000118.1
314S23Very low25.5Very low111 Ų111148.6 Ų148.678%0.77683%0.829SS**  trans-85.7-171.6167.8-22.80000110.5
315P35Very low26.2Very low122 Ų122147.2 Ų147.279%0.79283%0.827SS**  cis-133.1147-16.931.4-13000114.8
316G23.9Very low26.4Very low74 Ų74145.5 Ų145.576%0.76382%0.824SS**  trans73.4116.9137.500000120.1
317Q25.6Very low26.6Very low204 Ų204146 Ų14695%0.95382%0.822SS**  trans-157.2144.4145-114.9161.6-4.400111.5
318A22.7Very low26.9Very low92 Ų92146 Ų14676%0.7683%0.829SS**  trans-129.2170.3164.700000106.8
319P34.3Very low27Very low115 Ų115142 Ų14275%0.74783%0.829SS**  cis-127.7177.1-0.742.1-28.7000113.5
320Q24.5Very low27.2Very low201 Ų201143 Ų14394%0.93983%0.829SS**  trans-162.2166.6139.2-113.8164.720.400112.4
321E22.6Very low27.3Very low182 Ų182138.3 Ų138.385%0.8582%0.823SS**  trans-130.7161.7-165-146.3-177.3141.300111
322S23.6Very low27.5Very low114 Ų114142.3 Ų142.380%0.79783%0.827SS**  trans69.4152.8-177.880.10000115.4
323E27.4Very low27.8Very low186 Ų186140.4 Ų140.487%0.86983%0.83SS**  cis-129.2172.411.6-68.1-178.3102.700114
324R25.1Very low28.3Very low238 Ų238135.9 Ų135.990%0.89883%0.825SS**  trans-129.1160.6162.7-90.1-169.6-177.9-169.72.5106.7
325P39.3Very low28.6Very low113 Ų113134 Ų13473%0.73482%0.823SS**  cis-140.2-149.633.642.4-20000111.5
326D27.3Very low29Very low141 Ų141140.4 Ų140.475%0.75483%0.831SS**  cis-165.2168-9.6-137.136.7000106.7
327S28.2Very low29.5Very low97 Ų97140.2 Ų140.268%0.67883%0.83SS**  cis-159.9162.8-32.144.20000109.4
328A30.2Very low30.1Very low107 Ų107134.9 Ų134.988%0.88483%0.829SS**  trans-152.9147.7162.500000109
329A29.1Very low30.9Very low107 Ų107133.9 Ų133.988%0.88483%0.827SS**  trans-131.8142-166.300000114.4
330A30.4Very low31.2Very low101 Ų101132 Ų13284%0.83582%0.816SS**  trans-141.7120164.200000112.2
331A29.4Very low32.4Very low94 Ų94131.3 Ų131.378%0.77781%0.806SS**  trans-20121.7164.100000116.9
332R30Very low33.5Very low250 Ų250129.2 Ų129.294%0.94379%0.791SS**  86.495.179.9-81.7-177.5166.6-171.6-2.2115.5
333S29.1Very low34.8Very low127 Ų127128.9 Ų128.989%0.88878%0.779SS**  trans-158.4141.6139.9-174.40000107.3
334G33.8Very low35.5Very low77 Ų77129.4 Ų129.479%0.79478%0.779SS**  cis135.7-17.27.400000112.7
335G29Very low36.4Very low72 Ų72120.2 Ų120.274%0.74276%0.758SS**  trans-89.6121.2-179.200000114.2G337G335-G337 PolarHBondContact O-N 3.24Å; G335-G337 VanDerWaalsContact O-N 3.16Å
336R42.6Very low36.6Very low257 Ų257119.7 Ų119.797%0.9775%0.753SS**  trans-79.883.2163.7-76.9165.163.4175.8-0.3109.3
337G35.6Very low37.3Very low70 Ų70118 Ų11872%0.72275%0.748SS**  trans-102.8121.8174.200000111.9G335 G339G335-G337 PolarHBondContact O-N 3.24Å; G335-G337 VanDerWaalsContact O-N 3.16Å; G337-G339 PolarHBondContact O-N 3.46Å
338G37.6Very low38.4Very low92 Ų92118.7 Ų118.795%0.94874%0.737SS**  trans-76.965172.900000112.2
339G40.9Very low39.3Very low70 Ų70118.9 Ų118.972%0.72273%0.731SS**  trans-68.2132.2177.400000111.7G337 Y341G337-G339 PolarHBondContact O-N 3.46Å; G339-Y341 PolarHBondContact O-N 3.09Å
340C40.3Very low40.4Very low76 Ų76120.4 Ų120.451%0.51473%0.725SS.*  trans-66.8125.1-178.7-143.80000110.4W342 L343C340-W342 PolarHBondContact O-N 3.15Å; C340-W342 VanDerWaalsContact O-N 3.08Å; C340-W342 VanDerWaalsContact SG-CD1 3.59Å; C340-L343 HydrophobicContact CB-CD1 4.39Å; C340-L343 PolarHBondContact O-N 3.13Å; C340-L343 VanDerWaalsContact O-N 3.11Å
341Y49.8Very low41.6Very low186 Ų186116.5 Ų116.573%0.72969%0.689SS**G310 helixtrans-64.3-18.3-17253.9-94.6000114.2G339 L343G339-Y341 PolarHBondContact O-N 3.09Å; Y341-L343 VanDerWaalsContact C-N 3.26Å; Y341-L343 PolarHBondContact O-N 2.93Å
342W44.1Very low43Very low138 Ų138113.6 Ų113.652%0.52367%0.669SS.*G310 helixtrans-64.1-23.8174.2-56.883.1000114C340 K344 Q414C340-W342 PolarHBondContact O-N 3.15Å; C340-W342 VanDerWaalsContact O-N 3.08Å; C340-W342 VanDerWaalsContact SG-CD1 3.59Å; W342-K344 PolarHBondContact O-N 3.14Å; W342-Q414 HydrophobicContact CE3-CB 4.45Å; W342-Q414 HydrophobicContact CE3-CG 4.25Å; W342-Q414 HydrophobicContact CZ3-CG 4.18Å
343L50.9Low45.1Very low107 Ų107107.6 Ų107.656%0.5666%0.66SS**G310 helixtrans-79.99-176.9-76.5162.7000114.2C340 Y341 G345C340-L343 HydrophobicContact CB-CD1 4.39Å; C340-L343 PolarHBondContact O-N 3.13Å; C340-L343 VanDerWaalsContact O-N 3.11Å; Y341-L343 VanDerWaalsContact C-N 3.26Å; Y341-L343 PolarHBondContact O-N 2.93Å; L343-G345 VanDerWaalsContact C-N 3.28Å; L343-G345 PolarHBondContact O-N 3.1Å; L343-G345 VanDerWaalsContact O-N 3.14Å
344K42.8Very low47Very low198 Ų198106.3 Ų106.386%0.86164%0.643SS**  trans-91.850.5-173.3-155.4164.4-174.9173.80113.6W342W342-K344 PolarHBondContact O-N 3.14Å
345G44.8Very low48.8Very low44 Ų44102.9 Ų102.945%0.45461%0.607SS.*SBendtrans-90.4-171.5165.600000112.7L343L343-G345 VanDerWaalsContact C-N 3.28Å; L343-G345 PolarHBondContact O-N 3.1Å; L343-G345 VanDerWaalsContact O-N 3.14Å
346T42.8Very low51.2Low102 Ų102105.4 Ų105.463%0.62659%0.594SS**SBendtrans-56.8156.9176.332.40000113.5Y348T346-Y348 PolarHBondContact O-N 2.9Å
347T41.7Very low52.9Low107 Ų10798.9 Ų98.966%0.65658%0.576SS**  trans-57.1129.3-176.930.30000112.7S349T347-S349 PolarHBondContact O-N 3.29Å
348Y50.9Low55.1Low111 Ų11196.6 Ų96.644%0.43555%0.547SS..THydrogen-bonded Turntrans-59.5-8.2-172.3-116-73.2000116.5T346 W356 F419T346-Y348 PolarHBondContact O-N 2.9Å; Y348-W356 HydrophobicContact CD1-CZ2 4.45Å; Y348-W356 AromaticContact CE1-CZ2 3.68Å; Y348-W356 HydrophobicContact CE1-CZ2 3.68Å; Y348-F419 HydrophobicContact CE1-CZ 4.33Å; Y348-F419 WeakPolarHBondContact OH-CZ 3.42Å
349S50.7Low57.2Low110 Ų11093 Ų9377%0.76951%0.506SS*.THydrogen-bonded Turntrans-77.8-28.7-175.1-59.80000114.3T347T347-S349 PolarHBondContact O-N 3.29Å
350D50.4Low59.4Low140 Ų14095.9 Ų95.975%0.74951%0.505SS*.SBendtrans-106-2.6-176.1-55.3-59.8000113G352D350-G352 PolarHBondContact O-N 2.99Å
351I55.7Low61.7Low18 Ų1895.8 Ų95.89%0.09251%0.505CS..SBendtrans-76.685.4168.4-61.4172.4000106M411I351-M411 HydrophobicContact CG2-CG 3.91Å; I351-M411 HydrophobicContact CG2-SD 4.11Å
352G58.8Low63.5Low34 Ų3487 Ų8735%0.35147%0.471SS..  trans-65.6164.7-150.900000116.3D350 L354 A355D350-G352 PolarHBondContact O-N 2.99Å; G352-L354 PolarHBondContact O-N 3.34Å; G352-A355 PolarHBondContact O-N 3.31Å
353T75.3Confident65.8Low124 Ų12481.1 Ų81.176%0.76145%0.452SS*.Hα-helixtrans-43.5-32.8179.4-450000114.2A355 W356 M357T353-A355 PolarHBondContact O-N 3.07Å; T353-W356 PolarHBondContact O-N 3Å; T353-M357 WeakPolarHBondContact O-CB 3.47Å; T353-M357 PolarHBondContact O-N 3.12Å
354L67.7Low67.8Low99 Ų9981.1 Ų81.152%0.51845%0.453SS..Hα-helixtrans-56.5-46.6176.4-177.362.6000113.1G352 W356 M357 I358G352-L354 PolarHBondContact O-N 3.34Å; L354-W356 PolarHBondContact O-N 2.98Å; L354-M357 HydrophobicContact CD1-CE 4.05Å; L354-M357 PolarHBondContact O-N 2.69Å; L354-I358 HydrophobicContact CD1-CD1 4.04Å; L354-I358 HydrophobicContact CD1-CG1 4.41Å; L354-I358 HydrophobicContact CG-CD1 3.92Å; L354-I358 VanDerWaalsContact O-CG1 3.27Å; L354-I358 WeakPolarHBondContact O-CG1 3.45Å; L354-I358 PolarHBondContact O-N 3.42Å
355A72.3Confident70.1Confident5 Ų572.6 Ų72.64%0.04142%0.416CS..Hα-helixtrans-67.2-37.7-178.500000112.1G352 T353 T359 L406 M411G352-A355 PolarHBondContact O-N 3.31Å; T353-A355 PolarHBondContact O-N 3.07Å; A355-T359 PolarHBondContact O-N 3.16Å; A355-T359 PolarHBondContact O-OG1 2.99Å; A355-L406 HydrophobicContact CB-CD2 3.83Å; A355-M411 HydrophobicContact CB-SD 3.88Å
356W78.8Confident72.4Confident125 Ų12570.5 Ų70.547%0.47339%0.394SS..Hα-helixtrans-68.7-38.8172.9-82.1112.8000112.7Y348 T353 L354 L360 F419Y348-W356 HydrophobicContact CD1-CZ2 4.45Å; Y348-W356 AromaticContact CE1-CZ2 3.68Å; Y348-W356 HydrophobicContact CE1-CZ2 3.68Å; T353-W356 PolarHBondContact O-N 3Å; L354-W356 PolarHBondContact O-N 2.98Å; W356-L360 VanDerWaalsContact O-CB 3.23Å; W356-L360 WeakPolarHBondContact O-CB 3.34Å; W356-L360 PolarHBondContact O-N 2.94Å; W356-F419 HydrophobicContact CE3-CE1 4.2Å; W356-F419 AromaticContact CH2-CE1 3.84Å; W356-F419 HydrophobicContact CH2-CE1 3.84Å; W356-F419 HydrophobicContact CH2-CZ 4.18Å; W356-F419 HydrophobicContact CZ2-CE1 4.21Å; W356-F419 HydrophobicContact CZ2-CZ 4.24Å; W356-F419 AromaticContact CZ3-CE1 3.83Å; W356-F419 HydrophobicContact CZ3-CE1 3.83Å
357M80Confident74.9Confident120 Ų12068.9 Ų68.959%0.59138%0.378SS*.Hα-helixtrans-64.1-44.1176.3-172.4-172.183.200111.2T353 L354 L360 S361T353-M357 WeakPolarHBondContact O-CB 3.47Å; T353-M357 PolarHBondContact O-N 3.12Å; L354-M357 HydrophobicContact CD1-CE 4.05Å; L354-M357 PolarHBondContact O-N 2.69Å; M357-L360 PolarHBondContact O-N 2.91Å; M357-S361 WeakPolarHBondContact O-CB 3.24Å; M357-S361 PolarHBondContact O-N 3.01Å
358I80Confident77.5Confident23 Ų2364.9 Ų64.912%0.11835%0.353CS..Hα-helixtrans-59.5-60.7174.6-69.9163.7000109.5L354 L360 S361 D362 D402 I405L354-I358 HydrophobicContact CD1-CD1 4.04Å; L354-I358 HydrophobicContact CD1-CG1 4.41Å; L354-I358 HydrophobicContact CG-CD1 3.92Å; L354-I358 VanDerWaalsContact O-CG1 3.27Å; L354-I358 WeakPolarHBondContact O-CG1 3.45Å; L354-I358 PolarHBondContact O-N 3.42Å; I358-L360 PolarHBondContact O-N 2.91Å; I358-L360 VanDerWaalsContact O-N 3.08Å; I358-S361 PolarHBondContact O-N 2.93Å; I358-D362 WeakPolarHBondContact O-CB 3.32Å; I358-D362 PolarHBondContact O-N 3.17Å; I358-D402 HydrophobicContact CG2-CB 4.28Å; I358-D402 WeakPolarHBondContact CG2-OD1 3.47Å; I358-I405 HydrophobicContact CD1-CB 4.43Å; I358-I405 HydrophobicContact CD1-CG2 3.48Å; I358-I405 VanDerWaalsContact CD1-CG2 3.48Å
359T82.2Confident79.6Confident15 Ų1559.6 Ų59.69%0.09233%0.332CS..Hα-helixtrans-55.7-34.1-177.9-41.40000112.8A355 G363 F419A355-T359 PolarHBondContact O-N 3.16Å; A355-T359 PolarHBondContact O-OG1 2.99Å; T359-G363 PolarHBondContact O-N 3.49Å; T359-F419 HydrophobicContact CG2-CB 4.22Å; T359-F419 HydrophobicContact CG2-CD1 3.72Å; T359-F419 HydrophobicContact CG2-CG 4.48Å
360L88.3Confident81.8Confident132 Ų13254.3 Ų54.369%0.69130%0.295SS*.Hα-helixtrans-75.6-34.7178.7-175.664.6000112.9W356 M357 I358 L364W356-L360 VanDerWaalsContact O-CB 3.23Å; W356-L360 WeakPolarHBondContact O-CB 3.34Å; W356-L360 PolarHBondContact O-N 2.94Å; M357-L360 PolarHBondContact O-N 2.91Å; I358-L360 PolarHBondContact O-N 2.91Å; I358-L360 VanDerWaalsContact O-N 3.08Å; L360-L364 WeakPolarHBondContact O-CB 3.24Å; L360-L364 PolarHBondContact O-N 3.27Å
361S87.9Confident83.9Confident74 Ų7448.6 Ų48.652%0.51727%0.265SS..Hα-helixtrans-72.3-42.8174.7-166.50000111.1M357 I358 L364 H365M357-S361 WeakPolarHBondContact O-CB 3.24Å; M357-S361 PolarHBondContact O-N 3.01Å; I358-S361 PolarHBondContact O-N 2.93Å; S361-L364 PolarHBondContact O-N 2.97Å; S361-H365 PolarHBondContact O-CE1 2.83Å; S361-H365 PolarHBondContact O-N 3.37Å
362D88.5Confident85.8Confident2 Ų247.8 Ų47.81%0.01126%0.26CS..Hα-helixtrans-52.6-60.6171170.814.5000110.5I358 L364 H365 N366 S423I358-D362 WeakPolarHBondContact O-CB 3.32Å; I358-D362 PolarHBondContact O-N 3.17Å; D362-L364 PolarHBondContact O-N 3.47Å; D362-H365 WeakPolarHBondContact CA-CE1 3.44Å; D362-H365 WeakPolarHBondContact CA-ND1 3.42Å; D362-H365 WeakPolarHBondContact CA-NE2 3.31Å; D362-H365 VanDerWaalsContact O-CG 3.32Å; D362-H365 PolarHBondContact O-N 3Å; D362-H365 PolarHBondContact O-ND1 3.34Å; D362-H365 IonicContact OD1-NE2 2.72Å; D362-H365 PolarHBondContact OD1-NE2 2.99Å; D362-N366 PolarHBondContact O-N 3.12Å; D362-S423 WeakPolarHBondContact OD1-CB 3.45Å; D362-S423 PolarHBondContact OD1-OG 2.73Å; D362-S423 WeakPolarHBondContact OD2-CB 3.34Å; D362-S423 PolarHBondContact OD2-OG 2.97Å
363G91.5Very high87.6Confident13 Ų1346.1 Ų46.113%0.13424%0.244CC..Hα-helixtrans-64.3-10.7178.500000115.4T359 F367 S423 C426T359-G363 PolarHBondContact O-N 3.49Å; G363-F367 WeakPolarHBondContact O-CB 3.22Å; G363-F367 PolarHBondContact O-N 2.81Å; G363-S423 WeakPolarHBondContact CA-OG 3.39Å; G363-S423 PolarHBondContact N-OG 2.85Å; G363-C426 VanDerWaalsContact O-CB 3.23Å; G363-C426 WeakPolarHBondContact O-CB 3.39Å
364L91.9Very high88.6Confident108 Ų10840.2 Ų40.257%0.56521%0.207SC*.Hα-helixtrans-91.5-36.3173-175.2145.7000112.5L360 S361 D362 I368L360-L364 WeakPolarHBondContact O-CB 3.24Å; L360-L364 PolarHBondContact O-N 3.27Å; S361-L364 PolarHBondContact O-N 2.97Å; D362-L364 PolarHBondContact O-N 3.47Å; L364-I368 HydrophobicContact CD2-CD1 3.92Å; L364-I368 WeakPolarHBondContact O-CG1 3.26Å; L364-I368 PolarHBondContact O-N 3.13Å
365H92.1Very high89.8Confident19 Ų1935.5 Ų35.59%0.08818%0.183CC..Hα-helixtrans-66-52.2168.874.5-117.2000109.2S361 D362 F367 I368 D369 E395 H398 D402 M453 I457S361-H365 PolarHBondContact O-CE1 2.83Å; S361-H365 PolarHBondContact O-N 3.37Å; D362-H365 WeakPolarHBondContact CA-CE1 3.44Å; D362-H365 WeakPolarHBondContact CA-ND1 3.42Å; D362-H365 WeakPolarHBondContact CA-NE2 3.31Å; D362-H365 VanDerWaalsContact O-CG 3.32Å; D362-H365 PolarHBondContact O-N 3Å; D362-H365 PolarHBondContact O-ND1 3.34Å; D362-H365 IonicContact OD1-NE2 2.72Å; D362-H365 PolarHBondContact OD1-NE2 2.99Å; H365-F367 CarbonylContact O-C 3.37Å; H365-F367 PolarHBondContact O-N 3.15Å; H365-I368 CarbonylContact O-C 3.59Å; H365-I368 WeakPolarHBondContact O-CA 3.31Å; H365-I368 WeakPolarHBondContact O-CB 3.47Å; H365-I368 PolarHBondContact O-N 3.34Å; H365-D369 IonicContact CD2-OD2 2.71Å; H365-D369 PolarHBondContact O-N 3.41Å; H365-E395 IonicContact CD2-OE1 3.72Å; H365-H398 AromaticContact NE2-ND1 3.65Å; H365-D402 IonicContact NE2-OD2 2.62Å; H365-M453 HydrophobicContact CB-CE 3.98Å; H365-I457 HydrophobicContact CB-CD1 3.97Å
366N93.6Very high90.8Very high0 Ų035.3 Ų35.30%018%0.181CC..Hα-helixtrans-51.5-36.9-179.8-113.7-88.3000112.3D362 G370 E395 A424 C427D362-N366 PolarHBondContact O-N 3.12Å; N366-G370 PolarHBondContact O-N 2.96Å; N366-E395 VanDerWaalsContact CG-OE1 3.32Å; N366-E395 PolarHBondContact ND2-OE1 3.12Å; N366-E395 PolarHBondContact ND2-OE2 2.97Å; N366-E395 VanDerWaalsContact ND2-OE2 3.13Å; N366-E395 PolarHBondContact OD1-OE1 3.04Å; N366-A424 WeakPolarHBondContact OD1-CA 3.28Å; N366-C427 HydrophobicContact CB-CB 4.45Å; N366-C427 WeakPolarHBondContact O-CA 3.47Å; N366-C427 WeakPolarHBondContact O-CB 3.35Å; N366-C427 WeakPolarHBondContact OD1-CB 3.35Å
