A0A3Q0KLY1_SCHMA Loading...

Chitin synthase export chaperone

AlphaFold DB , UniProt , Accession A0A3Q0KLY1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 281 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
1M50Low57.5Low237 Ų237120.4 Ų120.4100%1.16765%0.646SS**  0-17.60-89.6178.4160.600115
2L49.2Very low58.9Low151 Ų151118.9 Ų118.979%0.79164%0.638SS**  trans-75-24-175.7-116.489.2000116.1N4 C5L2-N4 PolarHBondContact O-N 3.3Å; L2-C5 PolarHBondContact O-N 3.37Å
3H50Low59.9Low149 Ų149118.4 Ų118.469%0.6963%0.634SS**Hα-helixtrans-69.7-29.9-169.9-157.9-95.5000113.9C5H3-C5 PolarHBondContact O-N 3.48Å
4N56.4Low60.9Low134 Ų134123.5 Ų123.572%0.71764%0.64SS**Hα-helixtrans-74.2-25.7-179-73.2-0.4000113.2L2 G8L2-N4 PolarHBondContact O-N 3.3Å; N4-G8 PolarHBondContact O-N 3.24Å
5C54.2Low61.9Low100 Ų100119.7 Ų119.768%0.67662%0.624SS**Hα-helixtrans-76.1-35.5-175.2-157.70000112.3L2 H3 K9L2-C5 PolarHBondContact O-N 3.37Å; H3-C5 PolarHBondContact O-N 3.48Å; C5-K9 PolarHBondContact O-N 3.31Å
6V57.6Low62.9Low98 Ų98120.4 Ų120.459%0.59462%0.624SS**Hα-helixtrans-69.5-41.8177.5179.80000111G8 K9 V10V6-G8 PolarHBondContact O-N 3.35Å; V6-K9 PolarHBondContact O-N 3.24Å; V6-V10 WeakPolarHBondContact O-CG2 3.27Å; V6-V10 PolarHBondContact O-N 3.49Å
7I58.9Low63.9Low81 Ų81115.2 Ų115.242%0.41561%0.606SS.*Hα-helixtrans-61.8-43.8178.8-64.2171.5000110.8K9 V10 I11I7-K9 VanDerWaalsContact C-N 3.34Å; I7-K9 PolarHBondContact O-N 3.12Å; I7-V10 PolarHBondContact O-N 2.68Å; I7-I11 HydrophobicContact CG2-CD1 3.7Å; I7-I11 HydrophobicContact CG2-CG1 4.45Å; I7-I11 VanDerWaalsContact O-CG1 3.3Å; I7-I11 WeakPolarHBondContact O-CG1 2.94Å; I7-I11 PolarHBondContact O-N 3.11Å; I7-I11 VanDerWaalsContact O-N 3.1Å
8G58.9Low64.8Low33 Ų33112.4 Ų112.434%0.3460%0.595SS.*Hα-helixtrans-61.1-38.6177.700000113.7N4 V6 N12N4-G8 PolarHBondContact O-N 3.24Å; V6-G8 PolarHBondContact O-N 3.35Å; G8-N12 PolarHBondContact O-N 3.43Å; G8-N12 VanDerWaalsContact O-N 3.14Å
9K64.1Low65.8Low154 Ų154115.9 Ų115.967%0.6760%0.599SS**Hα-helixtrans-70-38179.8-163175-176.3179.50112.5C5 V6 I7 N12 L13C5-K9 PolarHBondContact O-N 3.31Å; V6-K9 PolarHBondContact O-N 3.24Å; I7-K9 VanDerWaalsContact C-N 3.34Å; I7-K9 PolarHBondContact O-N 3.12Å; K9-N12 PolarHBondContact O-N 3.15Å; K9-L13 PolarHBondContact O-N 3.35Å; K9-L13 VanDerWaalsContact O-N 3.15Å
10V65.9Low66.6Low92 Ų92117.6 Ų117.656%0.55860%0.598SS**Hα-helixtrans-67.8-40.4176.7176.30000111.1V6 I7 N12 L13 W14V6-V10 WeakPolarHBondContact O-CG2 3.27Å; V6-V10 PolarHBondContact O-N 3.49Å; I7-V10 PolarHBondContact O-N 2.68Å; V10-N12 VanDerWaalsContact C-N 3.35Å; V10-N12 PolarHBondContact O-N 2.82Å; V10-L13 PolarHBondContact O-N 3.41Å; V10-W14 WeakPolarHBondContact O-CB 3.49Å; V10-W14 PolarHBondContact O-N 3.3Å