367F95.7Very high91.5Very high67 Ų6729.4 Ų29.429%0.29416%0.159SC..Hα-helixtrans-65-43171.9177.9-93.9000114G363 H365 D369 L371 C426 L429 G430 F433G363-F367 WeakPolarHBondContact O-CB 3.22Å; G363-F367 PolarHBondContact O-N 2.81Å; H365-F367 CarbonylContact O-C 3.37Å; H365-F367 PolarHBondContact O-N 3.15Å; F367-D369 VanDerWaalsContact C-N 3.34Å; F367-L371 WeakPolarHBondContact O-CB 3.47Å; F367-L371 PolarHBondContact O-N 3.19Å; F367-C426 HydrophobicContact CB-CB 4.24Å; F367-L429 HydrophobicContact CD2-CB 4.26Å; F367-L429 HydrophobicContact CE2-CB 4.34Å; F367-G430 WeakPolarHBondContact O-CA 3.4Å; F367-F433 HydrophobicContact CE2-CD2 4.27Å; F367-F433 HydrophobicContact CZ-CB 4.3Å; F367-F433 HydrophobicContact CZ-CD2 4.4Å; F367-F433 HydrophobicContact CZ-CG 4.34Å
368I95Very high92Very high23 Ų2323.7 Ų23.712%0.11813%0.131CC..Hα-helixtrans-68.9-34.5176.8-62.7167.3000110.8L364 H365 L371 A372 M453L364-I368 HydrophobicContact CD2-CD1 3.92Å; L364-I368 WeakPolarHBondContact O-CG1 3.26Å; L364-I368 PolarHBondContact O-N 3.13Å; H365-I368 CarbonylContact O-C 3.59Å; H365-I368 WeakPolarHBondContact O-CA 3.31Å; H365-I368 WeakPolarHBondContact O-CB 3.47Å; H365-I368 PolarHBondContact O-N 3.34Å; I368-L371 CarbonylContact O-C 3.57Å; I368-L371 VanDerWaalsContact O-CB 3.3Å; I368-L371 WeakPolarHBondContact O-CB 3.41Å; I368-L371 PolarHBondContact O-N 3.5Å; I368-A372 WeakPolarHBondContact O-CB 3.46Å; I368-A372 PolarHBondContact O-N 2.9Å; I368-M453 HydrophobicContact CB-CE 3.97Å; I368-M453 HydrophobicContact CD1-CG 4.12Å; I368-M453 HydrophobicContact CG2-CB 4.25Å; I368-M453 HydrophobicContact CG2-CE 3.92Å; I368-M453 HydrophobicContact CG2-CG 4.05Å
369D95.3Very high92.3Very high0 Ų024.1 Ų24.10%014%0.138CC..Hα-helixtrans-68.1-44.2176.5-64-50.5000111.6H365 F367 L371 A372 I373 I391 M453 F454H365-D369 IonicContact CD2-OD2 2.71Å; H365-D369 PolarHBondContact O-N 3.41Å; F367-D369 VanDerWaalsContact C-N 3.34Å; D369-L371 VanDerWaalsContact C-N 3.32Å; D369-L371 PolarHBondContact O-N 2.98Å; D369-A372 PolarHBondContact O-N 3.48Å; D369-I373 VanDerWaalsContact O-CG1 3.31Å; D369-I373 WeakPolarHBondContact O-CG1 3.46Å; D369-I373 PolarHBondContact O-N 3.24Å; D369-I391 HydrophobicContact CB-CD1 3.96Å; D369-I391 HydrophobicContact CB-CG1 4.21Å; D369-I391 HydrophobicContact CB-CG2 3.97Å; D369-M453 VanDerWaalsContact CG-CE 3.48Å; D369-M453 WeakPolarHBondContact OD1-CE 3.47Å; D369-M453 VanDerWaalsContact OD2-CE 3.23Å; D369-M453 WeakPolarHBondContact OD2-CE 3.21Å; D369-F454 WeakPolarHBondContact OD1-CE1 3.37Å; D369-F454 WeakPolarHBondContact OD1-CZ 3.48Å
370G96.3Very high92.6Very high0 Ų024.7 Ų24.70%014%0.142CC..Hα-helixtrans-54.2-48.5165.800000112.1N366 A372 I373 G374 C427 M431N366-G370 PolarHBondContact O-N 2.96Å; G370-A372 VanDerWaalsContact C-N 3.29Å; G370-A372 PolarHBondContact O-N 2.9Å; G370-I373 PolarHBondContact O-N 3.42Å; G370-G374 PolarHBondContact O-N 2.91Å; G370-C427 WeakPolarHBondContact CA-O 3.36Å; G370-C427 WeakPolarHBondContact CA-SG 3.17Å; G370-C427 PolarHBondContact N-SG 3.46Å; G370-M431 WeakPolarHBondContact O-CA 3.49Å; G370-M431 PolarHBondContact O-N 3.47Å
371L96.1Very high92.6Very high20 Ų2019.3 Ų19.311%0.10512%0.115CC..Hα-helixtrans-58-41.7179.2-165.580.9000111.6F367 I368 D369 A375 G430 F433 I446 L449F367-L371 WeakPolarHBondContact O-CB 3.47Å; F367-L371 PolarHBondContact O-N 3.19Å; I368-L371 CarbonylContact O-C 3.57Å; I368-L371 VanDerWaalsContact O-CB 3.3Å; I368-L371 WeakPolarHBondContact O-CB 3.41Å; I368-L371 PolarHBondContact O-N 3.5Å; D369-L371 VanDerWaalsContact C-N 3.32Å; D369-L371 PolarHBondContact O-N 2.98Å; L371-A375 WeakPolarHBondContact O-CB 3.43Å; L371-A375 PolarHBondContact O-N 2.71Å; L371-G430 WeakPolarHBondContact CA-O 3.46Å; L371-G430 VanDerWaalsContact N-C 3.29Å; L371-G430 PolarHBondContact N-O 2.67Å; L371-F433 HydrophobicContact CD1-CB 3.77Å; L371-I446 HydrophobicContact CB-CG2 4.47Å; L371-I446 HydrophobicContact CD2-CG1 4.41Å; L371-I446 HydrophobicContact CD2-CG2 3.84Å; L371-I446 HydrophobicContact CG-CG1 4.49Å; L371-I446 HydrophobicContact CG-CG2 3.72Å; L371-L449 HydrophobicContact CD2-CD2 4.18Å
372A95.8Very high92.6Very high0 Ų016.9 Ų16.90%010%0.095CC..Hα-helixtrans-67.1-43.8176.900000112.3I368 D369 G370 S376 T387 A450 F454I368-A372 WeakPolarHBondContact O-CB 3.46Å; I368-A372 PolarHBondContact O-N 2.9Å; D369-A372 PolarHBondContact O-N 3.48Å; G370-A372 VanDerWaalsContact C-N 3.29Å; G370-A372 PolarHBondContact O-N 2.9Å; A372-S376 WeakPolarHBondContact O-CB 3.28Å; A372-S376 PolarHBondContact O-N 3.24Å; A372-S376 PolarHBondContact O-OG 2.95Å; A372-T387 HydrophobicContact CB-CG2 4.13Å; A372-A450 HydrophobicContact CB-CB 3.7Å; A372-F454 HydrophobicContact CB-CE1 4.43Å; A372-F454 HydrophobicContact CB-CZ 4.33Å
373I96.1Very high92.5Very high0 Ų017.5 Ų17.50%010%0.098CC..Hα-helixtrans-59-51.1173.9-69.6167.3000110.3V174 I177 D369 G370 A375 S376 F377 I391 M431V174-I373 HydrophobicContact CG2-CD1 4.05Å; V174-I373 HydrophobicContact CG2-CG2 4.29Å; I177-I373 HydrophobicContact CD1-CD1 3.57Å; D369-I373 VanDerWaalsContact O-CG1 3.31Å; D369-I373 WeakPolarHBondContact O-CG1 3.46Å; D369-I373 PolarHBondContact O-N 3.24Å; G370-I373 PolarHBondContact O-N 3.42Å; I373-A375 PolarHBondContact O-N 2.98Å; I373-S376 PolarHBondContact O-N 3.35Å; I373-F377 HydrophobicContact CG2-CD2 3.74Å; I373-F377 HydrophobicContact CG2-CE2 3.83Å; I373-F377 WeakPolarHBondContact O-CD2 3Å; I373-F377 PolarHBondContact O-N 2.82Å; I373-I391 HydrophobicContact CD1-CD1 3.66Å; I373-I391 HydrophobicContact CG1-CD1 3.44Å; I373-I391 VanDerWaalsContact CG1-CD1 3.44Å; I373-M431 HydrophobicContact CG2-CG 4.46Å
374G95.2Very high92.6Very high0 Ų016.9 Ų16.90%09%0.091CC..Hα-helixtrans-60.5-47.2-178.100000112.6G370 T378G370-G374 PolarHBondContact O-N 2.91Å; G374-T378 PolarHBondContact O-N 3.21Å
375A93.7Very high92.6Very high0 Ų014.5 Ų14.50%08%0.079CC..Hα-helixtrans-63.3-41.9175.100000112L371 I373 F377 T378 A379 P443 I446 F447L371-A375 WeakPolarHBondContact O-CB 3.43Å; L371-A375 PolarHBondContact O-N 2.71Å; I373-A375 PolarHBondContact O-N 2.98Å; A375-F377 PolarHBondContact O-N 2.98Å; A375-T378 PolarHBondContact O-N 3.18Å; A375-T378 VanDerWaalsContact O-N 3.13Å; A375-T378 PolarHBondContact O-OG1 3.02Å; A375-A379 PolarHBondContact O-N 3.08Å; A375-P443 HydrophobicContact CB-CB 4.11Å; A375-I446 HydrophobicContact CB-CB 3.9Å; A375-I446 HydrophobicContact CB-CD1 3.8Å; A375-I446 HydrophobicContact CB-CG1 4.47Å; A375-I446 HydrophobicContact CB-CG2 3.61Å; A375-F447 HydrophobicContact CB-CD1 4.31Å; A375-F447 HydrophobicContact CB-CE1 3.67Å; A375-F447 HydrophobicContact CB-CZ 4.16Å
376S93.1Very high92.6Very high0 Ų013.7 Ų13.70%08%0.075CC..Hα-helixtrans-63.3-42.7-178.5-63.80000111.9A372 I373 T378 A379 S380 T387 F447A372-S376 WeakPolarHBondContact O-CB 3.28Å; A372-S376 PolarHBondContact O-N 3.24Å; A372-S376 PolarHBondContact O-OG 2.95Å; I373-S376 PolarHBondContact O-N 3.35Å; S376-T378 PolarHBondContact O-N 3.04Å; S376-A379 PolarHBondContact O-N 3.02Å; S376-S380 PolarHBondContact O-N 3Å; S376-T387 PolarHBondContact OG-OG1 2.99Å; S376-F447 WeakPolarHBondContact OG-CE1 3.46Å
377F93.1Very high92.6Very high1 Ų113.7 Ų13.70%0.0048%0.075CC..Hα-helixtrans-66.2-32.7173.7-82.6-67.7000113.2P161 V166 Y169 C173 I373 A375 A379 V381 I385P161-F377 VanDerWaalsContact CG-O 3.23Å; P161-F377 WeakPolarHBondContact CG-O 3.3Å; V166-F377 HydrophobicContact CG1-CB 4.02Å; Y169-F377 HydrophobicContact CD2-CE1 4.48Å; Y169-F377 HydrophobicContact CG-CE1 4.16Å; C173-F377 HydrophobicContact CB-CE2 4.22Å; I373-F377 HydrophobicContact CG2-CD2 3.74Å; I373-F377 HydrophobicContact CG2-CE2 3.83Å; I373-F377 WeakPolarHBondContact O-CD2 3Å; I373-F377 PolarHBondContact O-N 2.82Å; A375-F377 PolarHBondContact O-N 2.98Å; F377-A379 PolarHBondContact O-N 3.5Å; F377-V381 HydrophobicContact CE1-CG1 4.33Å; F377-I385 HydrophobicContact CE1-CG1 4.03Å; F377-I385 HydrophobicContact CZ-CG1 3.94Å
378T90.7Very high92.6Very high1 Ų110.8 Ų10.81%0.0066%0.063CC..Hα-helixtrans-68.5-19.817359.60000114.2R160 V166 G374 A375 S376 I435R160-T378 PolarHBondContact NE-O 2.98Å; V166-T378 HydrophobicContact CG1-CG2 3.81Å; G374-T378 PolarHBondContact O-N 3.21Å; A375-T378 PolarHBondContact O-N 3.18Å; A375-T378 VanDerWaalsContact O-N 3.13Å; A375-T378 PolarHBondContact O-OG1 3.02Å; S376-T378 PolarHBondContact O-N 3.04Å; T378-I435 HydrophobicContact CG2-CB 4.3Å; T378-I435 HydrophobicContact CG2-CG2 4.02Å
379A86.9Confident92.5Very high32 Ų3211.9 Ų11.926%0.2647%0.071SC..Hα-helixtrans-85.9-57.5172.800000111.1A375 S376 F377 Q383 F447A375-A379 PolarHBondContact O-N 3.08Å; S376-A379 PolarHBondContact O-N 3.02Å; F377-A379 PolarHBondContact O-N 3.5Å; A379-Q383 VanDerWaalsContact CB-OE1 3.27Å; A379-F447 HydrophobicContact CB-CE2 4.27Å; A379-F447 HydrophobicContact CB-CZ 3.98Å
380S88Confident92.5Very high27 Ų2711.9 Ų11.919%0.1897%0.071CC..  trans-157.9153.7172.4680000113.4S376 F382 Q383 G384S376-S380 PolarHBondContact O-N 3Å; S380-F382 PolarHBondContact O-N 3.03Å; S380-Q383 PolarHBondContact O-N 3.49Å; S380-Q383 VanDerWaalsContact OG-CB 3.22Å; S380-Q383 WeakPolarHBondContact OG-CB 3.33Å; S380-Q383 PolarHBondContact OG-N 2.94Å; S380-Q383 VanDerWaalsContact OG-N 3.1Å; S380-G384 PolarHBondContact O-N 3.48Å
381V88.4Confident92.4Very high19 Ų1911.9 Ų11.912%0.1157%0.071CC..Hα-helixtrans-57.1-39.8173.3-174.20000111.1P161 Y169 F377 G384 I385 L511P161-V381 HydrophobicContact CB-CG2 3.69Å; P161-V381 HydrophobicContact CG-CG2 4Å; Y169-V381 HydrophobicContact CD2-CG1 4.02Å; Y169-V381 HydrophobicContact CE2-CG1 3.98Å; Y169-V381 HydrophobicContact CE2-CG2 4.44Å; F377-V381 HydrophobicContact CE1-CG1 4.33Å; V381-G384 PolarHBondContact O-N 2.9Å; V381-I385 HydrophobicContact CG1-CD1 3.94Å; V381-I385 WeakPolarHBondContact O-CG1 3.35Å; V381-I385 PolarHBondContact O-N 3.38Å; V381-L511 HydrophobicContact CG1-CB 4.37Å; V381-L511 HydrophobicContact CG1-CD1 4.06Å
382F87.1Confident92.2Very high23 Ų2313.8 Ų13.810%0.1018%0.081CC..Hα-helixtrans-63.1-50.6179.9-176.7-91.7000112.3S380 G384 I385 S386 L502 S506 I509 L511S380-F382 PolarHBondContact O-N 3.03Å; F382-G384 VanDerWaalsContact C-N 3.33Å; F382-G384 PolarHBondContact O-N 2.92Å; F382-I385 PolarHBondContact O-N 3.27Å; F382-S386 VanDerWaalsContact O-CB 3.29Å; F382-S386 WeakPolarHBondContact O-CB 3.29Å; F382-S386 PolarHBondContact O-N 2.86Å; F382-L502 HydrophobicContact CE1-CB 4.44Å; F382-L502 WeakPolarHBondContact CE1-O 3.04Å; F382-L502 HydrophobicContact CE2-CD2 4.03Å; F382-L502 HydrophobicContact CZ-CB 3.83Å; F382-L502 HydrophobicContact CZ-CD2 3.78Å; F382-L502 HydrophobicContact CZ-CG 4.43Å; F382-L502 WeakPolarHBondContact CZ-O 3.48Å; F382-S506 WeakPolarHBondContact CD1-OG 3.44Å; F382-I509 HydrophobicContact CD2-CB 4.43Å; F382-I509 HydrophobicContact CD2-CD1 4.46Å; F382-I509 HydrophobicContact CE2-CB 4.49Å; F382-I509 HydrophobicContact CE2-CD1 3.71Å; F382-I509 HydrophobicContact CZ-CD1 4.47Å; F382-L511 HydrophobicContact CB-CD1 4.47Å; F382-L511 HydrophobicContact CD2-CD1 4.35Å
383Q87.3Confident92.1Very high14 Ų1414.7 Ų14.77%0.0659%0.087CC..Hα-helixtrans-65.5-37.6179.1-171.8-175.2-6.400111.8A379 S380 S386 T387 F447A379-Q383 VanDerWaalsContact CB-OE1 3.27Å; S380-Q383 PolarHBondContact O-N 3.49Å; S380-Q383 VanDerWaalsContact OG-CB 3.22Å; S380-Q383 WeakPolarHBondContact OG-CB 3.33Å; S380-Q383 PolarHBondContact OG-N 2.94Å; S380-Q383 VanDerWaalsContact OG-N 3.1Å; Q383-S386 PolarHBondContact O-N 2.97Å; Q383-T387 WeakPolarHBondContact O-CB 3.37Å; Q383-T387 PolarHBondContact O-N 3.01Å; Q383-T387 PolarHBondContact O-OG1 2.98Å; Q383-F447 VanDerWaalsContact NE2-CZ 3.25Å
384G92.9Very high91.8Very high0 Ų014.7 Ų14.70%09%0.087CC..Hα-helixtrans-57.9-50.8173.100000112.9S380 V381 F382 S388S380-G384 PolarHBondContact O-N 3.48Å; V381-G384 PolarHBondContact O-N 2.9Å; F382-G384 VanDerWaalsContact C-N 3.33Å; F382-G384 PolarHBondContact O-N 2.92Å; G384-S388 VanDerWaalsContact O-CB 3.32Å; G384-S388 WeakPolarHBondContact O-CB 3.5Å; G384-S388 PolarHBondContact O-N 3.19Å; G384-S388 PolarHBondContact O-OG 2.92Å
385I92.6Very high91.6Very high59 Ų5914.8 Ų14.830%0.3039%0.087SC..Hα-helixtrans-62.7-45.3175.7-70.4170.3000110.9F377 V381 F382 S388 V389 L511F377-I385 HydrophobicContact CE1-CG1 4.03Å; F377-I385 HydrophobicContact CZ-CG1 3.94Å; V381-I385 HydrophobicContact CG1-CD1 3.94Å; V381-I385 WeakPolarHBondContact O-CG1 3.35Å; V381-I385 PolarHBondContact O-N 3.38Å; F382-I385 PolarHBondContact O-N 3.27Å; I385-S388 WeakPolarHBondContact O-CB 3.5Å; I385-S388 PolarHBondContact O-N 2.56Å; I385-V389 HydrophobicContact CG2-CG2 4.4Å; I385-V389 WeakPolarHBondContact O-CG2 3.4Å; I385-V389 PolarHBondContact O-N 2.75Å; I385-L511 HydrophobicContact CD1-CD1 3.75Å
386S91.4Very high91.3Very high1 Ų116.7 Ų16.71%0.00710%0.096CC..Hα-helixtrans-63.4-45.1-177.4-179.30000112.7Q218 F382 Q383 V389 A390 M499Q218-S386 PolarHBondContact NE2-OG 3.01Å; Q218-S386 VanDerWaalsContact OE1-CB 3.24Å; Q218-S386 PolarHBondContact OE1-OG 2.96Å; F382-S386 VanDerWaalsContact O-CB 3.29Å; F382-S386 WeakPolarHBondContact O-CB 3.29Å; F382-S386 PolarHBondContact O-N 2.86Å; Q383-S386 PolarHBondContact O-N 2.97Å; S386-V389 PolarHBondContact O-N 3.47Å; S386-A390 PolarHBondContact O-N 3.25Å; S386-A390 VanDerWaalsContact O-N 3.1Å; S386-M499 VanDerWaalsContact OG-CE 3.28Å; S386-M499 WeakPolarHBondContact OG-CE 3.3Å
387T94.2Very high90.9Very high0 Ų017 Ų170%010%0.097CC..Hα-helixtrans-63.8-41.4173.5-64.80000111.2A372 S376 Q383 V389 A390 I391 F454A372-T387 HydrophobicContact CB-CG2 4.13Å; S376-T387 PolarHBondContact OG-OG1 2.99Å; Q383-T387 WeakPolarHBondContact O-CB 3.37Å; Q383-T387 PolarHBondContact O-N 3.01Å; Q383-T387 PolarHBondContact O-OG1 2.98Å; T387-V389 VanDerWaalsContact C-N 3.3Å; T387-V389 PolarHBondContact O-N 2.77Å; T387-A390 WeakPolarHBondContact O-CB 3.45Å; T387-A390 PolarHBondContact O-N 2.81Å; T387-A390 VanDerWaalsContact O-N 3.15Å; T387-I391 HydrophobicContact CG2-CD1 3.81Å; T387-I391 WeakPolarHBondContact O-CD1 3.48Å; T387-I391 WeakPolarHBondContact O-CG1 3.38Å; T387-I391 PolarHBondContact O-N 3.29Å; T387-I391 VanDerWaalsContact O-N 3.09Å; T387-F454 HydrophobicContact CG2-CZ 4.47Å
388S95.5Very high90.6Very high6 Ų617.6 Ų17.64%0.04210%0.1CC..Hα-helixtrans-62.7-34175.6-56.30000113.1C173 G384 I385 L392C173-S388 WeakPolarHBondContact CB-OG 3.43Å; G384-S388 VanDerWaalsContact O-CB 3.32Å; G384-S388 WeakPolarHBondContact O-CB 3.5Å; G384-S388 PolarHBondContact O-N 3.19Å; G384-S388 PolarHBondContact O-OG 2.92Å; I385-S388 WeakPolarHBondContact O-CB 3.5Å; I385-S388 PolarHBondContact O-N 2.56Å; S388-L392 WeakPolarHBondContact O-CB 3.32Å; S388-L392 PolarHBondContact O-N 2.95Å
389V93.8Very high90.3Very high47 Ų4717.7 Ų17.729%0.28510%0.1SC..Hα-helixtrans-69.9-36.1174.5166.20000111.5I385 S386 T387 C393 I498 L502I385-V389 HydrophobicContact CG2-CG2 4.4Å; I385-V389 WeakPolarHBondContact O-CG2 3.4Å; I385-V389 PolarHBondContact O-N 2.75Å; S386-V389 PolarHBondContact O-N 3.47Å; T387-V389 VanDerWaalsContact C-N 3.3Å; T387-V389 PolarHBondContact O-N 2.77Å; V389-C393 PolarHBondContact O-N 2.94Å; V389-C393 PolarHBondContact O-SG 3.4Å; V389-I498 HydrophobicContact CG1-CG2 4.09Å; V389-L502 HydrophobicContact CG1-CD1 4.5Å
390A93.6Very high90.2Very high0 Ų016.4 Ų16.40%09%0.089CC..Hα-helixtrans-64.4-47.7176.100000111.6T210 N214 S386 T387 C393 E394 M499T210-A390 PolarHBondContact OG1-O 2.98Å; N214-A390 HydrophobicContact CB-CB 3.75Å; S386-A390 PolarHBondContact O-N 3.25Å; S386-A390 VanDerWaalsContact O-N 3.1Å; T387-A390 WeakPolarHBondContact O-CB 3.45Å; T387-A390 PolarHBondContact O-N 2.81Å; T387-A390 VanDerWaalsContact O-N 3.15Å; A390-C393 WeakPolarHBondContact O-CB 3.23Å; A390-C393 PolarHBondContact O-N 3.48Å; A390-E394 PolarHBondContact O-N 3Å; A390-M499 HydrophobicContact CB-CE 4.22Å; A390-M499 HydrophobicContact CB-SD 4.16Å
391I94.6Very high89.9Confident0 Ų016.4 Ų16.40%09%0.094CC..Hα-helixtrans-64.8-45.3178-63.7158.1000111.1I177 D369 I373 T387 C393 E394 E395 F454I177-I391 HydrophobicContact CD1-CB 4.3Å; I177-I391 HydrophobicContact CD1-CG2 3.92Å; I177-I391 HydrophobicContact CG2-CG2 4.35Å; D369-I391 HydrophobicContact CB-CD1 3.96Å; D369-I391 HydrophobicContact CB-CG1 4.21Å; D369-I391 HydrophobicContact CB-CG2 3.97Å; I373-I391 HydrophobicContact CD1-CD1 3.66Å; I373-I391 HydrophobicContact CG1-CD1 3.44Å; I373-I391 VanDerWaalsContact CG1-CD1 3.44Å; T387-I391 HydrophobicContact CG2-CD1 3.81Å; T387-I391 WeakPolarHBondContact O-CD1 3.48Å; T387-I391 WeakPolarHBondContact O-CG1 3.38Å; T387-I391 PolarHBondContact O-N 3.29Å; T387-I391 VanDerWaalsContact O-N 3.09Å; I391-C393 PolarHBondContact O-N 2.9Å; I391-E394 WeakPolarHBondContact CA-OE1 3.16Å; I391-E394 WeakPolarHBondContact O-CG 3.27Å; I391-E394 PolarHBondContact O-N 3.12Å; I391-E395 HydrophobicContact CG2-CG 3.64Å; I391-E395 WeakPolarHBondContact O-CG 3.38Å; I391-E395 PolarHBondContact O-N 2.92Å; I391-F454 HydrophobicContact CD1-CZ 3.92Å; I391-F454 HydrophobicContact CG1-CE2 4.01Å; I391-F454 HydrophobicContact CG1-CZ 3.59Å
392L93.3Very high89.7Confident60 Ų6016.4 Ų16.431%0.3149%0.093SC..Hα-helixtrans-56.6-25.6176.7-17665.5000113I177 C180 S388I177-L392 HydrophobicContact CB-CD1 4.46Å; I177-L392 HydrophobicContact CG1-CB 4.12Å; I177-L392 HydrophobicContact CG1-CD1 3.91Å; C180-L392 HydrophobicContact CB-CD1 4.32Å; S388-L392 WeakPolarHBondContact O-CB 3.32Å; S388-L392 PolarHBondContact O-N 2.95Å
393C92.1Very high89.6Confident18 Ų1815.4 Ų15.412%0.1229%0.089CC..Hα-helixtrans-82.4-22.1175.5-65.30000114L206 A207 T210 V389 A390 I391 P397L206-C393 HydrophobicContact CD2-CB 4.33Å; L206-C393 HydrophobicContact CG-CB 4.39Å; A207-C393 WeakPolarHBondContact CB-O 3.48Å; T210-C393 HydrophobicContact CG2-CB 3.99Å; T210-C393 WeakPolarHBondContact OG1-CB 3.31Å; V389-C393 PolarHBondContact O-N 2.94Å; V389-C393 PolarHBondContact O-SG 3.4Å; A390-C393 WeakPolarHBondContact O-CB 3.23Å; A390-C393 PolarHBondContact O-N 3.48Å; I391-C393 PolarHBondContact O-N 2.9Å; C393-P397 WeakPolarHBondContact O-CD 3.47Å
394E91.4Very high89.4Confident0 Ų016.5 Ų16.50%010%0.096CC..Hα-helixtrans-91-40.1176.289.6-166.3110.800113.4A207 L211 A390 I391 F396 P397 H398A207-E394 HydrophobicContact CB-CB 4.01Å; L211-E394 HydrophobicContact CD1-CB 3.67Å; L211-E394 HydrophobicContact CD1-CG 4.3Å; L211-E394 WeakPolarHBondContact CD1-OE2 3.26Å; L211-E394 HydrophobicContact CD2-CB 3.95Å; L211-E394 HydrophobicContact CD2-CG 4.11Å; L211-E394 WeakPolarHBondContact CD2-OE1 3.42Å; L211-E394 VanDerWaalsContact CD2-OE2 3.28Å; L211-E394 WeakPolarHBondContact CD2-OE2 3.47Å; L211-E394 HydrophobicContact CG-CB 4.02Å; A390-E394 PolarHBondContact O-N 3Å; I391-E394 WeakPolarHBondContact CA-OE1 3.16Å; I391-E394 WeakPolarHBondContact O-CG 3.27Å; I391-E394 PolarHBondContact O-N 3.12Å; E394-F396 VanDerWaalsContact C-N 3.29Å; E394-F396 PolarHBondContact O-N 3.43Å; E394-P397 WeakPolarHBondContact O-CD 3.33Å; E394-P397 WeakPolarHBondContact O-CG 3.38Å; E394-H398 WeakPolarHBondContact O-CB 2.88Å; E394-H398 PolarHBondContact O-N 3.18Å
395E89.5Confident88.9Confident2 Ų219.9 Ų19.91%0.00911%0.114CC..Hα-helixtrans-63.6-36.6-178.7-69.3-80.2-165.400111.1I177 H365 N366 I391 H398 E399I177-E395 HydrophobicContact CG2-CB 3.95Å; I177-E395 HydrophobicContact CG2-CG 3.66Å; H365-E395 IonicContact CD2-OE1 3.72Å; N366-E395 VanDerWaalsContact CG-OE1 3.32Å; N366-E395 PolarHBondContact ND2-OE1 3.12Å; N366-E395 PolarHBondContact ND2-OE2 2.97Å; N366-E395 VanDerWaalsContact ND2-OE2 3.13Å; N366-E395 PolarHBondContact OD1-OE1 3.04Å; I391-E395 HydrophobicContact CG2-CG 3.64Å; I391-E395 WeakPolarHBondContact O-CG 3.38Å; I391-E395 PolarHBondContact O-N 2.92Å; E395-H398 PolarHBondContact O-N 2.99Å; E395-E399 VanDerWaalsContact O-CB 3.25Å; E395-E399 WeakPolarHBondContact O-CB 3.35Å; E395-E399 WeakPolarHBondContact O-CG 3.31Å; E395-E399 PolarHBondContact O-N 3.43Å; E395-E399 WeakPolarHBondContact OE2-CG 3.33Å
396F87.2Confident88.4Confident41 Ų4117.1 Ų17.118%0.1810%0.099CC..Hα-helixtrans-60.2-46.2179.3-176.8-95.2000114.2C180 I183 F203 E394C180-F396 HydrophobicContact CB-CD2 4.46Å; I183-F396 HydrophobicContact CG2-CE2 4.49Å; F203-F396 HydrophobicContact CB-CD1 4.15Å; F203-F396 AromaticContact CD1-CD1 3.94Å; F203-F396 HydrophobicContact CD1-CD1 3.94Å; F203-F396 HydrophobicContact CD1-CE1 4.38Å; F203-F396 AromaticContact CD2-CD1 3.81Å; F203-F396 HydrophobicContact CD2-CD1 3.81Å; F203-F396 AromaticContact CD2-CE1 3.48Å; F203-F396 HydrophobicContact CD2-CE1 3.48Å; F203-F396 VanDerWaalsContact CD2-CE1 3.48Å; F203-F396 HydrophobicContact CE1-CD1 4.27Å; F203-F396 HydrophobicContact CE1-CE1 4.49Å; F203-F396 HydrophobicContact CE2-CD1 4.14Å; F203-F396 AromaticContact CE2-CE1 3.6Å; F203-F396 HydrophobicContact CE2-CE1 3.6Å; F203-F396 HydrophobicContact CE2-CZ 4.42Å; F203-F396 AromaticContact CG-CD1 3.71Å; F203-F396 HydrophobicContact CG-CD1 3.71Å; F203-F396 AromaticContact CG-CE1 3.91Å; F203-F396 HydrophobicContact CG-CE1 3.91Å; F203-F396 HydrophobicContact CZ-CD1 4.36Å; F203-F396 HydrophobicContact CZ-CE1 4.13Å; E394-F396 VanDerWaalsContact C-N 3.29Å; E394-F396 PolarHBondContact O-N 3.43Å
397P86.1Confident88Confident5 Ų519.5 Ų19.53%0.03211%0.112CC..Hα-helixtrans-73.7-37.6168.724.2-30.7000114.3L200 F203 I204 A207 C393 E394 G401L200-P397 HydrophobicContact CD1-CB 4.06Å; F203-P397 HydrophobicContact CB-CB 4.39Å; F203-P397 HydrophobicContact CB-CG 4.36Å; I204-P397 HydrophobicContact CG1-CB 3.7Å; A207-P397 HydrophobicContact CB-CG 4.1Å; C393-P397 WeakPolarHBondContact O-CD 3.47Å; E394-P397 WeakPolarHBondContact O-CD 3.33Å; E394-P397 WeakPolarHBondContact O-CG 3.38Å; P397-G401 PolarHBondContact O-N 3.26Å
398H86.1Confident87.4Confident14 Ų1425.8 Ų25.87%0.06515%0.145CC..Hα-helixtrans-62.5-60.6-178.8-109.4-74.4000112.5H365 E394 E395 L400 G401 D402 D461 M462H365-H398 AromaticContact NE2-ND1 3.65Å; E394-H398 WeakPolarHBondContact O-CB 2.88Å; E394-H398 PolarHBondContact O-N 3.18Å; E395-H398 PolarHBondContact O-N 2.99Å; H398-L400 PolarHBondContact O-N 3.37Å; H398-G401 WeakPolarHBondContact O-CA 3.46Å; H398-G401 PolarHBondContact O-N 3.11Å; H398-D402 IonicContact ND1-OD2 3.89Å; H398-D402 PolarHBondContact O-N 3.39Å; H398-D461 IonicContact CE1-OD2 2.99Å; H398-M462 VanDerWaalsContact NE2-CE 3.32Å; H398-M462 WeakPolarHBondContact NE2-CE 3.18Å
399E85.2Confident86.7Confident3 Ų327.6 Ų27.61%0.01416%0.161CC..Hα-helixtrans-56.3-28.4-177.3-72.1-99.2-135.300111.8S181 E395 F403 N420S181-E399 WeakPolarHBondContact CB-OE1 3.37Å; S181-E399 VanDerWaalsContact CB-OE2 3.23Å; S181-E399 WeakPolarHBondContact CB-OE2 3.15Å; S181-E399 PolarHBondContact OG-OE1 3.05Å; E395-E399 VanDerWaalsContact O-CB 3.25Å; E395-E399 WeakPolarHBondContact O-CB 3.35Å; E395-E399 WeakPolarHBondContact O-CG 3.31Å; E395-E399 PolarHBondContact O-N 3.43Å; E395-E399 WeakPolarHBondContact OE2-CG 3.33Å; E399-F403 WeakPolarHBondContact O-CB 3.44Å; E399-F403 PolarHBondContact O-N 3.06Å; E399-F403 VanDerWaalsContact O-N 3.09Å; E399-N420 PolarHBondContact O-ND2 2.92Å; E399-N420 WeakPolarHBondContact OE2-CB 3.31Å; E399-N420 PolarHBondContact OE2-ND2 2.64Å
400L84.2Confident86.1Confident5 Ų528.1 Ų28.13%0.02618%0.176CC..Hα-helixtrans-80.3-37.1174.8-167.6141000113.5V187 Y196 L200 H398 V404V187-L400 HydrophobicContact CB-CD1 4.04Å; V187-L400 HydrophobicContact CG1-CD1 3.78Å; V187-L400 HydrophobicContact CG2-CD1 4.42Å; Y196-L400 HydrophobicContact CE1-CD2 4.3Å; Y196-L400 WeakPolarHBondContact OH-CD1 3.21Å; Y196-L400 WeakPolarHBondContact OH-CD2 3.18Å; L200-L400 HydrophobicContact CD1-CD2 4.2Å; L200-L400 HydrophobicContact CD2-CD2 4.1Å; H398-L400 PolarHBondContact O-N 3.37Å; L400-V404 HydrophobicContact CD2-CG2 4.46Å; L400-V404 VanDerWaalsContact O-CG2 3.26Å; L400-V404 WeakPolarHBondContact O-CG2 3.2Å; L400-V404 PolarHBondContact O-N 3.14Å
401G82.6Confident85.6Confident28 Ų2828.5 Ų28.529%0.28918%0.177SC..Hα-helixtrans-60.1-52170.800000111P397 H398 F403 V404 I405P397-G401 PolarHBondContact O-N 3.26Å; H398-G401 WeakPolarHBondContact O-CA 3.46Å; H398-G401 PolarHBondContact O-N 3.11Å; G401-F403 PolarHBondContact O-N 3.21Å; G401-V404 WeakPolarHBondContact O-CA 3.47Å; G401-V404 WeakPolarHBondContact O-CB 3.31Å; G401-V404 PolarHBondContact O-N 3.49Å; G401-I405 WeakPolarHBondContact O-CG1 3.46Å; G401-I405 PolarHBondContact O-N 3.06Å
402D84.1Confident85.3Confident19 Ų1931 Ų3110%0.10220%0.195CC..Hα-helixtrans-63.2-42180-72.1-49.6000112.1I358 H365 H398 V404 I405 L406I358-D402 HydrophobicContact CG2-CB 4.28Å; I358-D402 WeakPolarHBondContact CG2-OD1 3.47Å; H365-D402 IonicContact NE2-OD2 2.62Å; H398-D402 IonicContact ND1-OD2 3.89Å; H398-D402 PolarHBondContact O-N 3.39Å; D402-V404 PolarHBondContact O-N 2.86Å; D402-I405 PolarHBondContact O-N 3.19Å; D402-I405 VanDerWaalsContact O-N 3.1Å; D402-L406 WeakPolarHBondContact O-CB 3.4Å; D402-L406 VanDerWaalsContact O-CG 3.26Å; D402-L406 WeakPolarHBondContact O-CG 3.47Å; D402-L406 PolarHBondContact O-N 3.04Å
403F85.2Confident84.9Confident2 Ų232.4 Ų32.41%0.00920%0.202CC..Hα-helixtrans-54.7-39.5171.9174.8-94.7000112.6V188 E399 G401 L407 I413 A416 L417V188-F403 HydrophobicContact CG2-CD1 4.43Å; V188-F403 HydrophobicContact CG2-CE1 3.42Å; V188-F403 VanDerWaalsContact CG2-CE1 3.42Å; V188-F403 HydrophobicContact CG2-CZ 3.85Å; E399-F403 WeakPolarHBondContact O-CB 3.44Å; E399-F403 PolarHBondContact O-N 3.06Å; E399-F403 VanDerWaalsContact O-N 3.09Å; G401-F403 PolarHBondContact O-N 3.21Å; F403-L407 HydrophobicContact CD1-CD1 4.26Å; F403-L407 HydrophobicContact CE1-CD1 3.44Å; F403-L407 VanDerWaalsContact CE1-CD1 3.44Å; F403-L407 HydrophobicContact CE1-CG 4.08Å; F403-L407 HydrophobicContact CE2-CG 4.45Å; F403-L407 HydrophobicContact CZ-CD1 3.61Å; F403-L407 HydrophobicContact CZ-CD2 4.34Å; F403-L407 HydrophobicContact CZ-CG 4Å; F403-L407 WeakPolarHBondContact O-CG 3.45Å; F403-L407 PolarHBondContact O-N 3.08Å; F403-L407 VanDerWaalsContact O-N 3.16Å; F403-I413 HydrophobicContact CE2-CG2 4.34Å; F403-I413 HydrophobicContact CZ-CG1 4.46Å; F403-I413 HydrophobicContact CZ-CG2 4.17Å; F403-A416 HydrophobicContact CD2-CB 3.72Å; F403-A416 HydrophobicContact CE2-CB 3.71Å; F403-L417 HydrophobicContact CD2-CD2 3.81Å; F403-L417 HydrophobicContact CD2-CG 4.27Å; F403-L417 HydrophobicContact CE2-CD2 3.69Å; F403-L417 HydrophobicContact CE2-CG 3.8Å
404V81.7Confident84.6Confident37 Ų3736.8 Ų36.822%0.22422%0.221CC..Hα-helixtrans-71.9-39.1177.3171.90000111.8M191 L400 G401 D402 L407 N408M191-V404 HydrophobicContact CE-CG2 3.35Å; M191-V404 HydrophobicContact SD-CG2 4.07Å; L400-V404 HydrophobicContact CD2-CG2 4.46Å; L400-V404 VanDerWaalsContact O-CG2 3.26Å; L400-V404 WeakPolarHBondContact O-CG2 3.2Å; L400-V404 PolarHBondContact O-N 3.14Å; G401-V404 WeakPolarHBondContact O-CA 3.47Å; G401-V404 WeakPolarHBondContact O-CB 3.31Å; G401-V404 PolarHBondContact O-N 3.49Å; D402-V404 PolarHBondContact O-N 2.86Å; V404-L407 PolarHBondContact O-N 3.4Å; V404-N408 WeakPolarHBondContact O-CB 3.34Å; V404-N408 VanDerWaalsContact O-CG 3.25Å; V404-N408 PolarHBondContact O-N 2.86Å; V404-N408 PolarHBondContact O-ND2 3.06Å
405I82Confident84.3Confident71 Ų7138 Ų3836%0.36423%0.226SC..Hα-helixtrans-67-42.1177.7-61.9162.3000110.6I358 G401 D402 L407 N408 A409I358-I405 HydrophobicContact CD1-CB 4.43Å; I358-I405 HydrophobicContact CD1-CG2 3.48Å; I358-I405 VanDerWaalsContact CD1-CG2 3.48Å; G401-I405 WeakPolarHBondContact O-CG1 3.46Å; G401-I405 PolarHBondContact O-N 3.06Å; D402-I405 PolarHBondContact O-N 3.19Å; D402-I405 VanDerWaalsContact O-N 3.1Å; I405-L407 PolarHBondContact O-N 2.8Å; I405-N408 CarbonylContact O-C 3.58Å; I405-N408 PolarHBondContact O-N 3.36Å; I405-N408 VanDerWaalsContact O-N 3.16Å; I405-A409 WeakPolarHBondContact O-CB 3.11Å; I405-A409 PolarHBondContact O-N 3.49Å