11I67.4Low67.5Low95 Ų95116.3 Ų116.349%0.48759%0.593SS.*Hα-helixtrans-62.8-41.1176.4-66.6166000111.2I7 W14 T15I7-I11 HydrophobicContact CG2-CD1 3.7Å; I7-I11 HydrophobicContact CG2-CG1 4.45Å; I7-I11 VanDerWaalsContact O-CG1 3.3Å; I7-I11 WeakPolarHBondContact O-CG1 2.94Å; I7-I11 PolarHBondContact O-N 3.11Å; I7-I11 VanDerWaalsContact O-N 3.1Å; I11-W14 PolarHBondContact O-N 2.89Å; I11-T15 HydrophobicContact CG2-CG2 4.37Å; I11-T15 WeakPolarHBondContact O-CB 3.5Å; I11-T15 WeakPolarHBondContact O-CG2 3.36Å; I11-T15 PolarHBondContact O-N 3.21Å; I11-T15 PolarHBondContact O-OG1 3.01Å
12N73.8Confident69.2Low103 Ų103110 Ų11055%0.55156%0.563SS**Hα-helixtrans-65.4-40.7177-82.1-13.8000113.3G8 K9 V10 T15 Q16G8-N12 PolarHBondContact O-N 3.43Å; G8-N12 VanDerWaalsContact O-N 3.14Å; K9-N12 PolarHBondContact O-N 3.15Å; V10-N12 VanDerWaalsContact C-N 3.35Å; V10-N12 PolarHBondContact O-N 2.82Å; N12-T15 WeakPolarHBondContact CA-OG1 3.33Å; N12-T15 PolarHBondContact O-OG1 3.08Å; N12-Q16 WeakPolarHBondContact O-CB 3.18Å; N12-Q16 VanDerWaalsContact O-CG 3.29Å; N12-Q16 WeakPolarHBondContact O-CG 3.31Å; N12-Q16 PolarHBondContact O-N 3.35Å
13L72Confident70.9Confident112 Ų112107 Ų10759%0.58655%0.548SS*.Hα-helixtrans-66.1-41.5176-79164.4000111.9K9 V10 Q16 G17K9-L13 PolarHBondContact O-N 3.35Å; K9-L13 VanDerWaalsContact O-N 3.15Å; V10-L13 PolarHBondContact O-N 3.41Å; L13-Q16 PolarHBondContact O-N 2.86Å; L13-G17 PolarHBondContact O-N 3.37Å
14W73.5Confident72.6Confident190 Ų190107.3 Ų107.372%0.7254%0.543SS*.Hα-helixtrans-66.8-45178.9-162.377.6000111.5V10 I11 Q16 G17 V18V10-W14 WeakPolarHBondContact O-CB 3.49Å; V10-W14 PolarHBondContact O-N 3.3Å; I11-W14 PolarHBondContact O-N 2.89Å; W14-Q16 PolarHBondContact O-N 3.37Å; W14-G17 PolarHBondContact O-N 2.82Å; W14-V18 HydrophobicContact CD2-CG2 4.09Å; W14-V18 HydrophobicContact CE3-CG2 4.03Å; W14-V18 HydrophobicContact CH2-CG2 4.15Å; W14-V18 HydrophobicContact CZ2-CG2 4.2Å; W14-V18 HydrophobicContact CZ3-CG2 4.06Å; W14-V18 WeakPolarHBondContact O-CG2 3.35Å; W14-V18 PolarHBondContact O-N 3.07Å
15T76.8Confident74Confident66 Ų66106.9 Ų106.941%0.40554%0.54SS..Hα-helixtrans-63.9-36.8175.848.70000112.9I11 N12 R19I11-T15 HydrophobicContact CG2-CG2 4.37Å; I11-T15 WeakPolarHBondContact O-CB 3.5Å; I11-T15 WeakPolarHBondContact O-CG2 3.36Å; I11-T15 PolarHBondContact O-N 3.21Å; I11-T15 PolarHBondContact O-OG1 3.01Å; N12-T15 WeakPolarHBondContact CA-OG1 3.33Å; N12-T15 PolarHBondContact O-OG1 3.08Å; T15-R19 WeakPolarHBondContact O-CB 3.48Å; T15-R19 PolarHBondContact O-N 3.2Å
16Q78Confident75.4Confident132 Ų132107.4 Ų107.462%0.61753%0.533SS*.Hα-helixtrans-64.4-44.1172.1-79.2-179.8-11.500112N12 L13 W14 R19 Y20N12-Q16 WeakPolarHBondContact O-CB 3.18Å; N12-Q16 VanDerWaalsContact O-CG 3.29Å; N12-Q16 WeakPolarHBondContact O-CG 3.31Å; N12-Q16 PolarHBondContact O-N 3.35Å; L13-Q16 PolarHBondContact O-N 2.86Å; W14-Q16 PolarHBondContact O-N 3.37Å; Q16-R19 PolarHBondContact O-N 3.05Å; Q16-Y20 WeakPolarHBondContact O-CB 3.33Å; Q16-Y20 PolarHBondContact O-N 3.41Å