406L82.8Confident84.1Confident1 Ų137.9 Ų37.91%0.00523%0.226CC..Hα-helixtrans-62.6-40175.8-65.1173.2000111.9A355 D402 A409 M411 A416 F419A355-L406 HydrophobicContact CB-CD2 3.83Å; D402-L406 WeakPolarHBondContact O-CB 3.4Å; D402-L406 VanDerWaalsContact O-CG 3.26Å; D402-L406 WeakPolarHBondContact O-CG 3.47Å; D402-L406 PolarHBondContact O-N 3.04Å; L406-A409 PolarHBondContact O-N 3.12Å; L406-M411 HydrophobicContact CB-SD 4Å; L406-M411 HydrophobicContact CD2-CE 4.32Å; L406-M411 HydrophobicContact CD2-SD 3.68Å; L406-M411 HydrophobicContact CG-SD 4.37Å; L406-M411 VanDerWaalsContact O-CB 3.31Å; L406-M411 WeakPolarHBondContact O-CB 3.28Å; L406-M411 PolarHBondContact O-N 3.13Å; L406-A416 HydrophobicContact CB-CB 3.94Å; L406-A416 HydrophobicContact CD1-CB 4.43Å; L406-F419 HydrophobicContact CD1-CB 4.24Å
407L83.6Confident83.9Confident50 Ų5037.7 Ų37.726%0.26223%0.227SC..Hα-helixtrans-62.9-43.3171.1-74.4-173.1000112.4F403 V404 I405 A409 G410 M411 I413 A416F403-L407 HydrophobicContact CD1-CD1 4.26Å; F403-L407 HydrophobicContact CE1-CD1 3.44Å; F403-L407 VanDerWaalsContact CE1-CD1 3.44Å; F403-L407 HydrophobicContact CE1-CG 4.08Å; F403-L407 HydrophobicContact CE2-CG 4.45Å; F403-L407 HydrophobicContact CZ-CD1 3.61Å; F403-L407 HydrophobicContact CZ-CD2 4.34Å; F403-L407 HydrophobicContact CZ-CG 4Å; F403-L407 WeakPolarHBondContact O-CG 3.45Å; F403-L407 PolarHBondContact O-N 3.08Å; F403-L407 VanDerWaalsContact O-N 3.16Å; V404-L407 PolarHBondContact O-N 3.4Å; I405-L407 PolarHBondContact O-N 2.8Å; L407-A409 VanDerWaalsContact C-N 3.27Å; L407-A409 PolarHBondContact O-N 2.87Å; L407-G410 PolarHBondContact O-N 3.19Å; L407-M411 WeakPolarHBondContact CD2-O 3.49Å; L407-I413 HydrophobicContact CD1-CG1 4.46Å; L407-I413 HydrophobicContact CD2-CB 4.48Å; L407-I413 HydrophobicContact CD2-CG1 3.81Å; L407-A416 HydrophobicContact CD2-CB 4.31Å
408N81.3Confident83.9Confident133 Ų13342.6 Ų42.671%0.71125%0.248SC*.Hα-helixtrans-67.4-27.7177.9-71.3-26.2000112.4V404 I405 G410V404-N408 WeakPolarHBondContact O-CB 3.34Å; V404-N408 VanDerWaalsContact O-CG 3.25Å; V404-N408 PolarHBondContact O-N 2.86Å; V404-N408 PolarHBondContact O-ND2 3.06Å; I405-N408 CarbonylContact O-C 3.58Å; I405-N408 PolarHBondContact O-N 3.36Å; I405-N408 VanDerWaalsContact O-N 3.16Å; N408-G410 PolarHBondContact O-N 3.39Å
409A80.4Confident83.9Confident44 Ų4442.5 Ų42.536%0.36425%0.247SC..THydrogen-bonded Turntrans-73.23.8169.700000113.7I405 L406 L407I405-A409 WeakPolarHBondContact O-CB 3.11Å; I405-A409 PolarHBondContact O-N 3.49Å; L406-A409 PolarHBondContact O-N 3.12Å; L407-A409 VanDerWaalsContact C-N 3.27Å; L407-A409 PolarHBondContact O-N 2.87Å
410G81.4Confident83.9Confident58 Ų5842.4 Ų42.460%0.59825%0.247SC*.THydrogen-bonded Turntrans89.18.3173.900000115.1L407 N408L407-G410 PolarHBondContact O-N 3.19Å; N408-G410 PolarHBondContact O-N 3.39Å
411M83.6Confident83.9Confident7 Ų746.5 Ų46.53%0.03426%0.264CS..  trans-75.4145.4176-61.817062.300110.7I351 A355 L406 L407 Q415 F419I351-M411 HydrophobicContact CG2-CG 3.91Å; I351-M411 HydrophobicContact CG2-SD 4.11Å; A355-M411 HydrophobicContact CB-SD 3.88Å; L406-M411 HydrophobicContact CB-SD 4Å; L406-M411 HydrophobicContact CD2-CE 4.32Å; L406-M411 HydrophobicContact CD2-SD 3.68Å; L406-M411 HydrophobicContact CG-SD 4.37Å; L406-M411 VanDerWaalsContact O-CB 3.31Å; L406-M411 WeakPolarHBondContact O-CB 3.28Å; L406-M411 PolarHBondContact O-N 3.13Å; L407-M411 WeakPolarHBondContact CD2-O 3.49Å; M411-Q415 HydrophobicContact CB-CB 4.17Å; M411-Q415 HydrophobicContact CE-CB 4.01Å; M411-F419 HydrophobicContact CE-CB 4.33Å; M411-F419 HydrophobicContact CE-CD2 3.35Å; M411-F419 HydrophobicContact CE-CE2 3.72Å; M411-F419 HydrophobicContact CE-CG 3.89Å
412S86.9Confident84.2Confident54 Ų5449.3 Ų49.338%0.37827%0.272SS..  trans-70.4156.5171.668.40000111.3Q414 Q415 A416S412-Q414 PolarHBondContact O-N 3.16Å; S412-Q414 VanDerWaalsContact O-N 3.12Å; S412-Q415 WeakPolarHBondContact O-CA 3.06Å; S412-Q415 WeakPolarHBondContact O-CB 3.5Å; S412-Q415 PolarHBondContact O-N 2.87Å; S412-Q415 WeakPolarHBondContact OG-CG 3.29Å; S412-Q415 PolarHBondContact OG-N 3.1Å; S412-Q415 PolarHBondContact OG-OE1 3.41Å; S412-A416 PolarHBondContact O-N 3.14Å
413I85.4Confident84.4Confident88 Ų8848.5 Ų48.545%0.45127%0.268SS..Hα-helixtrans-51.2-38.6176.6-64.1167.8000111.8F403 L407 L417F403-I413 HydrophobicContact CE2-CG2 4.34Å; F403-I413 HydrophobicContact CZ-CG1 4.46Å; F403-I413 HydrophobicContact CZ-CG2 4.17Å; L407-I413 HydrophobicContact CD1-CG1 4.46Å; L407-I413 HydrophobicContact CD2-CB 4.48Å; L407-I413 HydrophobicContact CD2-CG1 3.81Å; I413-L417 HydrophobicContact CG2-CD1 3.85Å; I413-L417 HydrophobicContact CG2-CG 4.4Å; I413-L417 WeakPolarHBondContact O-CB 3.1Å; I413-L417 VanDerWaalsContact O-CG 3.24Å; I413-L417 WeakPolarHBondContact O-CG 3.22Å; I413-L417 PolarHBondContact O-N 3.01Å; I413-L417 VanDerWaalsContact O-N 3.07Å
414Q85.7Confident84.6Confident111 Ų11148.4 Ų48.452%0.51927%0.267SS..Hα-helixtrans-70.7-31.9178.9-66.2178.6-6.200112.9W342 S412 F418W342-Q414 HydrophobicContact CE3-CB 4.45Å; W342-Q414 HydrophobicContact CE3-CG 4.25Å; W342-Q414 HydrophobicContact CZ3-CG 4.18Å; S412-Q414 PolarHBondContact O-N 3.16Å; S412-Q414 VanDerWaalsContact O-N 3.12Å; Q414-F418 WeakPolarHBondContact O-CB 3.1Å; Q414-F418 PolarHBondContact O-N 3.23Å
415Q85.6Confident84.9Confident25 Ų2548.6 Ų48.612%0.11727%0.27CS..Hα-helixtrans-73.4-50.9173.1-71.6162.1-66.700110.3M411 S412 L417 F418 F419M411-Q415 HydrophobicContact CB-CB 4.17Å; M411-Q415 HydrophobicContact CE-CB 4.01Å; S412-Q415 WeakPolarHBondContact O-CA 3.06Å; S412-Q415 WeakPolarHBondContact O-CB 3.5Å; S412-Q415 PolarHBondContact O-N 2.87Å; S412-Q415 WeakPolarHBondContact OG-CG 3.29Å; S412-Q415 PolarHBondContact OG-N 3.1Å; S412-Q415 PolarHBondContact OG-OE1 3.41Å; Q415-L417 VanDerWaalsContact C-N 3.35Å; Q415-L417 PolarHBondContact O-N 3Å; Q415-F418 WeakPolarHBondContact O-CB 3.32Å; Q415-F418 PolarHBondContact O-N 3.42Å; Q415-F419 WeakPolarHBondContact O-CD2 3.23Å; Q415-F419 PolarHBondContact O-N 3.33Å
416A84.9Confident85.5Confident0 Ų047 Ų470%027%0.265CS..Hα-helixtrans-53.4-50.1179.300000111.7F403 L406 L407 S412 F418 F419 N420F403-A416 HydrophobicContact CD2-CB 3.72Å; F403-A416 HydrophobicContact CE2-CB 3.71Å; L406-A416 HydrophobicContact CB-CB 3.94Å; L406-A416 HydrophobicContact CD1-CB 4.43Å; L407-A416 HydrophobicContact CD2-CB 4.31Å; S412-A416 PolarHBondContact O-N 3.14Å; A416-F418 VanDerWaalsContact C-N 3.29Å; A416-F418 PolarHBondContact O-N 3.11Å; A416-F419 PolarHBondContact O-N 3.5Å; A416-F419 VanDerWaalsContact O-N 3.1Å; A416-N420 PolarHBondContact O-N 3.04Å; A416-N420 PolarHBondContact O-OD1 3.16Å; A416-N420 VanDerWaalsContact O-OD1 3.13Å
417L83.9Confident86.1Confident37 Ų3747 Ų4719%0.19427%0.265CS..Hα-helixtrans-63-30.8176.6-65.4171.6000114.1A185 F403 I413 Q415 F421A185-L417 HydrophobicContact CB-CD1 3.61Å; A185-L417 HydrophobicContact CB-CD2 3.77Å; A185-L417 HydrophobicContact CB-CG 4.31Å; F403-L417 HydrophobicContact CD2-CD2 3.81Å; F403-L417 HydrophobicContact CD2-CG 4.27Å; F403-L417 HydrophobicContact CE2-CD2 3.69Å; F403-L417 HydrophobicContact CE2-CG 3.8Å; I413-L417 HydrophobicContact CG2-CD1 3.85Å; I413-L417 HydrophobicContact CG2-CG 4.4Å; I413-L417 WeakPolarHBondContact O-CB 3.1Å; I413-L417 VanDerWaalsContact O-CG 3.24Å; I413-L417 WeakPolarHBondContact O-CG 3.22Å; I413-L417 PolarHBondContact O-N 3.01Å; I413-L417 VanDerWaalsContact O-N 3.07Å; Q415-L417 VanDerWaalsContact C-N 3.35Å; Q415-L417 PolarHBondContact O-N 3Å; L417-F421 WeakPolarHBondContact O-CB 3.44Å; L417-F421 PolarHBondContact O-N 3.46Å
418F85.8Confident86.7Confident108 Ų10848 Ų4847%0.47427%0.266SS..Hα-helixtrans-70.3-37.2174.7175.4-95.6000111.7Q414 Q415 A416 L422Q414-F418 WeakPolarHBondContact O-CB 3.1Å; Q414-F418 PolarHBondContact O-N 3.23Å; Q415-F418 WeakPolarHBondContact O-CB 3.32Å; Q415-F418 PolarHBondContact O-N 3.42Å; A416-F418 VanDerWaalsContact C-N 3.29Å; A416-F418 PolarHBondContact O-N 3.11Å; F418-L422 HydrophobicContact CE1-CD2 4.26Å; F418-L422 VanDerWaalsContact O-CB 3.22Å; F418-L422 WeakPolarHBondContact O-CB 3.18Å; F418-L422 PolarHBondContact O-N 2.97Å
419F85.6Confident87.4Confident11 Ų1146.8 Ų46.85%0.04826%0.259CS..Hα-helixtrans-73.8-46.6178.1-83.6-93.2000111.9Y348 W356 T359 L406 M411 Q415 A416 F421 L422 S423Y348-F419 HydrophobicContact CE1-CZ 4.33Å; Y348-F419 WeakPolarHBondContact OH-CZ 3.42Å; W356-F419 HydrophobicContact CE3-CE1 4.2Å; W356-F419 AromaticContact CH2-CE1 3.84Å; W356-F419 HydrophobicContact CH2-CE1 3.84Å; W356-F419 HydrophobicContact CH2-CZ 4.18Å; W356-F419 HydrophobicContact CZ2-CE1 4.21Å; W356-F419 HydrophobicContact CZ2-CZ 4.24Å; W356-F419 AromaticContact CZ3-CE1 3.83Å; W356-F419 HydrophobicContact CZ3-CE1 3.83Å; T359-F419 HydrophobicContact CG2-CB 4.22Å; T359-F419 HydrophobicContact CG2-CD1 3.72Å; T359-F419 HydrophobicContact CG2-CG 4.48Å; L406-F419 HydrophobicContact CD1-CB 4.24Å; M411-F419 HydrophobicContact CE-CB 4.33Å; M411-F419 HydrophobicContact CE-CD2 3.35Å; M411-F419 HydrophobicContact CE-CE2 3.72Å; M411-F419 HydrophobicContact CE-CG 3.89Å; Q415-F419 WeakPolarHBondContact O-CD2 3.23Å; Q415-F419 PolarHBondContact O-N 3.33Å; A416-F419 PolarHBondContact O-N 3.5Å; A416-F419 VanDerWaalsContact O-N 3.1Å; F419-F421 PolarHBondContact O-N 3.44Å; F419-L422 PolarHBondContact O-N 3.3Å; F419-S423 PolarHBondContact O-N 3.43Å
420N84.7Confident88.2Confident2 Ų244.7 Ų44.71%0.01124%0.241CC..Hα-helixtrans-49.5-55.3167.8-83.380.7000111.1E399 A416 L422 S423 A424E399-N420 PolarHBondContact O-ND2 2.92Å; E399-N420 WeakPolarHBondContact OE2-CB 3.31Å; E399-N420 PolarHBondContact OE2-ND2 2.64Å; A416-N420 PolarHBondContact O-N 3.04Å; A416-N420 PolarHBondContact O-OD1 3.16Å; A416-N420 VanDerWaalsContact O-OD1 3.13Å; N420-L422 VanDerWaalsContact C-N 3.27Å; N420-L422 PolarHBondContact O-N 2.89Å; N420-S423 WeakPolarHBondContact O-CA 3.31Å; N420-S423 WeakPolarHBondContact O-CB 3.32Å; N420-S423 PolarHBondContact O-N 3.39Å; N420-A424 PolarHBondContact O-N 3.19Å
421F85.6Confident88.9Confident91 Ų9142 Ų4240%0.39921%0.213SC..Hα-helixtrans-63.5-32.3-177.8-178.6-100.6000113.2L182 L417 F419 C425L182-F421 HydrophobicContact CD1-CD2 4.42Å; L182-F421 HydrophobicContact CD2-CB 4.39Å; L182-F421 HydrophobicContact CD2-CD2 4.12Å; L417-F421 WeakPolarHBondContact O-CB 3.44Å; L417-F421 PolarHBondContact O-N 3.46Å; F419-F421 PolarHBondContact O-N 3.44Å; F421-C425 PolarHBondContact O-N 2.83Å; F421-C425 VanDerWaalsContact O-N 3.12Å; F421-C425 PolarHBondContact O-SG 2.85Å
422L87.2Confident89.5Confident86 Ų8642.3 Ų42.345%0.4522%0.218SC..Hα-helixtrans-68.9-35.4173.8-177.562.2000112F418 F419 N420 C425F418-L422 HydrophobicContact CE1-CD2 4.26Å; F418-L422 VanDerWaalsContact O-CB 3.22Å; F418-L422 WeakPolarHBondContact O-CB 3.18Å; F418-L422 PolarHBondContact O-N 2.97Å; F419-L422 PolarHBondContact O-N 3.3Å; N420-L422 VanDerWaalsContact C-N 3.27Å; N420-L422 PolarHBondContact O-N 2.89Å; L422-C425 WeakPolarHBondContact O-CB 3.34Å
423S89.3Confident89.9Confident2 Ų246 Ų461%0.01423%0.227CC..Hα-helixtrans-64.8-53.4170.3178.10000111.5D362 G363 F419 N420 C425 C426D362-S423 WeakPolarHBondContact OD1-CB 3.45Å; D362-S423 PolarHBondContact OD1-OG 2.73Å; D362-S423 WeakPolarHBondContact OD2-CB 3.34Å; D362-S423 PolarHBondContact OD2-OG 2.97Å; G363-S423 WeakPolarHBondContact CA-OG 3.39Å; G363-S423 PolarHBondContact N-OG 2.85Å; F419-S423 PolarHBondContact O-N 3.43Å; N420-S423 WeakPolarHBondContact O-CA 3.31Å; N420-S423 WeakPolarHBondContact O-CB 3.32Å; N420-S423 PolarHBondContact O-N 3.39Å; S423-C425 PolarHBondContact O-N 3.17Å; S423-C426 WeakPolarHBondContact O-CA 3.46Å; S423-C426 WeakPolarHBondContact O-CB 3.15Å; S423-C426 PolarHBondContact O-N 3.23Å
424A88.5Confident90.3Very high0 Ų041.9 Ų41.90%021%0.206CC..Hα-helixtrans-55.7-26178.700000113.3N366 N420 C426 C427N366-A424 WeakPolarHBondContact OD1-CA 3.28Å; N420-A424 PolarHBondContact O-N 3.19Å; A424-C426 VanDerWaalsContact C-N 3.3Å; A424-C426 PolarHBondContact O-N 3.49Å; A424-C427 WeakPolarHBondContact O-CB 3.38Å; A424-C427 PolarHBondContact O-N 2.7Å
425C89.6Confident90.7Very high42 Ų4236.6 Ų36.628%0.28418%0.181SC..Hα-helixtrans-65.7-26.2172.2-74.50000114F421 L422 S423 C427 Y428F421-C425 PolarHBondContact O-N 2.83Å; F421-C425 VanDerWaalsContact O-N 3.12Å; F421-C425 PolarHBondContact O-SG 2.85Å; L422-C425 WeakPolarHBondContact O-CB 3.34Å; S423-C425 PolarHBondContact O-N 3.17Å; C425-C427 PolarHBondContact O-N 3.38Å; C425-Y428 PolarHBondContact O-N 3.21Å
426C94.1Very high91Very high37 Ų3740.5 Ų40.525%0.2520%0.202CC..Hα-helixtrans-64-27.8172.4-75.10000112.6G363 F367 S423 A424 Y428 L429 G430G363-C426 VanDerWaalsContact O-CB 3.23Å; G363-C426 WeakPolarHBondContact O-CB 3.39Å; F367-C426 HydrophobicContact CB-CB 4.24Å; S423-C426 WeakPolarHBondContact O-CA 3.46Å; S423-C426 WeakPolarHBondContact O-CB 3.15Å; S423-C426 PolarHBondContact O-N 3.23Å; A424-C426 VanDerWaalsContact C-N 3.3Å; A424-C426 PolarHBondContact O-N 3.49Å; C426-Y428 VanDerWaalsContact C-N 3.32Å; C426-Y428 PolarHBondContact O-N 3.2Å; C426-L429 WeakPolarHBondContact O-CB 3.49Å; C426-L429 PolarHBondContact O-N 3.36Å; C426-L429 VanDerWaalsContact O-N 3.09Å; C426-G430 PolarHBondContact O-N 3.49Å
427C95.1Very high91.2Very high0 Ų041.7 Ų41.70%021%0.212CC..Hα-helixtrans-62.9-35.8175.7-169.50000112.7V174 N366 G370 A424 C425 L429 G430 M431V174-C427 HydrophobicContact CG1-CB 4.02Å; N366-C427 HydrophobicContact CB-CB 4.45Å; N366-C427 WeakPolarHBondContact O-CA 3.47Å; N366-C427 WeakPolarHBondContact O-CB 3.35Å; N366-C427 WeakPolarHBondContact OD1-CB 3.35Å; G370-C427 WeakPolarHBondContact CA-O 3.36Å; G370-C427 WeakPolarHBondContact CA-SG 3.17Å; G370-C427 PolarHBondContact N-SG 3.46Å; A424-C427 WeakPolarHBondContact O-CB 3.38Å; A424-C427 PolarHBondContact O-N 2.7Å; C425-C427 PolarHBondContact O-N 3.38Å; C427-L429 VanDerWaalsContact C-N 3.35Å; C427-L429 PolarHBondContact O-N 3.13Å; C427-G430 PolarHBondContact O-N 3Å; C427-M431 WeakPolarHBondContact O-CB 3.5Å; C427-M431 PolarHBondContact O-N 2.94Å