17G79.3Confident76.6Confident31 Ų31108.5 Ų108.532%0.3253%0.531SS..Hα-helixtrans-63.1-40.6176.800000113L13 W14 N21L13-G17 PolarHBondContact O-N 3.37Å; W14-G17 PolarHBondContact O-N 2.82Å; G17-N21 PolarHBondContact O-N 2.89Å; G17-N21 VanDerWaalsContact O-N 3.1Å; G17-N21 PolarHBondContact O-ND2 2.84Å
18V81.1Confident77.5Confident66 Ų66107.2 Ų107.240%0.453%0.532SS..Hα-helixtrans-65-44.3175.1172.30000110.9W14 N21 L22W14-V18 HydrophobicContact CD2-CG2 4.09Å; W14-V18 HydrophobicContact CE3-CG2 4.03Å; W14-V18 HydrophobicContact CH2-CG2 4.15Å; W14-V18 HydrophobicContact CZ2-CG2 4.2Å; W14-V18 HydrophobicContact CZ3-CG2 4.06Å; W14-V18 WeakPolarHBondContact O-CG2 3.35Å; W14-V18 PolarHBondContact O-N 3.07Å; V18-N21 PolarHBondContact O-N 3.06Å; V18-L22 WeakPolarHBondContact O-CB 3.32Å; V18-L22 PolarHBondContact O-N 3.31Å
19R83.5Confident78.4Confident179 Ų179107.7 Ų107.768%0.67553%0.531SS*.Hα-helixtrans-62.3-45.8178.3-167.6178.7-68.3-167.9-1.9111.6T15 Q16 N21 L22 D23T15-R19 WeakPolarHBondContact O-CB 3.48Å; T15-R19 PolarHBondContact O-N 3.2Å; Q16-R19 PolarHBondContact O-N 3.05Å; R19-N21 VanDerWaalsContact C-N 3.35Å; R19-N21 PolarHBondContact O-N 3Å; R19-L22 PolarHBondContact O-N 3.4Å; R19-D23 VanDerWaalsContact O-CG 3.31Å; R19-D23 PolarHBondContact O-N 3.45Å
20Y80.8Confident79.1Confident148 Ų148103.9 Ų103.958%0.5852%0.518SS*.Hα-helixtrans-59.3-42.6176.9-176.9-97.8000112.8Q16 R24Q16-Y20 WeakPolarHBondContact O-CB 3.33Å; Q16-Y20 PolarHBondContact O-N 3.41Å; Y20-R24 PolarHBondContact O-N 3.32Å
21N86Confident79.7Confident92 Ų92103.7 Ų103.749%0.49251%0.514SS..Hα-helixtrans-68.2-38.2176.6-75.9-46.9000112.4G17 V18 R19 R24 L25G17-N21 PolarHBondContact O-N 2.89Å; G17-N21 VanDerWaalsContact O-N 3.1Å; G17-N21 PolarHBondContact O-ND2 2.84Å; V18-N21 PolarHBondContact O-N 3.06Å; R19-N21 VanDerWaalsContact C-N 3.35Å; R19-N21 PolarHBondContact O-N 3Å; N21-R24 PolarHBondContact O-N 2.71Å; N21-L25 WeakPolarHBondContact O-CG 3.47Å; N21-L25 PolarHBondContact O-N 3.31Å
22L84.9Confident79.8Confident105 Ų105106.1 Ų106.155%0.5552%0.523SS..Hα-helixtrans-64.3-44.9177.6-159.785.3000111.4V18 R19 R24 L25 Q26V18-L22 WeakPolarHBondContact O-CB 3.32Å; V18-L22 PolarHBondContact O-N 3.31Å; R19-L22 PolarHBondContact O-N 3.4Å; L22-R24 VanDerWaalsContact C-N 3.3Å; L22-R24 PolarHBondContact O-N 3.09Å; L22-L25 PolarHBondContact O-N 3.47Å; L22-Q26 WeakPolarHBondContact O-CB 3.36Å; L22-Q26 PolarHBondContact O-N 3.28Å
23D86.4Confident79.4Confident88 Ų88108.7 Ų108.747%0.47153%0.525SS..Hα-helixtrans-60.7-41.5177.8-68.3-25.2000110.9R19 Q26 E27R19-D23 VanDerWaalsContact O-CG 3.31Å; R19-D23 PolarHBondContact O-N 3.45Å; D23-Q26 PolarHBondContact O-N 2.91Å; D23-E27 WeakPolarHBondContact O-CB 3.27Å; D23-E27 PolarHBondContact O-N 3.41Å
24R86Confident79.2Confident155 Ų155109 Ų10959%0.58552%0.523SS*.Hα-helixtrans-66.7-38.8177.2-150.3-172.8-157.3-177.57.2112.9Y20 N21 L22 A28Y20-R24 PolarHBondContact O-N 3.32Å; N21-R24 PolarHBondContact O-N 2.71Å; L22-R24 VanDerWaalsContact C-N 3.3Å; L22-R24 PolarHBondContact O-N 3.09Å; R24-A28 VanDerWaalsContact O-CB 3.3Å; R24-A28 WeakPolarHBondContact O-CB 3.27Å; R24-A28 PolarHBondContact O-N 2.92Å
25L84.2Confident79.1Confident124 Ų124106.4 Ų106.465%0.64951%0.514SS*.Hα-helixtrans-68.3-38.1174.7-73.3173.4000111.5N21 L22 A28 S29N21-L25 WeakPolarHBondContact O-CG 3.47Å; N21-L25 PolarHBondContact O-N 3.31Å; L22-L25 PolarHBondContact O-N 3.47Å; L25-A28 PolarHBondContact O-N 3.21Å; L25-S29 VanDerWaalsContact O-CB 3.32Å; L25-S29 WeakPolarHBondContact O-CB 3.27Å; L25-S29 PolarHBondContact O-N 3.21Å
26Q85Confident78.8Confident112 Ų112105.8 Ų105.852%0.52351%0.513SS..Hα-helixtrans-67.7-42.9176-176.8168.7-34.200111.2L22 D23 S29 N30L22-Q26 WeakPolarHBondContact O-CB 3.36Å; L22-Q26 PolarHBondContact O-N 3.28Å; D23-Q26 PolarHBondContact O-N 2.91Å; Q26-S29 PolarHBondContact O-N 3.25Å; Q26-N30 WeakPolarHBondContact O-CB 3.41Å; Q26-N30 PolarHBondContact O-N 2.94Å
27E83.2Confident78.7Confident121 Ų121103.8 Ų103.857%0.56551%0.506SS*.Hα-helixtrans-62.8-44.4173.9-171.9174.7-172.200111.3D23 S29 N30 N31D23-E27 WeakPolarHBondContact O-CB 3.27Å; D23-E27 PolarHBondContact O-N 3.41Å; E27-S29 PolarHBondContact O-N 3.37Å; E27-N30 PolarHBondContact O-N 3.04Å; E27-N31 WeakPolarHBondContact O-CB 3.23Å; E27-N31 PolarHBondContact O-N 2.84Å; E27-N31 PolarHBondContact O-ND2 3.47Å
28A77.6Confident78.7Confident53 Ų53105.5 Ų105.544%0.43851%0.508SS..Hα-helixtrans-60.6-42.7173.400000112.2R24 L25 Q32R24-A28 VanDerWaalsContact O-CB 3.3Å; R24-A28 WeakPolarHBondContact O-CB 3.27Å; R24-A28 PolarHBondContact O-N 2.92Å; L25-A28 PolarHBondContact O-N 3.21Å; A28-Q32 VanDerWaalsContact O-CB 3.29Å; A28-Q32 WeakPolarHBondContact O-CB 3.25Å; A28-Q32 PolarHBondContact O-N 2.91Å
29S77.5Confident78.6Confident43 Ų43105 Ų10530%0.30150%0.5SS..Hα-helixtrans-62.9-43.8175.8-172.60000111.8L25 Q26 E27 Q32 R33L25-S29 VanDerWaalsContact O-CB 3.32Å; L25-S29 WeakPolarHBondContact O-CB 3.27Å; L25-S29 PolarHBondContact O-N 3.21Å; Q26-S29 PolarHBondContact O-N 3.25Å; E27-S29 PolarHBondContact O-N 3.37Å; S29-Q32 PolarHBondContact O-N 3.49Å; S29-R33 WeakPolarHBondContact O-CG 3.33Å; S29-R33 PolarHBondContact O-N 2.92Å; S29-R33 PolarHBondContact OG-NH2 2.76Å
30N78.9Confident78.6Confident75 Ų75100.9 Ų100.940%0.40149%0.492SS..Hα-helixtrans-65.9-45.1178.9-73.7-12.7000111.4Q26 E27 Q32 R33 Q34Q26-N30 WeakPolarHBondContact O-CB 3.41Å; Q26-N30 PolarHBondContact O-N 2.94Å; E27-N30 PolarHBondContact O-N 3.04Å; N30-Q32 VanDerWaalsContact C-N 3.32Å; N30-Q32 PolarHBondContact O-N 3.4Å; N30-R33 PolarHBondContact O-N 3.46Å; N30-Q34 WeakPolarHBondContact O-CB 3.44Å; N30-Q34 PolarHBondContact O-N 3.09Å