428Y95.9Very high91.2Very high73 Ų7340.1 Ų40.129%0.28621%0.205SC..Hα-helixtrans-65.6-36.9172.1-66.8-96.8000112.6L171 V174 T175 S178 C425 C426 G432L171-Y428 HydrophobicContact CD2-CD1 3.96Å; L171-Y428 HydrophobicContact CD2-CE1 4.29Å; V174-Y428 HydrophobicContact CB-CE1 4.44Å; V174-Y428 HydrophobicContact CG1-CD1 3.85Å; V174-Y428 HydrophobicContact CG1-CD2 3.64Å; V174-Y428 HydrophobicContact CG1-CE1 3.86Å; V174-Y428 HydrophobicContact CG1-CE2 3.65Å; V174-Y428 HydrophobicContact CG1-CG 3.75Å; T175-Y428 WeakPolarHBondContact CA-OH 3.46Å; T175-Y428 PolarHBondContact OG1-OH 3.04Å; S178-Y428 WeakPolarHBondContact OG-CE2 3.21Å; C425-Y428 PolarHBondContact O-N 3.21Å; C426-Y428 VanDerWaalsContact C-N 3.32Å; C426-Y428 PolarHBondContact O-N 3.2Å; Y428-G432 PolarHBondContact O-N 3.2Å
429L96.2Very high91Very high107 Ų10738.2 Ų38.256%0.5620%0.2SC*.Hα-helixtrans-68.7-43.4176-59.4179.2000110.6F367 C426 C427 G432 F433F367-L429 HydrophobicContact CD2-CB 4.26Å; F367-L429 HydrophobicContact CE2-CB 4.34Å; C426-L429 WeakPolarHBondContact O-CB 3.49Å; C426-L429 PolarHBondContact O-N 3.36Å; C426-L429 VanDerWaalsContact O-N 3.09Å; C427-L429 VanDerWaalsContact C-N 3.35Å; C427-L429 PolarHBondContact O-N 3.13Å; L429-G432 PolarHBondContact O-N 2.89Å; L429-F433 WeakPolarHBondContact O-CD2 3.35Å; L429-F433 PolarHBondContact O-N 3.22Å
430G96.8Very high90.6Very high0 Ų042 Ų420%023%0.227CC..Hα-helixtrans-54.4-53.4171.800000111.8F367 L371 C426 C427 G432 F433 G434F367-G430 WeakPolarHBondContact O-CA 3.4Å; L371-G430 WeakPolarHBondContact CA-O 3.46Å; L371-G430 VanDerWaalsContact N-C 3.29Å; L371-G430 PolarHBondContact N-O 2.67Å; C426-G430 PolarHBondContact O-N 3.49Å; C427-G430 PolarHBondContact O-N 3Å; G430-G432 PolarHBondContact O-N 2.82Å; G430-F433 CarbonylContact O-C 3.41Å; G430-F433 PolarHBondContact O-N 3.36Å; G430-F433 VanDerWaalsContact O-N 3.13Å; G430-G434 PolarHBondContact O-N 3.19Å
431M97.1Very high90.1Very high2 Ų249.3 Ų49.31%0.0126%0.259CS..Hα-helixtrans-60.1-43.2179-178.7-133.564.200112.2W167 L171 V174 G370 I373 C427 F433 G434 I435W167-M431 HydrophobicContact CE3-CE 3.75Å; W167-M431 HydrophobicContact CZ3-CE 3.52Å; L171-M431 HydrophobicContact CD2-CE 3.75Å; L171-M431 HydrophobicContact CD2-SD 4.02Å; L171-M431 HydrophobicContact CG-CE 4.1Å; L171-M431 HydrophobicContact CG-SD 4.1Å; L171-M431 PolarHBondContact N-SD 2.89Å; V174-M431 HydrophobicContact CG2-CB 3.95Å; V174-M431 HydrophobicContact CG2-CG 4.03Å; V174-M431 HydrophobicContact CG2-SD 4.1Å; G370-M431 WeakPolarHBondContact O-CA 3.49Å; G370-M431 PolarHBondContact O-N 3.47Å; I373-M431 HydrophobicContact CG2-CG 4.46Å; C427-M431 WeakPolarHBondContact O-CB 3.5Å; C427-M431 PolarHBondContact O-N 2.94Å; M431-F433 PolarHBondContact O-N 3.37Å; M431-G434 PolarHBondContact O-N 3.5Å; M431-I435 HydrophobicContact CE-CD1 4.05Å; M431-I435 HydrophobicContact CG-CD1 4.06Å; M431-I435 WeakPolarHBondContact O-CG1 3.49Å; M431-I435 PolarHBondContact O-N 3.3Å; M431-I435 HydrophobicContact SD-CD1 4.21Å
432G95.6Very high89.9Confident12 Ų1247.7 Ų47.712%0.12426%0.259CS..Hα-helixtrans-59.4-44.3173.800000112.6Y428 L429 G430 L436Y428-G432 PolarHBondContact O-N 3.2Å; L429-G432 PolarHBondContact O-N 2.89Å; G430-G432 PolarHBondContact O-N 2.82Å; G432-L436 WeakPolarHBondContact O-CB 3.13Å; G432-L436 WeakPolarHBondContact O-CD1 3.33Å; G432-L436 VanDerWaalsContact O-CG 3.22Å; G432-L436 WeakPolarHBondContact O-CG 3.05Å; G432-L436 PolarHBondContact O-N 3.46Å
433F94.9Very high89.7Confident133 Ų13344.5 Ų44.558%0.58324%0.244SC*.Hα-helixtrans-65.9-39.6173.7-95.2-88.7000112.8F367 L371 L429 G430 M431 L436 A437F367-F433 HydrophobicContact CE2-CD2 4.27Å; F367-F433 HydrophobicContact CZ-CB 4.3Å; F367-F433 HydrophobicContact CZ-CD2 4.4Å; F367-F433 HydrophobicContact CZ-CG 4.34Å; L371-F433 HydrophobicContact CD1-CB 3.77Å; L429-F433 WeakPolarHBondContact O-CD2 3.35Å; L429-F433 PolarHBondContact O-N 3.22Å; G430-F433 CarbonylContact O-C 3.41Å; G430-F433 PolarHBondContact O-N 3.36Å; G430-F433 VanDerWaalsContact O-N 3.13Å; M431-F433 PolarHBondContact O-N 3.37Å; F433-L436 PolarHBondContact O-N 2.99Å; F433-A437 WeakPolarHBondContact O-CB 3.17Å; F433-A437 PolarHBondContact O-N 3.31Å
434G94.9Very high89.7Confident0 Ų046.4 Ų46.40%025%0.254CS..Hα-helixtrans-64.5-43.1-177.800000112G430 M431 G438G430-G434 PolarHBondContact O-N 3.19Å; M431-G434 PolarHBondContact O-N 3.5Å; G434-G438 PolarHBondContact O-N 3.42Å
435I93.5Very high89.8Confident1 Ų156.2 Ų56.21%0.00529%0.291CS..Hα-helixtrans-65.8-48.9175.3-62.7167.9000110.7V166 W167 T378 M431 A437 G438 N439V166-I435 HydrophobicContact CG1-CB 4.35Å; V166-I435 HydrophobicContact CG1-CD1 3.96Å; V166-I435 HydrophobicContact CG1-CG1 3.74Å; V166-I435 HydrophobicContact CG1-CG2 3.76Å; W167-I435 HydrophobicContact CD2-CD1 3.76Å; W167-I435 HydrophobicContact CE3-CD1 3.92Å; W167-I435 HydrophobicContact CG-CD1 4.13Å; W167-I435 HydrophobicContact CZ2-CB 4.33Å; W167-I435 HydrophobicContact CZ2-CD1 4.4Å; W167-I435 HydrophobicContact CZ2-CG2 4.14Å; W167-I435 HydrophobicContact CZ3-CD1 4.32Å; T378-I435 HydrophobicContact CG2-CB 4.3Å; T378-I435 HydrophobicContact CG2-CG2 4.02Å; M431-I435 HydrophobicContact CE-CD1 4.05Å; M431-I435 HydrophobicContact CG-CD1 4.06Å; M431-I435 WeakPolarHBondContact O-CG1 3.49Å; M431-I435 PolarHBondContact O-N 3.3Å; M431-I435 HydrophobicContact SD-CD1 4.21Å; I435-A437 VanDerWaalsContact C-N 3.33Å; I435-A437 PolarHBondContact O-N 2.85Å; I435-G438 PolarHBondContact O-N 3.37Å; I435-N439 WeakPolarHBondContact O-CB 3.39Å; I435-N439 PolarHBondContact O-N 3.46Å
436L91.9Very high89.9Confident107 Ų10755 Ų5556%0.5628%0.281SS*.Hα-helixtrans-63.8-38.4-179.4-69.8171.8000112.1G432 F433 S440G432-L436 WeakPolarHBondContact O-CB 3.13Å; G432-L436 WeakPolarHBondContact O-CD1 3.33Å; G432-L436 VanDerWaalsContact O-CG 3.22Å; G432-L436 WeakPolarHBondContact O-CG 3.05Å; G432-L436 PolarHBondContact O-N 3.46Å; F433-L436 PolarHBondContact O-N 2.99Å; L436-S440 VanDerWaalsContact O-CB 3.26Å; L436-S440 WeakPolarHBondContact O-CB 3.37Å; L436-S440 PolarHBondContact O-N 3.09Å; L436-S440 VanDerWaalsContact O-N 3.15Å; L436-S440 PolarHBondContact O-OG 3.41Å
437A88.5Confident89.9Confident25 Ų2553.2 Ų53.221%0.20727%0.269CS..Hα-helixtrans-76-40.5178.800000112.4F433 I435 N439 S440 F441 I446F433-A437 WeakPolarHBondContact O-CB 3.17Å; F433-A437 PolarHBondContact O-N 3.31Å; I435-A437 VanDerWaalsContact C-N 3.33Å; I435-A437 PolarHBondContact O-N 2.85Å; A437-N439 VanDerWaalsContact C-N 3.28Å; A437-N439 PolarHBondContact O-N 3.4Å; A437-S440 PolarHBondContact O-N 2.75Å; A437-F441 CarbonylContact O-C 3.6Å; A437-F441 WeakPolarHBondContact O-CA 3.41Å; A437-F441 WeakPolarHBondContact O-CB 3.22Å; A437-F441 PolarHBondContact O-N 3.13Å; A437-I446 HydrophobicContact CB-CD1 3.79Å
438G83.8Confident89.8Confident3 Ų355.5 Ų55.53%0.03129%0.288CS..Hα-helixtrans-69.9-19.3175.600000114.9R160 G434 I435 F441R160-G438 PolarHBondContact NH2-O 2.84Å; G434-G438 PolarHBondContact O-N 3.42Å; I435-G438 PolarHBondContact O-N 3.37Å; G438-F441 CarbonylContact C-O 3.5Å
439N81.8Confident89.7Confident69 Ų6956.6 Ų56.637%0.36930%0.298SS..Hα-helixtrans-88.6-24.5168.5-82.3-3000113.5R160 D163 I435 A437R160-N439 PolarHBondContact NH2-OD1 2.86Å; D163-N439 PolarHBondContact OD1-ND2 3.23Å; I435-N439 WeakPolarHBondContact O-CB 3.39Å; I435-N439 PolarHBondContact O-N 3.46Å; A437-N439 VanDerWaalsContact C-N 3.28Å; A437-N439 PolarHBondContact O-N 3.4Å
440S76.9Confident89.6Confident89 Ų8951.5 Ų51.562%0.62227%0.272SS*.Hα-helixtrans-100.1-26-176.8-55.10000114.5L436 A437L436-S440 VanDerWaalsContact O-CB 3.26Å; L436-S440 WeakPolarHBondContact O-CB 3.37Å; L436-S440 PolarHBondContact O-N 3.09Å; L436-S440 VanDerWaalsContact O-N 3.15Å; L436-S440 PolarHBondContact O-OG 3.41Å; A437-S440 PolarHBondContact O-N 2.75Å
441F75.6Confident89.6Confident156 Ų15651.5 Ų51.568%0.68427%0.272SS*.SBendtrans-132.9171.3-179.5-58-81.3000108.9A437 G438A437-F441 CarbonylContact O-C 3.6Å; A437-F441 WeakPolarHBondContact O-CA 3.41Å; A437-F441 WeakPolarHBondContact O-CB 3.22Å; A437-F441 PolarHBondContact O-N 3.13Å; G438-F441 CarbonylContact C-O 3.5Å
442S80.1Confident89.5Confident58 Ų5853.5 Ų53.541%0.40629%0.293SS..  trans-70.2125.8172.6156.20000110N444S442-N444 PolarHBondContact O-N 2.8Å; S442-N444 VanDerWaalsContact OG-CB 3.29Å; S442-N444 WeakPolarHBondContact OG-CB 3.24Å; S442-N444 PolarHBondContact OG-N 3.08Å; S442-N444 PolarHBondContact OG-OD1 3.45Å
443P84.3Confident89.4Confident19 Ų1954 Ų5412%0.12329%0.292CS..THydrogen-bonded Turntrans-67.5-15.2-178.828.9-35.9000112.8A375 W445 I446 F447A375-P443 HydrophobicContact CB-CB 4.11Å; P443-W445 PolarHBondContact O-N 3.43Å; P443-W445 VanDerWaalsContact O-N 3.11Å; P443-I446 WeakPolarHBondContact O-CA 3.39Å; P443-I446 WeakPolarHBondContact O-CB 3.47Å; P443-I446 PolarHBondContact O-N 3.33Å; P443-F447 HydrophobicContact CB-CD2 4.36Å; P443-F447 HydrophobicContact CB-CE2 3.73Å; P443-F447 HydrophobicContact CB-CZ 3.85Å; P443-F447 HydrophobicContact CG-CE2 3.89Å; P443-F447 HydrophobicContact CG-CZ 4.31Å; P443-F447 WeakPolarHBondContact O-CD2 3.3Å; P443-F447 PolarHBondContact O-N 3.41Å
444N88.6Confident89.4Confident42 Ų4247.7 Ų47.723%0.22527%0.265CS..Hα-helixtrans-50.2-35.8176.7-57.758.4000113.4E222 A223 S442 F447 A448E222-N444 PolarHBondContact O-ND2 2.86Å; A223-N444 WeakPolarHBondContact CB-O 3.37Å; A223-N444 PolarHBondContact O-ND2 2.97Å; S442-N444 PolarHBondContact O-N 2.8Å; S442-N444 VanDerWaalsContact OG-CB 3.29Å; S442-N444 WeakPolarHBondContact OG-CB 3.24Å; S442-N444 PolarHBondContact OG-N 3.08Å; S442-N444 PolarHBondContact OG-OD1 3.45Å; N444-F447 PolarHBondContact O-N 2.93Å; N444-A448 WeakPolarHBondContact O-CB 3.48Å; N444-A448 PolarHBondContact O-N 2.97Å
445W90.2Very high89.4Confident206 Ų20649.8 Ų49.878%0.7828%0.275SS*.Hα-helixtrans-69.8-32.1175.8-68.7102.8000113.2P443 L449P443-W445 PolarHBondContact O-N 3.43Å; P443-W445 VanDerWaalsContact O-N 3.11Å; W445-L449 PolarHBondContact O-N 3.17Å
446I92.6Very high89.4Confident16 Ų1657.2 Ų57.28%0.08231%0.305CS..Hα-helixtrans-72-42.5173.4-60.4168.3000109.3L371 A375 A437 P443 A448 L449 A450L371-I446 HydrophobicContact CB-CG2 4.47Å; L371-I446 HydrophobicContact CD2-CG1 4.41Å; L371-I446 HydrophobicContact CD2-CG2 3.84Å; L371-I446 HydrophobicContact CG-CG1 4.49Å; L371-I446 HydrophobicContact CG-CG2 3.72Å; A375-I446 HydrophobicContact CB-CB 3.9Å; A375-I446 HydrophobicContact CB-CD1 3.8Å; A375-I446 HydrophobicContact CB-CG1 4.47Å; A375-I446 HydrophobicContact CB-CG2 3.61Å; A437-I446 HydrophobicContact CB-CD1 3.79Å; P443-I446 WeakPolarHBondContact O-CA 3.39Å; P443-I446 WeakPolarHBondContact O-CB 3.47Å; P443-I446 PolarHBondContact O-N 3.33Å; I446-A448 VanDerWaalsContact C-N 3.32Å; I446-A448 PolarHBondContact O-N 3.36Å; I446-L449 PolarHBondContact O-N 2.83Å; I446-A450 WeakPolarHBondContact O-CB 3.29Å; I446-A450 PolarHBondContact O-N 2.86Å
447F93.2Very high89.5Confident0 Ų052.5 Ų52.50%028%0.28CS..Hα-helixtrans-63.8-34.9175.4-55.9-37.9000112.7L219 E222 A223 A375 S376 A379 Q383 P443 N444 G451L219-F447 HydrophobicContact CD2-CD1 3.95Å; L219-F447 WeakPolarHBondContact O-CB 3.19Å; E222-F447 HydrophobicContact CB-CD2 3.89Å; E222-F447 HydrophobicContact CB-CE2 4.35Å; E222-F447 HydrophobicContact CG-CD2 3.41Å; E222-F447 VanDerWaalsContact CG-CD2 3.41Å; E222-F447 HydrophobicContact CG-CE2 3.44Å; E222-F447 VanDerWaalsContact CG-CE2 3.44Å; E222-F447 HydrophobicContact CG-CG 4.42Å; E222-F447 HydrophobicContact CG-CZ 4.45Å; A223-F447 HydrophobicContact CB-CB 4.09Å; A375-F447 HydrophobicContact CB-CD1 4.31Å; A375-F447 HydrophobicContact CB-CE1 3.67Å; A375-F447 HydrophobicContact CB-CZ 4.16Å; S376-F447 WeakPolarHBondContact OG-CE1 3.46Å; A379-F447 HydrophobicContact CB-CE2 4.27Å; A379-F447 HydrophobicContact CB-CZ 3.98Å; Q383-F447 VanDerWaalsContact NE2-CZ 3.25Å; P443-F447 HydrophobicContact CB-CD2 4.36Å; P443-F447 HydrophobicContact CB-CE2 3.73Å; P443-F447 HydrophobicContact CB-CZ 3.85Å; P443-F447 HydrophobicContact CG-CE2 3.89Å; P443-F447 HydrophobicContact CG-CZ 4.31Å; P443-F447 WeakPolarHBondContact O-CD2 3.3Å; P443-F447 PolarHBondContact O-N 3.41Å; N444-F447 PolarHBondContact O-N 2.93Å; F447-G451 WeakPolarHBondContact O-CA 3.32Å; F447-G451 PolarHBondContact O-N 3.3Å
448A94Very high89.7Confident47 Ų4751.3 Ų51.339%0.38827%0.27SS..Hα-helixtrans-63.4-45.8172.200000112A223 N444 I446 G452A223-A448 HydrophobicContact CB-CB 3.91Å; N444-A448 WeakPolarHBondContact O-CB 3.48Å; N444-A448 PolarHBondContact O-N 2.97Å; I446-A448 VanDerWaalsContact C-N 3.32Å; I446-A448 PolarHBondContact O-N 3.36Å; A448-G452 PolarHBondContact O-N 2.72Å; A448-G452 VanDerWaalsContact O-N 3.15Å
449L93.9Very high90.2Very high96 Ų9654.4 Ų54.450%0.50329%0.285SS..Hα-helixtrans-64.1-51.3178.3178.964.2000111.5L371 W445 I446 G452 M453L371-L449 HydrophobicContact CD2-CD2 4.18Å; W445-L449 PolarHBondContact O-N 3.17Å; I446-L449 PolarHBondContact O-N 2.83Å; L449-G452 PolarHBondContact O-N 2.72Å; L449-M453 WeakPolarHBondContact O-CB 3.42Å; L449-M453 PolarHBondContact O-N 3.47Å
450A94.6Very high90.7Very high1 Ų153.5 Ų53.51%0.00829%0.287CS..Hα-helixtrans-64-43179.100000111.7L219 A372 I446 G452 M453 F454L219-A450 HydrophobicContact CD1-CB 3.96Å; A372-A450 HydrophobicContact CB-CB 3.7Å; I446-A450 WeakPolarHBondContact O-CB 3.29Å; I446-A450 PolarHBondContact O-N 2.86Å; A450-G452 VanDerWaalsContact C-N 3.3Å; A450-G452 PolarHBondContact O-N 2.68Å; A450-M453 WeakPolarHBondContact O-CB 3.27Å; A450-M453 PolarHBondContact O-N 3.35Å; A450-M453 VanDerWaalsContact O-N 3.12Å; A450-F454 HydrophobicContact CB-CD1 4.48Å; A450-F454 HydrophobicContact CB-CE1 4.27Å; A450-F454 WeakPolarHBondContact O-CB 3.38Å; A450-F454 WeakPolarHBondContact O-CD1 3.29Å; A450-F454 WeakPolarHBondContact O-CG 3.37Å; A450-F454 PolarHBondContact O-N 2.9Å
451G95.1Very high91.3Very high0 Ų052.5 Ų52.50%028%0.275CS..Hα-helixtrans-61.4-35.9176.900000113.3F447 L455F447-G451 WeakPolarHBondContact O-CA 3.32Å; F447-G451 PolarHBondContact O-N 3.3Å; G451-L455 WeakPolarHBondContact O-CG 3.44Å; G451-L455 PolarHBondContact O-N 2.95Å