31N77.9Confident78.8Confident88 Ų8898.1 Ų98.147%0.47149%0.486SS..Hα-helixtrans-62-41176-71.2-22.4000111.4E27 Q34 Y35E27-N31 WeakPolarHBondContact O-CB 3.23Å; E27-N31 PolarHBondContact O-N 2.84Å; E27-N31 PolarHBondContact O-ND2 3.47Å; N31-Q34 PolarHBondContact O-N 3.48Å; N31-Y35 VanDerWaalsContact O-CB 3.28Å; N31-Y35 WeakPolarHBondContact O-CB 3Å; N31-Y35 PolarHBondContact O-N 3.2Å
32Q70.1Confident78.8Confident145 Ų14594.5 Ų94.568%0.67847%0.466SS*.Hα-helixtrans-66.5-40.9176.5-170.2178.2-30.300112.1A28 S29 N30 Y35 S36A28-Q32 VanDerWaalsContact O-CB 3.29Å; A28-Q32 WeakPolarHBondContact O-CB 3.25Å; A28-Q32 PolarHBondContact O-N 2.91Å; S29-Q32 PolarHBondContact O-N 3.49Å; N30-Q32 VanDerWaalsContact C-N 3.32Å; N30-Q32 PolarHBondContact O-N 3.4Å; Q32-Y35 PolarHBondContact O-N 2.84Å; Q32-S36 PolarHBondContact O-N 3.03Å
33R64.4Low78.9Confident157 Ų15790.1 Ų90.159%0.59244%0.444SS*.Hα-helixtrans-64.1-45.5173.9-75.7-176.7-144.7178.36.5111.9S29 N30 Y35 S36 N37S29-R33 WeakPolarHBondContact O-CG 3.33Å; S29-R33 PolarHBondContact O-N 2.92Å; S29-R33 PolarHBondContact OG-NH2 2.76Å; N30-R33 PolarHBondContact O-N 3.46Å; R33-Y35 VanDerWaalsContact C-N 3.3Å; R33-Y35 PolarHBondContact O-N 3.14Å; R33-S36 PolarHBondContact O-N 2.76Å; R33-N37 WeakPolarHBondContact O-CB 3.4Å; R33-N37 VanDerWaalsContact O-CG 3.27Å; R33-N37 PolarHBondContact O-N 3.35Å; R33-N37 PolarHBondContact O-OD1 3.47Å
34Q68.8Low79Confident119 Ų11991.8 Ų91.856%0.55645%0.452SS*.Hα-helixtrans-62.3-41.1178.4-171.4175.9-1800111N30 N31 N37 N38N30-Q34 WeakPolarHBondContact O-CB 3.44Å; N30-Q34 PolarHBondContact O-N 3.09Å; N31-Q34 PolarHBondContact O-N 3.48Å; Q34-N37 PolarHBondContact O-N 3.42Å; Q34-N38 WeakPolarHBondContact O-CB 3.47Å; Q34-N38 PolarHBondContact O-N 2.99Å; Q34-N38 PolarHBondContact O-ND2 2.72Å; Q34-N38 PolarHBondContact O-OD1 3.38Å
35Y70Confident79.2Confident135 Ų13587.8 Ų87.853%0.52944%0.442SS..Hα-helixtrans-65.1-38.5174.6-175.6-121.9000112.9N31 Q32 R33 K39N31-Y35 VanDerWaalsContact O-CB 3.28Å; N31-Y35 WeakPolarHBondContact O-CB 3Å; N31-Y35 PolarHBondContact O-N 3.2Å; Q32-Y35 PolarHBondContact O-N 2.84Å; R33-Y35 VanDerWaalsContact C-N 3.3Å; R33-Y35 PolarHBondContact O-N 3.14Å; Y35-K39 HydrophobicContact CE1-CD 4.36Å; Y35-K39 WeakPolarHBondContact O-CG 3.39Å; Y35-K39 PolarHBondContact O-N 2.92Å; Y35-K39 VanDerWaalsContact OH-CE 3.26Å; Y35-K39 WeakPolarHBondContact OH-CE 3.28Å
36S71.9Confident79.5Confident53 Ų5381.9 Ų81.937%0.37141%0.411SS..Hα-helixtrans-64.9-51.5173.5-162.30000111.4Q32 R33 N38 K39 D40Q32-S36 PolarHBondContact O-N 3.03Å; R33-S36 PolarHBondContact O-N 2.76Å; S36-N38 VanDerWaalsContact C-N 3.27Å; S36-N38 PolarHBondContact O-N 2.9Å; S36-K39 WeakPolarHBondContact O-CB 3.18Å; S36-K39 PolarHBondContact O-N 3.15Å; S36-D40 PolarHBondContact O-N 2.83Å
37N76.5Confident79.8Confident91 Ų9178.4 Ų78.449%0.48740%0.396SS..Hα-helixtrans-56.4-42.3-179.9-72.7-1.9000111.6R33 Q34 K39 D40 I41R33-N37 WeakPolarHBondContact O-CB 3.4Å; R33-N37 VanDerWaalsContact O-CG 3.27Å; R33-N37 PolarHBondContact O-N 3.35Å; R33-N37 PolarHBondContact O-OD1 3.47Å; Q34-N37 PolarHBondContact O-N 3.42Å; N37-K39 VanDerWaalsContact C-N 3.3Å; N37-K39 PolarHBondContact O-N 3.44Å; N37-D40 PolarHBondContact O-N 3.04Å; N37-I41 WeakPolarHBondContact O-CB 3.41Å; N37-I41 WeakPolarHBondContact O-CD1 3.21Å; N37-I41 WeakPolarHBondContact O-CG1 3.45Å; N37-I41 PolarHBondContact O-N 3.31Å
38N78.2Confident80.2Confident66 Ų6674.6 Ų74.635%0.35339%0.39SS..Hα-helixtrans-63.1-35.7178-71.8-8.2000112.6Q34 S36 F42Q34-N38 WeakPolarHBondContact O-CB 3.47Å; Q34-N38 PolarHBondContact O-N 2.99Å; Q34-N38 PolarHBondContact O-ND2 2.72Å; Q34-N38 PolarHBondContact O-OD1 3.38Å; S36-N38 VanDerWaalsContact C-N 3.27Å; S36-N38 PolarHBondContact O-N 2.9Å; N38-F42 WeakPolarHBondContact O-CB 3.39Å; N38-F42 PolarHBondContact O-N 3.46Å
39K79.3Confident80.8Confident55 Ų5574.1 Ų74.124%0.23938%0.379CS..Hα-helixtrans-70.3-41.3176-71167.6174.5173.50112.3Y35 S36 N37 I41 F42 T43Y35-K39 HydrophobicContact CE1-CD 4.36Å; Y35-K39 WeakPolarHBondContact O-CG 3.39Å; Y35-K39 PolarHBondContact O-N 2.92Å; Y35-K39 VanDerWaalsContact OH-CE 3.26Å; Y35-K39 WeakPolarHBondContact OH-CE 3.28Å; S36-K39 WeakPolarHBondContact O-CB 3.18Å; S36-K39 PolarHBondContact O-N 3.15Å; N37-K39 VanDerWaalsContact C-N 3.3Å; N37-K39 PolarHBondContact O-N 3.44Å; K39-I41 VanDerWaalsContact C-N 3.34Å; K39-F42 PolarHBondContact O-N 3.01Å; K39-T43 WeakPolarHBondContact O-CB 3.23Å; K39-T43 PolarHBondContact O-N 3.39Å; K39-T43 PolarHBondContact O-OG1 2.94Å
40D82.8Confident81.5Confident93 Ų9372 Ų7250%0.49737%0.365SS..Hα-helixtrans-66.3-43.3-179.3-60.9-28000109.6S36 N37 T43 L44S36-D40 PolarHBondContact O-N 2.83Å; N37-D40 PolarHBondContact O-N 3.04Å; D40-T43 PolarHBondContact O-N 3.13Å; D40-L44 VanDerWaalsContact O-CB 3.25Å; D40-L44 WeakPolarHBondContact O-CB 3.36Å; D40-L44 PolarHBondContact O-N 2.83Å
41I84.7Confident82.1Confident90 Ų9072.5 Ų72.546%0.46237%0.37SS..Hα-helixtrans-61.4-45.3173.8-67.1165.3000111.1N37 K39 L44 N45N37-I41 WeakPolarHBondContact O-CB 3.41Å; N37-I41 WeakPolarHBondContact O-CD1 3.21Å; N37-I41 WeakPolarHBondContact O-CG1 3.45Å; N37-I41 PolarHBondContact O-N 3.31Å; K39-I41 VanDerWaalsContact C-N 3.34Å; I41-L44 PolarHBondContact O-N 3.45Å; I41-N45 WeakPolarHBondContact O-CB 3.32Å; I41-N45 PolarHBondContact O-N 3.25Å; I41-N45 PolarHBondContact O-ND2 3.31Å