452G95.3Very high92.1Very high43 Ų4345.6 Ų45.644%0.44325%0.245SC..Hα-helixtrans-69.5-41171.600000113.1A448 L449 A450 Y456A448-G452 PolarHBondContact O-N 2.72Å; A448-G452 VanDerWaalsContact O-N 3.15Å; L449-G452 PolarHBondContact O-N 2.72Å; A450-G452 VanDerWaalsContact C-N 3.3Å; A450-G452 PolarHBondContact O-N 2.68Å; G452-Y456 PolarHBondContact O-N 2.95Å
453M93.4Very high92.7Very high24 Ų2444.7 Ų44.712%0.11823%0.234CC..Hα-helixtrans-63.8-48177.2-172.6-71.2-115.500111.4H365 I368 D369 L449 A450 L455 Y456 I457H365-M453 HydrophobicContact CB-CE 3.98Å; I368-M453 HydrophobicContact CB-CE 3.97Å; I368-M453 HydrophobicContact CD1-CG 4.12Å; I368-M453 HydrophobicContact CG2-CB 4.25Å; I368-M453 HydrophobicContact CG2-CE 3.92Å; I368-M453 HydrophobicContact CG2-CG 4.05Å; D369-M453 VanDerWaalsContact CG-CE 3.48Å; D369-M453 WeakPolarHBondContact OD1-CE 3.47Å; D369-M453 VanDerWaalsContact OD2-CE 3.23Å; D369-M453 WeakPolarHBondContact OD2-CE 3.21Å; L449-M453 WeakPolarHBondContact O-CB 3.42Å; L449-M453 PolarHBondContact O-N 3.47Å; A450-M453 WeakPolarHBondContact O-CB 3.27Å; A450-M453 PolarHBondContact O-N 3.35Å; A450-M453 VanDerWaalsContact O-N 3.12Å; M453-L455 VanDerWaalsContact C-N 3.31Å; M453-L455 PolarHBondContact O-N 3.48Å; M453-Y456 WeakPolarHBondContact O-CA 3.49Å; M453-Y456 VanDerWaalsContact O-CB 3.29Å; M453-Y456 WeakPolarHBondContact O-CB 3.19Å; M453-Y456 PolarHBondContact O-N 3.47Å; M453-I457 HydrophobicContact CE-CD1 3.83Å; M453-I457 PolarHBondContact O-N 2.92Å; M453-I457 HydrophobicContact SD-CD1 3.33Å; M453-I457 WeakPolarHBondContact SD-CD1 3.32Å; M453-I457 HydrophobicContact SD-CG1 3.72Å
454F94.9Very high93Very high0 Ų046.8 Ų46.80%025%0.247CC..Hα-helixtrans-63.9-35.8-178.3-78.437.5000111.7L211 N214 A215 L219 D369 A372 T387 I391 A450 Y456 A458L211-F454 HydrophobicContact CD2-CD2 3.77Å; L211-F454 HydrophobicContact CD2-CE2 4.02Å; L211-F454 HydrophobicContact CD2-CG 4.36Å; N214-F454 HydrophobicContact CB-CD2 4.32Å; N214-F454 WeakPolarHBondContact ND2-CE2 3.43Å; A215-F454 HydrophobicContact CB-CB 4.18Å; L219-F454 HydrophobicContact CD1-CD1 4.25Å; L219-F454 HydrophobicContact CD1-CD2 3.68Å; L219-F454 HydrophobicContact CD1-CE1 4.34Å; L219-F454 HydrophobicContact CD1-CE2 3.83Å; L219-F454 HydrophobicContact CD1-CG 3.91Å; L219-F454 HydrophobicContact CD1-CZ 4.14Å; D369-F454 WeakPolarHBondContact OD1-CE1 3.37Å; D369-F454 WeakPolarHBondContact OD1-CZ 3.48Å; A372-F454 HydrophobicContact CB-CE1 4.43Å; A372-F454 HydrophobicContact CB-CZ 4.33Å; T387-F454 HydrophobicContact CG2-CZ 4.47Å; I391-F454 HydrophobicContact CD1-CZ 3.92Å; I391-F454 HydrophobicContact CG1-CE2 4.01Å; I391-F454 HydrophobicContact CG1-CZ 3.59Å; A450-F454 HydrophobicContact CB-CD1 4.48Å; A450-F454 HydrophobicContact CB-CE1 4.27Å; A450-F454 WeakPolarHBondContact O-CB 3.38Å; A450-F454 WeakPolarHBondContact O-CD1 3.29Å; A450-F454 WeakPolarHBondContact O-CG 3.37Å; A450-F454 PolarHBondContact O-N 2.9Å; F454-Y456 VanDerWaalsContact C-N 3.32Å; F454-A458 WeakPolarHBondContact O-CB 3.39Å; F454-A458 PolarHBondContact O-N 3.11Å
455L95.3Very high93Very high43 Ų4348.4 Ų48.423%0.22525%0.254CS..Hα-helixtrans-66.5-33.6171-75.1178.2000112.4Y212 A215 I220 G451 M453 L459Y212-L455 HydrophobicContact CD2-CD2 3.38Å; Y212-L455 HydrophobicContact CE2-CD2 3.75Å; Y212-L455 HydrophobicContact CG-CD2 4.09Å; A215-L455 HydrophobicContact CB-CD2 3.97Å; A215-L455 HydrophobicContact CB-CG 3.76Å; I220-L455 HydrophobicContact CD1-CD1 3.6Å; I220-L455 HydrophobicContact CD1-CG 4.37Å; G451-L455 WeakPolarHBondContact O-CG 3.44Å; G451-L455 PolarHBondContact O-N 2.95Å; M453-L455 VanDerWaalsContact C-N 3.31Å; M453-L455 PolarHBondContact O-N 3.48Å; L455-L459 VanDerWaalsContact O-CB 3.28Å; L455-L459 WeakPolarHBondContact O-CB 3.41Å; L455-L459 VanDerWaalsContact O-CG 3.29Å; L455-L459 WeakPolarHBondContact O-CG 3.37Å; L455-L459 PolarHBondContact O-N 3.43Å
456Y94.6Very high93Very high158 Ų15838.6 Ų38.662%0.6222%0.217SC*.Hα-helixtrans-68.5-54.3175.9-178.5-88.6000111.2G452 M453 F454 A458 L459 A460G452-Y456 PolarHBondContact O-N 2.95Å; M453-Y456 WeakPolarHBondContact O-CA 3.49Å; M453-Y456 VanDerWaalsContact O-CB 3.29Å; M453-Y456 WeakPolarHBondContact O-CB 3.19Å; M453-Y456 PolarHBondContact O-N 3.47Å; F454-Y456 VanDerWaalsContact C-N 3.32Å; Y456-A458 VanDerWaalsContact C-N 3.34Å; Y456-A458 PolarHBondContact O-N 3.26Å; Y456-L459 PolarHBondContact O-N 3.34Å; Y456-A460 HydrophobicContact CD1-CB 4.49Å; Y456-A460 HydrophobicContact CD2-CB 3.92Å; Y456-A460 HydrophobicContact CE1-CB 4.35Å; Y456-A460 HydrophobicContact CE2-CB 3.78Å; Y456-A460 HydrophobicContact CG-CB 4.28Å; Y456-A460 WeakPolarHBondContact O-CA 3.3Å; Y456-A460 VanDerWaalsContact O-CB 3.26Å; Y456-A460 WeakPolarHBondContact O-CB 3.37Å; Y456-A460 PolarHBondContact O-N 2.99Å
457I92Very high92.8Very high7 Ų739.5 Ų39.54%0.03622%0.222CC..Iπ-helixtrans-57.6-47.8178.6-64.9-173.6000110.7L211 H365 M453 L459 D461 M462L211-I457 HydrophobicContact CD1-CB 4.46Å; L211-I457 HydrophobicContact CD1-CG2 3.99Å; H365-I457 HydrophobicContact CB-CD1 3.97Å; M453-I457 HydrophobicContact CE-CD1 3.83Å; M453-I457 PolarHBondContact O-N 2.92Å; M453-I457 HydrophobicContact SD-CD1 3.33Å; M453-I457 WeakPolarHBondContact SD-CD1 3.32Å; M453-I457 HydrophobicContact SD-CG1 3.72Å; I457-L459 VanDerWaalsContact C-N 3.34Å; I457-L459 PolarHBondContact O-N 3.23Å; I457-D461 WeakPolarHBondContact O-CB 3.5Å; I457-D461 PolarHBondContact O-N 3.34Å; I457-M462 HydrophobicContact CG2-CG 3.96Å; I457-M462 PolarHBondContact O-N 3.43Å
458A94.6Very high92.5Very high0 Ų043.4 Ų43.40%024%0.24CC..Iπ-helixtrans-62.5-34.8-177.700000114.1I208 L211 F454 Y456 F463I208-A458 HydrophobicContact CG2-CB 4.48Å; L211-A458 HydrophobicContact CB-CB 3.9Å; L211-A458 HydrophobicContact CD1-CB 4.24Å; F454-A458 WeakPolarHBondContact O-CB 3.39Å; F454-A458 PolarHBondContact O-N 3.11Å; Y456-A458 VanDerWaalsContact C-N 3.34Å; Y456-A458 PolarHBondContact O-N 3.26Å; A458-F463 VanDerWaalsContact O-CB 3.23Å; A458-F463 WeakPolarHBondContact O-CB 3.49Å; A458-F463 PolarHBondContact O-N 3.17Å
459L94.1Very high92Very high68 Ų6841.8 Ų41.836%0.35623%0.225SC..Iπ-helixtrans-105.4-32.8-172.5-62.2177.3000114.8Y212 F244 L455 Y456 I457 P464Y212-L459 HydrophobicContact CD2-CD1 4.05Å; Y212-L459 HydrophobicContact CD2-CD2 3.72Å; Y212-L459 HydrophobicContact CD2-CG 3.93Å; Y212-L459 HydrophobicContact CE2-CD1 3.92Å; Y212-L459 HydrophobicContact CE2-CD2 3.89Å; Y212-L459 HydrophobicContact CE2-CG 4.22Å; F244-L459 HydrophobicContact CD2-CD2 4.23Å; F244-L459 HydrophobicContact CE2-CD2 3.74Å; F244-L459 HydrophobicContact CZ-CD2 4.1Å; L455-L459 VanDerWaalsContact O-CB 3.28Å; L455-L459 WeakPolarHBondContact O-CB 3.41Å; L455-L459 VanDerWaalsContact O-CG 3.29Å; L455-L459 WeakPolarHBondContact O-CG 3.37Å; L455-L459 PolarHBondContact O-N 3.43Å; Y456-L459 PolarHBondContact O-N 3.34Å; I457-L459 VanDerWaalsContact C-N 3.34Å; I457-L459 PolarHBondContact O-N 3.23Å; L459-P464 WeakPolarHBondContact O-CD 3.41Å
460A92.1Very high91.6Very high50 Ų5037.3 Ų37.341%0.41320%0.202SC..Iπ-helixtrans-101.8-18.2-17300000113.4Y456Y456-A460 HydrophobicContact CD1-CB 4.49Å; Y456-A460 HydrophobicContact CD2-CB 3.92Å; Y456-A460 HydrophobicContact CE1-CB 4.35Å; Y456-A460 HydrophobicContact CE2-CB 3.78Å; Y456-A460 HydrophobicContact CG-CB 4.28Å; Y456-A460 WeakPolarHBondContact O-CA 3.3Å; Y456-A460 VanDerWaalsContact O-CB 3.26Å; Y456-A460 WeakPolarHBondContact O-CB 3.37Å; Y456-A460 PolarHBondContact O-N 2.99Å
461D89.6Confident91Very high69 Ų6943.4 Ų43.437%0.36923%0.225SC..Iπ-helixtrans-116.6-71.2-178.3-157.6-17.2000111.1H398 I457 F463 P464 E465H398-D461 IonicContact CE1-OD2 2.99Å; I457-D461 WeakPolarHBondContact O-CB 3.5Å; I457-D461 PolarHBondContact O-N 3.34Å; D461-F463 PolarHBondContact O-N 2.75Å; D461-P464 VanDerWaalsContact O-CD 3.26Å; D461-P464 WeakPolarHBondContact O-CD 3.23Å; D461-E465 PolarHBondContact O-N 2.97Å; D461-E465 VanDerWaalsContact O-N 3.15Å
462M91.2Very high90.3Very high11 Ų1147.9 Ų47.95%0.05425%0.246CC..Hα-helixtrans-65.8-35.9-175.3-70.4-68.295.200113.9I204 I208 H398 I457 E465 M466I204-M462 HydrophobicContact CG2-CB 4.21Å; I204-M462 WeakPolarHBondContact CG2-O 3.34Å; I204-M462 HydrophobicContact CG2-SD 4.03Å; I208-M462 HydrophobicContact CD1-CB 4.22Å; I208-M462 HydrophobicContact CG1-CB 3.64Å; H398-M462 VanDerWaalsContact NE2-CE 3.32Å; H398-M462 WeakPolarHBondContact NE2-CE 3.18Å; I457-M462 HydrophobicContact CG2-CG 3.96Å; I457-M462 PolarHBondContact O-N 3.43Å; M462-E465 HydrophobicContact CE-CB 4.47Å; M462-E465 PolarHBondContact O-N 3.44Å; M462-M466 VanDerWaalsContact O-CB 3.31Å; M462-M466 WeakPolarHBondContact O-CB 3.23Å; M462-M466 PolarHBondContact O-N 3.08Å
463F92.7Very high89.3Confident38 Ų3846.3 Ų46.317%0.16723%0.227CC..Hα-helixtrans-69.7-42.3179.2-178.8-90.4000113.4I208 F244 F248 A458 D461 M466 N467I208-F463 HydrophobicContact CD1-CB 4.07Å; I208-F463 HydrophobicContact CD1-CD2 4.39Å; I208-F463 HydrophobicContact CG1-CB 4.47Å; I208-F463 HydrophobicContact CG2-CD2 4.49Å; F244-F463 HydrophobicContact CE2-CD2 4.27Å; F244-F463 AromaticContact CE2-CE2 3.99Å; F244-F463 HydrophobicContact CE2-CE2 3.99Å; F244-F463 HydrophobicContact CE2-CZ 4.37Å; F244-F463 AromaticContact CZ-CD2 3.83Å; F244-F463 HydrophobicContact CZ-CD2 3.83Å; F244-F463 AromaticContact CZ-CE2 3.73Å; F244-F463 HydrophobicContact CZ-CE2 3.73Å; F248-F463 AromaticContact CD2-CE2 3.58Å; F248-F463 HydrophobicContact CD2-CE2 3.58Å; F248-F463 AromaticContact CD2-CZ 3.79Å; F248-F463 HydrophobicContact CD2-CZ 3.79Å; F248-F463 HydrophobicContact CE2-CE2 4.08Å; F248-F463 HydrophobicContact CG-CE2 4.38Å; A458-F463 VanDerWaalsContact O-CB 3.23Å; A458-F463 WeakPolarHBondContact O-CB 3.49Å; A458-F463 PolarHBondContact O-N 3.17Å; D461-F463 PolarHBondContact O-N 2.75Å; F463-M466 HydrophobicContact CD2-CE 3.55Å; F463-M466 HydrophobicContact CE2-CE 3.74Å; F463-M466 HydrophobicContact CG-CE 4.39Å; F463-N467 WeakPolarHBondContact CE1-ND2 3.38Å; F463-N467 PolarHBondContact O-N 3.36Å; F463-N467 PolarHBondContact O-ND2 2.94Å
464P91.4Very high88.4Confident63 Ų6346.4 Ų46.441%0.40923%0.227SC..Hα-helixtrans-53.9-50.5163.9-32.238.4000113.8L459 D461 M466 N467 E468L459-P464 WeakPolarHBondContact O-CD 3.41Å; D461-P464 VanDerWaalsContact O-CD 3.26Å; D461-P464 WeakPolarHBondContact O-CD 3.23Å; P464-M466 PolarHBondContact O-N 3.27Å; P464-N467 CarbonylContact O-C 3.59Å; P464-N467 WeakPolarHBondContact O-CA 3.32Å; P464-N467 WeakPolarHBondContact O-CB 3.34Å; P464-N467 PolarHBondContact O-N 3.09Å; P464-E468 PolarHBondContact O-N 3.06Å
465E88.3Confident87.4Confident76 Ų7652 Ų5236%0.35526%0.257SS..Hα-helixtrans-60.8-42.6-179.3178.256.9-161.900112.4I204 D461 M462 N467 E468 V469I204-E465 HydrophobicContact CD1-CG 4.23Å; D461-E465 PolarHBondContact O-N 2.97Å; D461-E465 VanDerWaalsContact O-N 3.15Å; M462-E465 HydrophobicContact CE-CB 4.47Å; M462-E465 PolarHBondContact O-N 3.44Å; E465-N467 PolarHBondContact O-N 3.11Å; E465-N467 VanDerWaalsContact O-N 3.13Å; E465-E468 WeakPolarHBondContact O-CB 3.12Å; E465-E468 PolarHBondContact O-N 3.4Å; E465-E468 VanDerWaalsContact O-N 3.1Å; E465-V469 HydrophobicContact CG-CG2 4.48Å; E465-V469 WeakPolarHBondContact O-CG2 3.34Å; E465-V469 PolarHBondContact O-N 3.37Å; E465-V469 WeakPolarHBondContact OE1-CG2 3.43Å
466M90Very high86.2Confident0 Ų053.2 Ų53.20%027%0.273CS..Hα-helixtrans-56.5-30.6172.7-169.9-164.952.500112.6L201 I204 A205 I208 F248 M462 F463 P464 S470 Q488 L492L201-M466 HydrophobicContact CD1-CG 3.82Å; L201-M466 WeakPolarHBondContact CD1-O 3.46Å; I204-M466 HydrophobicContact CG2-CB 3.79Å; I204-M466 HydrophobicContact CG2-CG 4.39Å; A205-M466 HydrophobicContact CB-CG 4.42Å; A205-M466 HydrophobicContact CB-SD 3.72Å; I208-M466 HydrophobicContact CD1-CB 3.82Å; I208-M466 HydrophobicContact CD1-CE 3.95Å; I208-M466 HydrophobicContact CD1-CG 4.18Å; I208-M466 HydrophobicContact CD1-SD 3.64Å; F248-M466 HydrophobicContact CE2-CE 3.84Å; F248-M466 HydrophobicContact CZ-CE 4.41Å; M462-M466 VanDerWaalsContact O-CB 3.31Å; M462-M466 WeakPolarHBondContact O-CB 3.23Å; M462-M466 PolarHBondContact O-N 3.08Å; F463-M466 HydrophobicContact CD2-CE 3.55Å; F463-M466 HydrophobicContact CE2-CE 3.74Å; F463-M466 HydrophobicContact CG-CE 4.39Å; P464-M466 PolarHBondContact O-N 3.27Å; M466-S470 VanDerWaalsContact O-CB 3.3Å; M466-S470 WeakPolarHBondContact O-CB 3.23Å; M466-S470 PolarHBondContact O-N 3.44Å; M466-Q488 HydrophobicContact CG-CG 4.02Å; M466-Q488 PolarHBondContact O-NE2 2.99Å; M466-Q488 HydrophobicContact SD-CB 4.18Å; M466-Q488 HydrophobicContact SD-CG 3.9Å; M466-L492 HydrophobicContact CE-CD1 4.3Å; M466-L492 HydrophobicContact SD-CD1 4.24Å; M466-L492 HydrophobicContact SD-CG 4.43Å
467N88.6Confident84.7Confident36 Ų3647.1 Ų47.119%0.19326%0.258CS..Hα-helixtrans-84.8-32.9177.1-74.8-63.1000113K252 F463 P464 E465 R471K252-N467 VanDerWaalsContact CE-OD1 3.23Å; K252-N467 WeakPolarHBondContact CE-OD1 3.43Å; K252-N467 PolarHBondContact NZ-OD1 3.33Å; F463-N467 WeakPolarHBondContact CE1-ND2 3.38Å; F463-N467 PolarHBondContact O-N 3.36Å; F463-N467 PolarHBondContact O-ND2 2.94Å; P464-N467 CarbonylContact O-C 3.59Å; P464-N467 WeakPolarHBondContact O-CA 3.32Å; P464-N467 WeakPolarHBondContact O-CB 3.34Å; P464-N467 PolarHBondContact O-N 3.09Å; E465-N467 PolarHBondContact O-N 3.11Å; E465-N467 VanDerWaalsContact O-N 3.13Å; N467-R471 PolarHBondContact O-N 3.2Å; N467-R471 VanDerWaalsContact O-N 3.08Å
468E87.2Confident83.1Confident82 Ų8249.1 Ų49.138%0.38328%0.281SS..Hα-helixtrans-60.1-58171.4-173.667.4-124.400110.6P464 E465 S470 R471 E472P464-E468 PolarHBondContact O-N 3.06Å; E465-E468 WeakPolarHBondContact O-CB 3.12Å; E465-E468 PolarHBondContact O-N 3.4Å; E465-E468 VanDerWaalsContact O-N 3.1Å; E468-S470 PolarHBondContact O-N 2.76Å; E468-R471 WeakPolarHBondContact O-CB 3.4Å; E468-R471 PolarHBondContact O-N 3.41Å; E468-R471 IonicContact OE1-CZ 3.67Å; E468-R471 IonicContact OE1-NE 3.56Å; E468-R471 IonicContact OE1-NH2 2.57Å; E468-R471 PolarHBondContact OE1-NH2 3.4Å; E468-R471 IonicContact OE2-CZ 2.62Å; E468-R471 IonicContact OE2-NH2 3.82Å; E468-R471 PolarHBondContact OE2-NH2 3.2Å; E468-E472 PolarHBondContact O-N 2.97Å; E468-E472 VanDerWaalsContact O-N 3.15Å