42F87.2Confident82.9Confident16 Ų1673.4 Ų73.47%0.0738%0.375CS..Hα-helixtrans-58.9-50.9176.7173.4-95.7000111.6N38 K39 L44 N45 V46 E226 Q227 L230 A233N38-F42 WeakPolarHBondContact O-CB 3.39Å; N38-F42 PolarHBondContact O-N 3.46Å; K39-F42 PolarHBondContact O-N 3.01Å; F42-L44 VanDerWaalsContact C-N 3.33Å; F42-L44 PolarHBondContact O-N 2.99Å; F42-N45 PolarHBondContact O-N 3.49Å; F42-V46 HydrophobicContact CD1-CG2 4.29Å; F42-V46 HydrophobicContact CD2-CG2 4.45Å; F42-V46 HydrophobicContact CE1-CG2 3.88Å; F42-V46 HydrophobicContact CE2-CG2 4.07Å; F42-V46 HydrophobicContact CZ-CG2 3.76Å; F42-V46 WeakPolarHBondContact O-CG2 3.25Å; F42-V46 PolarHBondContact O-N 2.98Å; F42-E226 WeakPolarHBondContact CE2-O 3.21Å; F42-Q227 HydrophobicContact CD2-CB 4.49Å; F42-Q227 HydrophobicContact CD2-CG 4.27Å; F42-L230 HydrophobicContact CD2-CB 4.24Å; F42-L230 HydrophobicContact CD2-CD1 4.21Å; F42-L230 HydrophobicContact CD2-CG 4.46Å; F42-L230 HydrophobicContact CE2-CB 3.77Å; F42-L230 HydrophobicContact CE2-CG 4.32Å; F42-A233 HydrophobicContact CZ-CB 4.25Å
43T85.6Confident83.9Confident14 Ų1466.7 Ų66.79%0.08634%0.343CS..Hα-helixtrans-60.2-44.8-178.9-55.50000110.9K39 D40 N45 V46 L47 V217 F218K39-T43 WeakPolarHBondContact O-CB 3.23Å; K39-T43 PolarHBondContact O-N 3.39Å; K39-T43 PolarHBondContact O-OG1 2.94Å; D40-T43 PolarHBondContact O-N 3.13Å; T43-N45 PolarHBondContact O-N 3.49Å; T43-V46 PolarHBondContact O-N 2.87Å; T43-L47 HydrophobicContact CG2-CD1 4.12Å; T43-L47 WeakPolarHBondContact O-CB 3.36Å; T43-L47 WeakPolarHBondContact O-CG 3.14Å; T43-L47 PolarHBondContact O-N 2.91Å; T43-V217 HydrophobicContact CG2-CG1 4.28Å; T43-F218 HydrophobicContact CG2-CD1 4.06Å; T43-F218 HydrophobicContact CG2-CD2 4.07Å; T43-F218 HydrophobicContact CG2-CE1 3.94Å; T43-F218 HydrophobicContact CG2-CE2 3.95Å; T43-F218 HydrophobicContact CG2-CG 4.13Å; T43-F218 HydrophobicContact CG2-CZ 3.88Å
44L89.2Confident85.2Confident123 Ų12359.9 Ų59.964%0.64432%0.318SS*.Hα-helixtrans-64.2-39.1178.6-171.1130.5000112.1D40 I41 F42 G48D40-L44 VanDerWaalsContact O-CB 3.25Å; D40-L44 WeakPolarHBondContact O-CB 3.36Å; D40-L44 PolarHBondContact O-N 2.83Å; I41-L44 PolarHBondContact O-N 3.45Å; F42-L44 VanDerWaalsContact C-N 3.33Å; F42-L44 PolarHBondContact O-N 2.99Å; L44-G48 PolarHBondContact O-N 3.48Å
45N90.3Very high86.3Confident70 Ų7057 Ų5737%0.37431%0.314SS..Hα-helixtrans-67.6-42.4176.2-69.9-19.5000112.2I41 F42 T43 G48 I49 L230I41-N45 WeakPolarHBondContact O-CB 3.32Å; I41-N45 PolarHBondContact O-N 3.25Å; I41-N45 PolarHBondContact O-ND2 3.31Å; F42-N45 PolarHBondContact O-N 3.49Å; T43-N45 PolarHBondContact O-N 3.49Å; N45-G48 PolarHBondContact O-N 3.32Å; N45-I49 WeakPolarHBondContact O-CG1 3.3Å; N45-I49 PolarHBondContact O-N 3.24Å; N45-L230 HydrophobicContact CB-CD1 3.75Å; N45-L230 HydrophobicContact CB-CG 4.46Å