469V83.7Confident81.5Confident12 Ų1254.9 Ų54.97%0.07332%0.321CS..Hα-helixtrans-59.3-33.5178.4177.30000112.2L201 I204 E465 E473L201-V469 HydrophobicContact CB-CG1 4.29Å; L201-V469 HydrophobicContact CD1-CB 4.29Å; L201-V469 HydrophobicContact CD1-CG1 4.17Å; I204-V469 HydrophobicContact CD1-CG2 4.46Å; E465-V469 HydrophobicContact CG-CG2 4.48Å; E465-V469 WeakPolarHBondContact O-CG2 3.34Å; E465-V469 PolarHBondContact O-N 3.37Å; E465-V469 WeakPolarHBondContact OE1-CG2 3.43Å; V469-E473 PolarHBondContact O-N 3.38Å
470S84Confident80.5Confident3 Ų356.2 Ų56.22%0.02132%0.321CS..Hα-helixtrans-65.5-43.8174.3-177.60000112.4M466 E468 E472 E473 E474 T484 Q488M466-S470 VanDerWaalsContact O-CB 3.3Å; M466-S470 WeakPolarHBondContact O-CB 3.23Å; M466-S470 PolarHBondContact O-N 3.44Å; E468-S470 PolarHBondContact O-N 2.76Å; S470-E472 VanDerWaalsContact C-N 3.34Å; S470-E473 PolarHBondContact O-N 2.85Å; S470-E474 WeakPolarHBondContact O-CG 3.48Å; S470-E474 PolarHBondContact O-N 3.48Å; S470-E474 PolarHBondContact OG-OE1 3.35Å; S470-T484 WeakPolarHBondContact OG-CG2 3.14Å; S470-Q488 VanDerWaalsContact CB-NE2 3.25Å; S470-Q488 PolarHBondContact OG-NE2 2.76Å
471R82.3Confident79.8Confident129 Ų12954.7 Ų54.749%0.48731%0.305SS..Hα-helixtrans-61.8-42.9178.5178.617565.3-161.33.3110.9N467 E468 E473 E474 D475N467-R471 PolarHBondContact O-N 3.2Å; N467-R471 VanDerWaalsContact O-N 3.08Å; E468-R471 WeakPolarHBondContact O-CB 3.4Å; E468-R471 PolarHBondContact O-N 3.41Å; E468-R471 IonicContact OE1-CZ 3.67Å; E468-R471 IonicContact OE1-NE 3.56Å; E468-R471 IonicContact OE1-NH2 2.57Å; E468-R471 PolarHBondContact OE1-NH2 3.4Å; E468-R471 IonicContact OE2-CZ 2.62Å; E468-R471 IonicContact OE2-NH2 3.82Å; E468-R471 PolarHBondContact OE2-NH2 3.2Å; R471-E473 PolarHBondContact O-N 2.81Å; R471-E474 WeakPolarHBondContact O-CB 3.44Å; R471-E474 PolarHBondContact O-N 2.91Å; R471-D475 PolarHBondContact O-N 2.9Å
472E80.5Confident79.5Confident93 Ų9357 Ų5744%0.43532%0.317SS..Hα-helixtrans-58.8-46.6175.2-66.3-164.1130.200113.3K197 E468 S470 E474 A476K197-E472 IonicContact NZ-OE1 3.33Å; K197-E472 IonicContact NZ-OE2 2.72Å; K197-E472 PolarHBondContact NZ-OE2 2.99Å; E468-E472 PolarHBondContact O-N 2.97Å; E468-E472 VanDerWaalsContact O-N 3.15Å; S470-E472 VanDerWaalsContact C-N 3.34Å; E472-E474 VanDerWaalsContact C-N 3.31Å; E472-E474 PolarHBondContact O-N 2.96Å; E472-A476 VanDerWaalsContact O-CB 3.23Å; E472-A476 WeakPolarHBondContact O-CB 3.22Å; E472-A476 PolarHBondContact O-N 3.11Å; E472-A476 VanDerWaalsContact O-N 3.13Å
473E75.1Confident79.3Confident10 Ų1060.5 Ų60.55%0.04734%0.335CS..Hα-helixtrans-66.2-31.2177.4-85.8-113.2156.900112.5R198 V469 S470 R471 T484R198-E473 IonicContact CZ-OE2 3.31Å; R198-E473 VanDerWaalsContact CZ-OE2 3.31Å; R198-E473 IonicContact NE-OE1 3.44Å; R198-E473 PolarHBondContact NE-OE1 2.81Å; R198-E473 IonicContact NE-OE2 2.89Å; R198-E473 PolarHBondContact NE-OE2 2.62Å; R198-E473 IonicContact NH2-OE2 2.82Å; R198-E473 PolarHBondContact NH2-OE2 2.82Å; V469-E473 PolarHBondContact O-N 3.38Å; S470-E473 PolarHBondContact O-N 2.85Å; R471-E473 PolarHBondContact O-N 2.81Å; E473-T484 HydrophobicContact CB-CG2 4.26Å
474E74.1Confident79Confident26 Ų2658.7 Ų58.712%0.12133%0.327CS..Hα-helixtrans-69.7-50.6176.9-78.1-179.5-130.300112.5K259 S470 R471 E472 A476 G477 G478 F481K259-E474 IonicContact NZ-OE2 2.7Å; K259-E474 PolarHBondContact NZ-OE2 3.18Å; S470-E474 WeakPolarHBondContact O-CG 3.48Å; S470-E474 PolarHBondContact O-N 3.48Å; S470-E474 PolarHBondContact OG-OE1 3.35Å; R471-E474 WeakPolarHBondContact O-CB 3.44Å; R471-E474 PolarHBondContact O-N 2.91Å; E472-E474 VanDerWaalsContact C-N 3.31Å; E472-E474 PolarHBondContact O-N 2.96Å; E474-A476 VanDerWaalsContact C-N 3.27Å; E474-A476 PolarHBondContact O-N 3.23Å; E474-G477 CarbonylContact O-C 3.24Å; E474-G477 VanDerWaalsContact O-C 3.24Å; E474-G477 PolarHBondContact O-N 3.11Å; E474-G478 PolarHBondContact O-N 2.93Å; E474-G478 VanDerWaalsContact O-N 3.15Å; E474-F481 HydrophobicContact CG-CB 4.47Å; E474-F481 HydrophobicContact CG-CD2 3.7Å; E474-F481 HydrophobicContact CG-CE2 4.29Å; E474-F481 HydrophobicContact CG-CG 4.43Å; E474-F481 WeakPolarHBondContact OE1-CE2 3.33Å; E474-F481 WeakPolarHBondContact OE2-CD2 3.33Å; E474-F481 VanDerWaalsContact OE2-CE2 3.27Å; E474-F481 WeakPolarHBondContact OE2-CE2 3.4Å
475D73.5Confident78.9Confident119 Ų11957.2 Ų57.264%0.63631%0.314SS*.Hα-helixtrans-71.5-27.3-176.2-66.6-21.3000111R471 G477R471-D475 PolarHBondContact O-N 2.9Å; D475-G477 PolarHBondContact O-N 2.87Å
476A71.3Confident79Confident68 Ų6855.3 Ų55.356%0.56232%0.315SS*.THydrogen-bonded Turntrans-73.12.9167.700000114.9E472 E474 R480E472-A476 VanDerWaalsContact O-CB 3.23Å; E472-A476 WeakPolarHBondContact O-CB 3.22Å; E472-A476 PolarHBondContact O-N 3.11Å; E472-A476 VanDerWaalsContact O-N 3.13Å; E474-A476 VanDerWaalsContact C-N 3.27Å; E474-A476 PolarHBondContact O-N 3.23Å; A476-R480 PolarHBondContact O-NH1 3.34Å
477G62.8Low79.1Confident29 Ų2956.8 Ų56.830%0.29932%0.323SS..  trans155.294.2167.800000114.8E474 D475 S479 R480E474-G477 CarbonylContact O-C 3.24Å; E474-G477 VanDerWaalsContact O-C 3.24Å; E474-G477 PolarHBondContact O-N 3.11Å; D475-G477 PolarHBondContact O-N 2.87Å; G477-S479 PolarHBondContact O-N 2.95Å; G477-R480 WeakPolarHBondContact O-CB 3.25Å; G477-R480 PolarHBondContact O-N 2.84Å
478G58.1Low79.3Confident50 Ų5055.1 Ų55.152%0.51531%0.314SS..G310 helixtrans-54.5-19-167.900000118.5E474 R480 F481E474-G478 PolarHBondContact O-N 2.93Å; E474-G478 VanDerWaalsContact O-N 3.15Å; G478-R480 PolarHBondContact O-N 3.3Å; G478-F481 PolarHBondContact O-N 3.18Å
479S60.7Low79.7Confident120 Ų12051.9 Ų51.984%0.83930%0.299SS*.G310 helixtrans-67.3-15.4171-167.70000113.1G477G477-S479 PolarHBondContact O-N 2.95Å
480R73.4Confident80.3Confident96 Ų9653.3 Ų53.336%0.36231%0.312SS..G310 helixtrans-78.5-17177.3-69.4177.9177.6144.12114.1A476 G477 G478 L482 I483 T484A476-R480 PolarHBondContact O-NH1 3.34Å; G477-R480 WeakPolarHBondContact O-CB 3.25Å; G477-R480 PolarHBondContact O-N 2.84Å; G478-R480 PolarHBondContact O-N 3.3Å; R480-L482 VanDerWaalsContact C-N 3.29Å; R480-L482 PolarHBondContact O-N 3.23Å; R480-L482 VanDerWaalsContact O-N 3.13Å; R480-I483 WeakPolarHBondContact O-CA 3.43Å; R480-I483 WeakPolarHBondContact O-CB 3.49Å; R480-I483 PolarHBondContact O-N 3.25Å; R480-T484 PolarHBondContact O-N 2.9Å; R480-T484 PolarHBondContact O-OG1 3.24Å
481F78.4Confident80.8Confident19 Ų1953.2 Ų53.28%0.08331%0.311CS..Hα-helixtrans-44-52.6-175.1-174.2-70.2000112.7V256 E474 G478 I483 T484 F485V256-F481 HydrophobicContact CG2-CD1 3.64Å; V256-F481 HydrophobicContact CG2-CE1 3.11Å; V256-F481 HydrophobicContact CG2-CE2 4.48Å; V256-F481 HydrophobicContact CG2-CZ 3.62Å; E474-F481 HydrophobicContact CG-CB 4.47Å; E474-F481 HydrophobicContact CG-CD2 3.7Å; E474-F481 HydrophobicContact CG-CE2 4.29Å; E474-F481 HydrophobicContact CG-CG 4.43Å; E474-F481 WeakPolarHBondContact OE1-CE2 3.33Å; E474-F481 WeakPolarHBondContact OE2-CD2 3.33Å; E474-F481 VanDerWaalsContact OE2-CE2 3.27Å; E474-F481 WeakPolarHBondContact OE2-CE2 3.4Å; G478-F481 PolarHBondContact O-N 3.18Å; F481-I483 PolarHBondContact O-N 3.12Å; F481-T484 PolarHBondContact O-N 3.35Å; F481-T484 VanDerWaalsContact O-N 3.16Å; F481-F485 HydrophobicContact CD1-CB 4.16Å; F481-F485 HydrophobicContact CE1-CB 3.82Å; F481-F485 HydrophobicContact CE1-CG 4.24Å; F481-F485 WeakPolarHBondContact O-CB 3.49Å; F481-F485 PolarHBondContact O-N 3Å
482L82.7Confident81.5Confident117 Ų11747.1 Ų47.161%0.61329%0.289SS*.Hα-helixtrans-65.1-26.5-175-65174.4000112.8R480 G486R480-L482 VanDerWaalsContact C-N 3.29Å; R480-L482 PolarHBondContact O-N 3.23Å; R480-L482 VanDerWaalsContact O-N 3.13Å; L482-G486 PolarHBondContact O-N 3.5Å
483I86.6Confident82.3Confident84 Ų8446 Ų4643%0.43129%0.286SS..Hα-helixtrans-77.1-46.1174.6-52.9171.6000109.7R480 F481 F485 G486 I487R480-I483 WeakPolarHBondContact O-CA 3.43Å; R480-I483 WeakPolarHBondContact O-CB 3.49Å; R480-I483 PolarHBondContact O-N 3.25Å; F481-I483 PolarHBondContact O-N 3.12Å; I483-F485 PolarHBondContact O-N 3.22Å; I483-G486 PolarHBondContact O-N 3.35Å; I483-I487 HydrophobicContact CG2-CD1 3.94Å; I483-I487 VanDerWaalsContact O-CG1 3.29Å; I483-I487 WeakPolarHBondContact O-CG1 3.44Å; I483-I487 PolarHBondContact O-N 3.31Å
484T87.1Confident83.3Confident0 Ų048 Ų480%030%0.299CS..Hα-helixtrans-59.1-46.8177.1-480000111.2L201 S470 E473 R480 F481 I487 Q488L201-T484 HydrophobicContact CD2-CG2 3.51Å; S470-T484 WeakPolarHBondContact OG-CG2 3.14Å; E473-T484 HydrophobicContact CB-CG2 4.26Å; R480-T484 PolarHBondContact O-N 2.9Å; R480-T484 PolarHBondContact O-OG1 3.24Å; F481-T484 PolarHBondContact O-N 3.35Å; F481-T484 VanDerWaalsContact O-N 3.16Å; T484-I487 PolarHBondContact O-N 2.9Å; T484-Q488 WeakPolarHBondContact O-CG 3.44Å; T484-Q488 PolarHBondContact O-N 3.29Å
485F88.3Confident84.4Confident32 Ų3246.8 Ų46.814%0.1429%0.293CS..Hα-helixtrans-61.8-45.2172176.7-112000112F249 K252 V253 F481 I483 I487 Q488 N489F249-F485 AromaticContact CD2-CZ 3.79Å; F249-F485 HydrophobicContact CD2-CZ 3.79Å; F249-F485 HydrophobicContact CE2-CE1 4.32Å; F249-F485 AromaticContact CE2-CZ 3.78Å; F249-F485 HydrophobicContact CE2-CZ 3.78Å; K252-F485 HydrophobicContact CB-CD2 3.71Å; K252-F485 HydrophobicContact CB-CE2 3.34Å; K252-F485 HydrophobicContact CB-CZ 4.3Å; K252-F485 HydrophobicContact CD-CD2 4.22Å; K252-F485 HydrophobicContact CG-CD2 4.06Å; K252-F485 HydrophobicContact CG-CE2 3.91Å; V253-F485 HydrophobicContact CG2-CZ 4.45Å; F481-F485 HydrophobicContact CD1-CB 4.16Å; F481-F485 HydrophobicContact CE1-CB 3.82Å; F481-F485 HydrophobicContact CE1-CG 4.24Å; F481-F485 WeakPolarHBondContact O-CB 3.49Å; F481-F485 PolarHBondContact O-N 3Å; I483-F485 PolarHBondContact O-N 3.22Å; F485-I487 VanDerWaalsContact C-N 3.29Å; F485-I487 PolarHBondContact O-N 3.17Å; F485-Q488 PolarHBondContact O-N 2.94Å; F485-N489 WeakPolarHBondContact CD2-ND2 3.46Å; F485-N489 WeakPolarHBondContact CE2-ND2 3.47Å; F485-N489 VanDerWaalsContact CZ-ND2 3.28Å; F485-N489 WeakPolarHBondContact CZ-ND2 3.11Å; F485-N489 PolarHBondContact O-N 3.13Å; F485-N489 PolarHBondContact O-ND2 2.73Å
486G90.8Very high85.5Confident37 Ų3742.7 Ų42.738%0.38127%0.269SS..Hα-helixtrans-57.7-40.6175.800000113.1L482 I483 A490L482-G486 PolarHBondContact O-N 3.5Å; I483-G486 PolarHBondContact O-N 3.35Å; G486-A490 VanDerWaalsContact O-CB 3.28Å; G486-A490 WeakPolarHBondContact O-CB 3.45Å; G486-A490 PolarHBondContact O-N 3.16Å
487I92.6Very high86.6Confident30 Ų3041.3 Ų41.315%0.15426%0.258CS..Hα-helixtrans-64.5-47.1175.8-71.5162.8000111.3R198 L201 I483 T484 F485 N489 A490 G491R198-I487 HydrophobicContact CB-CD1 3.85Å; R198-I487 HydrophobicContact CG-CD1 3.9Å; L201-I487 HydrophobicContact CB-CG2 4.26Å; L201-I487 HydrophobicContact CD2-CG2 4.1Å; L201-I487 HydrophobicContact CG-CG2 4.04Å; I483-I487 HydrophobicContact CG2-CD1 3.94Å; I483-I487 VanDerWaalsContact O-CG1 3.29Å; I483-I487 WeakPolarHBondContact O-CG1 3.44Å; I483-I487 PolarHBondContact O-N 3.31Å; T484-I487 PolarHBondContact O-N 2.9Å; F485-I487 VanDerWaalsContact C-N 3.29Å; F485-I487 PolarHBondContact O-N 3.17Å; I487-N489 PolarHBondContact O-N 3.15Å; I487-A490 PolarHBondContact O-N 3.26Å; I487-G491 PolarHBondContact O-N 3.38Å
488Q93.3Very high88.1Confident1 Ų142.6 Ų42.61%0.00526%0.257CS..Hα-helixtrans-58.9-47178.2-72.9177.4-30.900112L201 F248 M466 S470 T484 F485 A490 G491 L492L201-Q488 HydrophobicContact CD1-CG 4.11Å; L201-Q488 HydrophobicContact CD2-CG 4.3Å; L201-Q488 HydrophobicContact CG-CG 4.26Å; F248-Q488 HydrophobicContact CZ-CB 4.13Å; M466-Q488 HydrophobicContact CG-CG 4.02Å; M466-Q488 PolarHBondContact O-NE2 2.99Å; M466-Q488 HydrophobicContact SD-CB 4.18Å; M466-Q488 HydrophobicContact SD-CG 3.9Å; S470-Q488 VanDerWaalsContact CB-NE2 3.25Å; S470-Q488 PolarHBondContact OG-NE2 2.76Å; T484-Q488 WeakPolarHBondContact O-CG 3.44Å; T484-Q488 PolarHBondContact O-N 3.29Å; F485-Q488 PolarHBondContact O-N 2.94Å; Q488-A490 VanDerWaalsContact C-N 3.34Å; Q488-A490 PolarHBondContact O-N 3.21Å; Q488-G491 PolarHBondContact O-N 3.26Å; Q488-L492 WeakPolarHBondContact O-CB 3.4Å; Q488-L492 WeakPolarHBondContact O-CG 3.43Å; Q488-L492 PolarHBondContact O-N 3.12Å
489N94.4Very high89.8Confident14 Ų1440.2 Ų40.28%0.07523%0.233CC..Hα-helixtrans-66.5-36.8177.6-69.1-92.4000111.7Y245 F485 I487 L493Y245-N489 WeakPolarHBondContact CE2-OD1 3.22Å; Y245-N489 PolarHBondContact OH-OD1 3.38Å; F485-N489 WeakPolarHBondContact CD2-ND2 3.46Å; F485-N489 WeakPolarHBondContact CE2-ND2 3.47Å; F485-N489 VanDerWaalsContact CZ-ND2 3.28Å; F485-N489 WeakPolarHBondContact CZ-ND2 3.11Å; F485-N489 PolarHBondContact O-N 3.13Å; F485-N489 PolarHBondContact O-ND2 2.73Å; I487-N489 PolarHBondContact O-N 3.15Å; N489-L493 VanDerWaalsContact O-CB 3.24Å; N489-L493 WeakPolarHBondContact O-CB 3.42Å; N489-L493 VanDerWaalsContact O-CG 3.28Å; N489-L493 WeakPolarHBondContact O-CG 3.49Å; N489-L493 PolarHBondContact O-N 3.11Å
490A95.8Very high91.3Very high43 Ų4336.8 Ų36.836%0.35521%0.205SC..Hα-helixtrans-63.3-44177.100000112.1Y202 G486 I487 Q488 T494Y202-A490 HydrophobicContact CD2-CB 4.36Å; Y202-A490 HydrophobicContact CE2-CB 4.13Å; G486-A490 VanDerWaalsContact O-CB 3.28Å; G486-A490 WeakPolarHBondContact O-CB 3.45Å; G486-A490 PolarHBondContact O-N 3.16Å; I487-A490 PolarHBondContact O-N 3.26Å; Q488-A490 VanDerWaalsContact C-N 3.34Å; Q488-A490 PolarHBondContact O-N 3.21Å; A490-T494 WeakPolarHBondContact O-CB 3.48Å; A490-T494 PolarHBondContact O-N 2.98Å; A490-T494 VanDerWaalsContact O-N 3.08Å; A490-T494 PolarHBondContact O-OG1 3.19Å
491G96.3Very high92.1Very high0 Ų037 Ų370%021%0.212CC..Hα-helixtrans-64-56.4175.400000111.9A205 I487 Q488 L493 T494 G495A205-G491 CarbonylContact O-C 3.57Å; I487-G491 PolarHBondContact O-N 3.38Å; Q488-G491 PolarHBondContact O-N 3.26Å; G491-L493 PolarHBondContact O-N 3.08Å; G491-T494 PolarHBondContact O-N 2.95Å; G491-T494 VanDerWaalsContact O-N 3.08Å; G491-G495 PolarHBondContact O-N 2.97Å
492L96.3Very high92.6Very high1 Ų137.8 Ų37.81%0.00522%0.218CC..Hα-helixtrans-55.2-47.9-177.7-74.5166.4000112.6A205 I208 F248 M466 Q488 F496A205-L492 HydrophobicContact CB-CG 4.31Å; A205-L492 VanDerWaalsContact O-CA 3.28Å; A205-L492 WeakPolarHBondContact O-CA 3.2Å; A205-L492 WeakPolarHBondContact O-CD2 3.42Å; A205-L492 PolarHBondContact O-N 3.07Å; I208-L492 HydrophobicContact CB-CD2 3.71Å; I208-L492 HydrophobicContact CG2-CD2 3.55Å; F248-L492 HydrophobicContact CD1-CD1 4.13Å; F248-L492 HydrophobicContact CE1-CD1 3.58Å; F248-L492 HydrophobicContact CE2-CD1 4.16Å; F248-L492 HydrophobicContact CZ-CD1 3.59Å; M466-L492 HydrophobicContact CE-CD1 4.3Å; M466-L492 HydrophobicContact SD-CD1 4.24Å; M466-L492 HydrophobicContact SD-CG 4.43Å; Q488-L492 WeakPolarHBondContact O-CB 3.4Å; Q488-L492 WeakPolarHBondContact O-CG 3.43Å; Q488-L492 PolarHBondContact O-N 3.12Å; L492-F496 WeakPolarHBondContact O-CB 3.04Å; L492-F496 PolarHBondContact O-N 2.92Å
493L96.8Very high92.7Very high71 Ų7132.5 Ų32.537%0.37219%0.19SC..Hα-helixtrans-72.4-29.3179.8-66.9176.8000112.7Y245 N489 G491 A497Y245-L493 HydrophobicContact CD2-CD2 4.12Å; Y245-L493 HydrophobicContact CE1-CD2 4.44Å; Y245-L493 HydrophobicContact CE2-CD1 4.32Å; Y245-L493 HydrophobicContact CE2-CD2 3.75Å; Y245-L493 HydrophobicContact CE2-CG 3.96Å; N489-L493 VanDerWaalsContact O-CB 3.24Å; N489-L493 WeakPolarHBondContact O-CB 3.42Å; N489-L493 VanDerWaalsContact O-CG 3.28Å; N489-L493 WeakPolarHBondContact O-CG 3.49Å; N489-L493 PolarHBondContact O-N 3.11Å; G491-L493 PolarHBondContact O-N 3.08Å; L493-A497 WeakPolarHBondContact O-CB 3.26Å; L493-A497 PolarHBondContact O-N 3.45Å
494T97Very high92.6Very high52 Ų5231.9 Ų31.932%0.31919%0.19SC..Hα-helixtrans-70.9-43174.7-59.10000110.9L206 A490 G491 A497 I498L206-T494 HydrophobicContact CD1-CG2 3.88Å; A490-T494 WeakPolarHBondContact O-CB 3.48Å; A490-T494 PolarHBondContact O-N 2.98Å; A490-T494 VanDerWaalsContact O-N 3.08Å; A490-T494 PolarHBondContact O-OG1 3.19Å; G491-T494 PolarHBondContact O-N 2.95Å; G491-T494 VanDerWaalsContact O-N 3.08Å; T494-A497 PolarHBondContact O-N 2.75Å; T494-I498 HydrophobicContact CG2-CD1 3.93Å; T494-I498 HydrophobicContact CG2-CG1 4.44Å; T494-I498 VanDerWaalsContact O-CG1 3.28Å; T494-I498 WeakPolarHBondContact O-CG1 3.44Å; T494-I498 PolarHBondContact O-N 3.39Å
495G96Very high92.3Very high0 Ų037.3 Ų37.30%021%0.211CC..Hα-helixtrans-63-45.5176.700000111.9G209 G491 A497 I498 M499G209-G495 CarbonylContact O-C 3.56Å; G491-G495 PolarHBondContact O-N 2.97Å; G495-A497 PolarHBondContact O-N 3.02Å; G495-I498 PolarHBondContact O-N 3.18Å; G495-M499 WeakPolarHBondContact O-CG 3.36Å; G495-M499 PolarHBondContact O-N 2.71Å; G495-M499 VanDerWaalsContact O-N 3.14Å
496F96.6Very high91.6Very high33 Ų3337.5 Ų37.515%0.14522%0.217CC..Hα-helixtrans-57.9-46.7171.6174.9-102.3000112.6G209 F217 A238 F241 L492 I498 M499 L500G209-F496 PolarHBondContact O-N 3.22Å; F217-F496 AromaticContact CE2-CD2 3.98Å; F217-F496 HydrophobicContact CE2-CD2 3.98Å; F217-F496 AromaticContact CE2-CE2 3.71Å; F217-F496 HydrophobicContact CE2-CE2 3.71Å; F217-F496 HydrophobicContact CZ-CD2 4.24Å; F217-F496 AromaticContact CZ-CE2 3.51Å; F217-F496 HydrophobicContact CZ-CE2 3.51Å; F217-F496 HydrophobicContact CZ-CZ 4.1Å; A238-F496 HydrophobicContact CB-CZ 4.16Å; F241-F496 HydrophobicContact CB-CD2 3.95Å; F241-F496 HydrophobicContact CB-CE2 3.56Å; F241-F496 HydrophobicContact CB-CZ 4.46Å; F241-F496 AromaticContact CD1-CD2 3.52Å; F241-F496 HydrophobicContact CD1-CD2 3.52Å; F241-F496 AromaticContact CD1-CE2 3.71Å; F241-F496 HydrophobicContact CD1-CE2 3.71Å; F241-F496 AromaticContact CD1-CG 3.95Å; F241-F496 HydrophobicContact CD1-CG 3.95Å; F241-F496 HydrophobicContact CD1-CZ 4.32Å; F241-F496 HydrophobicContact CD2-CB 4.43Å; F241-F496 AromaticContact CD2-CD2 3.35Å; F241-F496 HydrophobicContact CD2-CD2 3.35Å; F241-F496 AromaticContact CD2-CE2 3.91Å; F241-F496 HydrophobicContact CD2-CE2 3.91Å; F241-F496 HydrophobicContact CD2-CG 4.2Å; F241-F496 HydrophobicContact CE1-CB 3.96Å; F241-F496 HydrophobicContact CE1-CD1 4.5Å; F241-F496 AromaticContact CE1-CD2 3.83Å; F241-F496 HydrophobicContact CE1-CD2 3.83Å; F241-F496 HydrophobicContact CE1-CE2 4.43Å; F241-F496 AromaticContact CE1-CG 3.84Å; F241-F496 HydrophobicContact CE1-CG 3.84Å; F241-F496 HydrophobicContact CE2-CB 3.87Å; F241-F496 AromaticContact CE2-CD2 3.69Å; F241-F496 HydrophobicContact CE2-CD2 3.69Å; F241-F496 HydrophobicContact CE2-CG 4.12Å; F241-F496 AromaticContact CG-CD2 3.3Å; F241-F496 HydrophobicContact CG-CD2 3.3Å; F241-F496 AromaticContact CG-CE2 3.44Å; F241-F496 HydrophobicContact CG-CE2 3.44Å; F241-F496 VanDerWaalsContact CG-CE2 3.44Å; F241-F496 HydrophobicContact CG-CG 4.17Å; F241-F496 HydrophobicContact CG-CZ 4.41Å; F241-F496 HydrophobicContact CZ-CB 3.63Å; F241-F496 AromaticContact CZ-CD2 3.93Å; F241-F496 HydrophobicContact CZ-CD2 3.93Å; F241-F496 AromaticContact CZ-CG 3.95Å; F241-F496 HydrophobicContact CZ-CG 3.95Å; L492-F496 WeakPolarHBondContact O-CB 3.04Å; L492-F496 PolarHBondContact O-N 2.92Å; F496-I498 PolarHBondContact O-N 3.06Å; F496-M499 PolarHBondContact O-N 2.05Å; F496-L500 HydrophobicContact CE1-CD2 3.76Å; F496-L500 HydrophobicContact CZ-CD2 3.94Å; F496-L500 WeakPolarHBondContact O-CB 3.28Å; F496-L500 PolarHBondContact O-N 3.14Å
497A95.6Very high90.3Very high39 Ų3938.7 Ų38.732%0.32223%0.229SC..Hα-helixtrans-64.1-40.1179.900000112.2L493 T494 G495 L501L493-A497 WeakPolarHBondContact O-CB 3.26Å; L493-A497 PolarHBondContact O-N 3.45Å; T494-A497 PolarHBondContact O-N 2.75Å; G495-A497 PolarHBondContact O-N 3.02Å; A497-L501 VanDerWaalsContact O-CB 3.23Å; A497-L501 WeakPolarHBondContact O-CB 3.44Å; A497-L501 WeakPolarHBondContact O-CD1 3.4Å; A497-L501 WeakPolarHBondContact O-CG 3.23Å; A497-L501 PolarHBondContact O-N 3.15Å
498I94.2Very high88.8Confident55 Ų5544.5 Ų44.528%0.28226%0.255SS..Hα-helixtrans-57.9-53.9174.9-72164000110L206 V389 T494 G495 F496 L500 L501 L502L206-I498 HydrophobicContact CD1-CD1 4.34Å; V389-I498 HydrophobicContact CG1-CG2 4.09Å; T494-I498 HydrophobicContact CG2-CD1 3.93Å; T494-I498 HydrophobicContact CG2-CG1 4.44Å; T494-I498 VanDerWaalsContact O-CG1 3.28Å; T494-I498 WeakPolarHBondContact O-CG1 3.44Å; T494-I498 PolarHBondContact O-N 3.39Å; G495-I498 PolarHBondContact O-N 3.18Å; F496-I498 PolarHBondContact O-N 3.06Å; I498-L500 PolarHBondContact O-N 3.29Å; I498-L501 PolarHBondContact O-N 3.38Å; I498-L502 HydrophobicContact CG2-CD1 3.83Å; I498-L502 WeakPolarHBondContact O-CB 3.26Å; I498-L502 VanDerWaalsContact O-CG 3.3Å; I498-L502 WeakPolarHBondContact O-CG 3.4Å; I498-L502 PolarHBondContact O-N 3.35Å
499M93.3Very high87.2Confident0 Ų047.8 Ų47.80%027%0.272CS..Hα-helixtrans-69.8-34.5-176.7-58.5-47.7-58.600113.3T210 N214 F217 S386 A390 G495 F496 L502 T503T210-M499 HydrophobicContact CG2-CG 4.32Å; T210-M499 HydrophobicContact CG2-SD 4.37Å; T210-M499 WeakPolarHBondContact O-CG 3.38Å; N214-M499 HydrophobicContact CB-CE 3.84Å; N214-M499 WeakPolarHBondContact OD1-CE 3.36Å; F217-M499 HydrophobicContact CD2-CB 4.17Å; S386-M499 VanDerWaalsContact OG-CE 3.28Å; S386-M499 WeakPolarHBondContact OG-CE 3.3Å; A390-M499 HydrophobicContact CB-CE 4.22Å; A390-M499 HydrophobicContact CB-SD 4.16Å; G495-M499 WeakPolarHBondContact O-CG 3.36Å; G495-M499 PolarHBondContact O-N 2.71Å; G495-M499 VanDerWaalsContact O-N 3.14Å; F496-M499 PolarHBondContact O-N 2.05Å; M499-L502 HydrophobicContact CE-CD1 4.28Å; M499-L502 HydrophobicContact SD-CD1 4.05Å; M499-T503 WeakPolarHBondContact O-CB 3.4Å; M499-T503 PolarHBondContact O-N 3.35Å; M499-T503 PolarHBondContact O-OG1 3.32Å
500L91.9Very high85Confident49 Ų4956.2 Ų56.226%0.25731%0.311SS..Hα-helixtrans-66.5-43.8174.2177.962.7000111.2F217 V234 F496 I498 T504F217-L500 HydrophobicContact CE1-CD1 4.17Å; F217-L500 HydrophobicContact CE2-CB 4.01Å; F217-L500 HydrophobicContact CE2-CD1 4.35Å; F217-L500 HydrophobicContact CZ-CB 4.25Å; F217-L500 HydrophobicContact CZ-CD1 3.81Å; V234-L500 HydrophobicContact CG1-CD1 3.82Å; F496-L500 HydrophobicContact CE1-CD2 3.76Å; F496-L500 HydrophobicContact CZ-CD2 3.94Å; F496-L500 WeakPolarHBondContact O-CB 3.28Å; F496-L500 PolarHBondContact O-N 3.14Å; I498-L500 PolarHBondContact O-N 3.29Å; L500-T504 WeakPolarHBondContact O-CB 3.44Å; L500-T504 PolarHBondContact O-N 3.45Å; L500-T504 PolarHBondContact O-OG1 3.25Å
501L90.4Very high83Confident99 Ų9957.8 Ų57.852%0.51831%0.313SS..Hα-helixtrans-63.2-46.7175.7-73.2169000110.8A497 I498 T504 Y505A497-L501 VanDerWaalsContact O-CB 3.23Å; A497-L501 WeakPolarHBondContact O-CB 3.44Å; A497-L501 WeakPolarHBondContact O-CD1 3.4Å; A497-L501 WeakPolarHBondContact O-CG 3.23Å; A497-L501 PolarHBondContact O-N 3.15Å; I498-L501 PolarHBondContact O-N 3.38Å; L501-T504 PolarHBondContact O-N 2.95Å; L501-Y505 HydrophobicContact CD2-CD2 4.16Å; L501-Y505 HydrophobicContact CD2-CE2 3.75Å; L501-Y505 WeakPolarHBondContact O-CB 3.15Å; L501-Y505 VanDerWaalsContact O-CD2 3.32Å; L501-Y505 WeakPolarHBondContact O-CD2 3.48Å; L501-Y505 PolarHBondContact O-N 2.92Å
502L88.1Confident80.2Confident37 Ų3764 Ų6419%0.19438%0.378CS..Hα-helixtrans-55.1-57175.4-74.5169.1000110.9F382 V389 I498 M499 T504 Y505 S506F382-L502 HydrophobicContact CE1-CB 4.44Å; F382-L502 WeakPolarHBondContact CE1-O 3.04Å; F382-L502 HydrophobicContact CE2-CD2 4.03Å; F382-L502 HydrophobicContact CZ-CB 3.83Å; F382-L502 HydrophobicContact CZ-CD2 3.78Å; F382-L502 HydrophobicContact CZ-CG 4.43Å; F382-L502 WeakPolarHBondContact CZ-O 3.48Å; V389-L502 HydrophobicContact CG1-CD1 4.5Å; I498-L502 HydrophobicContact CG2-CD1 3.83Å; I498-L502 WeakPolarHBondContact O-CB 3.26Å; I498-L502 VanDerWaalsContact O-CG 3.3Å; I498-L502 WeakPolarHBondContact O-CG 3.4Å; I498-L502 PolarHBondContact O-N 3.35Å; M499-L502 HydrophobicContact CE-CD1 4.28Å; M499-L502 HydrophobicContact SD-CD1 4.05Å; L502-T504 VanDerWaalsContact C-N 3.31Å; L502-T504 PolarHBondContact O-N 2.96Å; L502-Y505 PolarHBondContact O-N 3.24Å; L502-S506 PolarHBondContact O-N 2.78Å
503T86.2Confident79.4Confident5 Ų567.2 Ų67.23%0.03140%0.397CS..Hα-helixtrans-61-38.9-178.5-49.20000112.5F217 Q218 P228 V234 M499 S506F217-T503 HydrophobicContact CB-CG2 4.12Å; F217-T503 WeakPolarHBondContact CB-OG1 3.45Å; Q218-T503 PolarHBondContact NE2-OG1 3.14Å; P228-T503 HydrophobicContact CB-CG2 4.33Å; V234-T503 HydrophobicContact CG1-CG2 4.23Å; V234-T503 HydrophobicContact CG2-CG2 3.8Å; M499-T503 WeakPolarHBondContact O-CB 3.4Å; M499-T503 PolarHBondContact O-N 3.35Å; M499-T503 PolarHBondContact O-OG1 3.32Å; T503-S506 WeakPolarHBondContact O-CB 3.4Å
504T83.7Confident78.5Confident71 Ų7167 Ų6744%0.43640%0.398SS..Hα-helixtrans-70.2-38.5-179.1-55.40000112.6L500 L501 L502L500-T504 WeakPolarHBondContact O-CB 3.44Å; L500-T504 PolarHBondContact O-N 3.45Å; L500-T504 PolarHBondContact O-OG1 3.25Å; L501-T504 PolarHBondContact O-N 2.95Å; L502-T504 VanDerWaalsContact C-N 3.31Å; L502-T504 PolarHBondContact O-N 2.96Å
505Y81.2Confident77.5Confident114 Ų11467.8 Ų67.845%0.44740%0.402SS..Hα-helixtrans-93.9-3.7-177.8-71.9-73.4000114.3L501 L502 G507 Q508 I509L501-Y505 HydrophobicContact CD2-CD2 4.16Å; L501-Y505 HydrophobicContact CD2-CE2 3.75Å; L501-Y505 WeakPolarHBondContact O-CB 3.15Å; L501-Y505 VanDerWaalsContact O-CD2 3.32Å; L501-Y505 WeakPolarHBondContact O-CD2 3.48Å; L501-Y505 PolarHBondContact O-N 2.92Å; L502-Y505 PolarHBondContact O-N 3.24Å; Y505-G507 VanDerWaalsContact C-N 3.33Å; Y505-G507 PolarHBondContact O-N 3.29Å; Y505-Q508 WeakPolarHBondContact O-CA 3.2Å; Y505-Q508 PolarHBondContact O-N 2.97Å; Y505-I509 WeakPolarHBondContact O-CG1 3.33Å; Y505-I509 PolarHBondContact O-N 2.84Å
506S73.7Confident76.4Confident37 Ų3771.8 Ų71.826%0.25943%0.426SS..G310 helixtrans-37.7-56.6177.1176.30000113.6F382 L502 T503 Q508 I509F382-S506 WeakPolarHBondContact CD1-OG 3.44Å; L502-S506 PolarHBondContact O-N 2.78Å; T503-S506 WeakPolarHBondContact O-CB 3.4Å; S506-Q508 PolarHBondContact O-N 2.99Å; S506-Q508 VanDerWaalsContact O-N 3.13Å; S506-I509 PolarHBondContact O-N 3.06Å
507G62Low75.1Confident61 Ų6174.3 Ų74.363%0.62944%0.443SS*.G310 helixtrans-73.21.6-178.900000116.3Y505Y505-G507 VanDerWaalsContact C-N 3.33Å; Y505-G507 PolarHBondContact O-N 3.29Å
508Q61.3Low73.8Confident152 Ų15276.6 Ų76.671%0.7145%0.452SS*.G310 helixtrans-112.1-11.4175.2-63.2-172-5.200113Y505 S506 Q510Y505-Q508 WeakPolarHBondContact O-CA 3.2Å; Y505-Q508 PolarHBondContact O-N 2.97Å; S506-Q508 PolarHBondContact O-N 2.99Å; S506-Q508 VanDerWaalsContact O-N 3.13Å; Q508-Q510 PolarHBondContact O-N 3.27Å
509I60.1Low72.3Confident71 Ų7178.1 Ų78.136%0.36446%0.464SS..  trans-98.686.1-176.8-57.1163.6000108.7F382 Y505 S506 L511F382-I509 HydrophobicContact CD2-CB 4.43Å; F382-I509 HydrophobicContact CD2-CD1 4.46Å; F382-I509 HydrophobicContact CE2-CB 4.49Å; F382-I509 HydrophobicContact CE2-CD1 3.71Å; F382-I509 HydrophobicContact CZ-CD1 4.47Å; Y505-I509 WeakPolarHBondContact O-CG1 3.33Å; Y505-I509 PolarHBondContact O-N 2.84Å; S506-I509 PolarHBondContact O-N 3.06Å; I509-L511 HydrophobicContact CG2-CD2 3.78Å; I509-L511 HydrophobicContact CG2-CG 3.9Å; I509-L511 PolarHBondContact O-N 2.92Å; I509-L511 VanDerWaalsContact O-N 3.14Å
510Q47.8Very low70.7Confident190 Ų19084.2 Ų84.289%0.88850%0.499SS*.  trans-68.8106.3170.1-73-176.9-23.200110Q508Q508-Q510 PolarHBondContact O-N 3.27Å
511L54.2Low68.9Low76 Ų7687.1 Ų87.140%0.39852%0.519SS..  trans-99.283.8175.3-66179.5000110.9V381 F382 I385 I509V381-L511 HydrophobicContact CG1-CB 4.37Å; V381-L511 HydrophobicContact CG1-CD1 4.06Å; F382-L511 HydrophobicContact CB-CD1 4.47Å; F382-L511 HydrophobicContact CD2-CD1 4.35Å; I385-L511 HydrophobicContact CD1-CD1 3.75Å; I509-L511 HydrophobicContact CG2-CD2 3.78Å; I509-L511 HydrophobicContact CG2-CG 3.9Å; I509-L511 PolarHBondContact O-N 2.92Å; I509-L511 VanDerWaalsContact O-N 3.14Å
512G38.4Very low67Low132 Ų13286 Ų86100%1.36152%0.52SS*.  trans81.80168.600000114.5

Retrieved 512 of 512 residues in 534.7 ms (Link to these results)