46V91Very high87.4Confident0 Ų054.6 Ų54.60%031%0.31CS..Hα-helixtrans-60.8-47.6176.4170.50000110.6F42 T43 I49 T50 V217 L230 A233 A234 L237F42-V46 HydrophobicContact CD1-CG2 4.29Å; F42-V46 HydrophobicContact CD2-CG2 4.45Å; F42-V46 HydrophobicContact CE1-CG2 3.88Å; F42-V46 HydrophobicContact CE2-CG2 4.07Å; F42-V46 HydrophobicContact CZ-CG2 3.76Å; F42-V46 WeakPolarHBondContact O-CG2 3.25Å; F42-V46 PolarHBondContact O-N 2.98Å; T43-V46 PolarHBondContact O-N 2.87Å; V46-I49 PolarHBondContact O-N 3.14Å; V46-T50 WeakPolarHBondContact O-CB 3.43Å; V46-T50 PolarHBondContact O-N 3.29Å; V46-T50 PolarHBondContact O-OG1 2.92Å; V46-V217 HydrophobicContact CB-CG1 4.11Å; V46-V217 HydrophobicContact CG1-CG1 3.76Å; V46-V217 HydrophobicContact CG1-CG2 4.2Å; V46-L230 HydrophobicContact CG2-CG 4.18Å; V46-A233 HydrophobicContact CG1-CB 3.98Å; V46-A233 HydrophobicContact CG2-CB 3.94Å; V46-A234 HydrophobicContact CG1-CB 4.28Å; V46-L237 HydrophobicContact CG1-CD2 4.34Å
47L90.7Very high88.3Confident39 Ų3952.1 Ų52.120%0.20429%0.292CS..Hα-helixtrans-64-41.5176.3-70.6174.2000111.6T43 I49 T50 V51 I150 F218 L237T43-L47 HydrophobicContact CG2-CD1 4.12Å; T43-L47 WeakPolarHBondContact O-CB 3.36Å; T43-L47 WeakPolarHBondContact O-CG 3.14Å; T43-L47 PolarHBondContact O-N 2.91Å; L47-I49 PolarHBondContact O-N 2.99Å; L47-T50 PolarHBondContact O-N 3.43Å; L47-V51 WeakPolarHBondContact O-CB 3.25Å; L47-V51 VanDerWaalsContact O-CG2 3.27Å; L47-V51 WeakPolarHBondContact O-CG2 3.33Å; L47-V51 PolarHBondContact O-N 3.21Å; L47-I150 HydrophobicContact CD2-CD1 3.85Å; L47-F218 HydrophobicContact CD1-CE2 4.21Å; L47-F218 HydrophobicContact CD1-CZ 4Å; L47-L237 HydrophobicContact CD2-CD2 3.78Å
48G91.1Very high88.9Confident42 Ų4251.5 Ų51.543%0.43329%0.286SS..Hα-helixtrans-59-45.5177.500000112.9L44 N45 L52L44-G48 PolarHBondContact O-N 3.48Å; N45-G48 PolarHBondContact O-N 3.32Å; G48-L52 WeakPolarHBondContact O-CB 3.21Å; G48-L52 PolarHBondContact O-N 3.41Å
49I91.8Very high89.5Confident42 Ų4249.8 Ų49.822%0.21528%0.284CS..Hα-helixtrans-64.5-44.3175.4-65.7168.3000110.5N45 V46 L47 V51 L52 Q53 L112 L230 A234N45-I49 WeakPolarHBondContact O-CG1 3.3Å; N45-I49 PolarHBondContact O-N 3.24Å; V46-I49 PolarHBondContact O-N 3.14Å; L47-I49 PolarHBondContact O-N 2.99Å; I49-V51 PolarHBondContact O-N 3.44Å; I49-L52 WeakPolarHBondContact O-CB 3.05Å; I49-L52 PolarHBondContact O-N 2.82Å; I49-Q53 WeakPolarHBondContact O-CG 3.33Å; I49-Q53 PolarHBondContact O-N 3.01Å; I49-L112 HydrophobicContact CG2-CD1 3.72Å; I49-L112 HydrophobicContact CG2-CD2 4.32Å; I49-L230 HydrophobicContact CD1-CD2 3.34Å; I49-A234 HydrophobicContact CB-CB 3.81Å; I49-A234 HydrophobicContact CD1-CB 4.42Å; I49-A234 HydrophobicContact CG2-CB 3.62Å
50T92Very high89.9Confident0 Ų047.9 Ų47.90%028%0.279CS..Hα-helixtrans-61.2-45.1-179.7-54.90000111.4V46 L47 L52 Q53 F54 F146 L237V46-T50 WeakPolarHBondContact O-CB 3.43Å; V46-T50 PolarHBondContact O-N 3.29Å; V46-T50 PolarHBondContact O-OG1 2.92Å; L47-T50 PolarHBondContact O-N 3.43Å; T50-L52 VanDerWaalsContact C-N 3.32Å; T50-L52 PolarHBondContact O-N 3.3Å; T50-Q53 WeakPolarHBondContact O-CB 3.31Å; T50-Q53 PolarHBondContact O-N 3.46Å; T50-F54 HydrophobicContact CG2-CD1 4.34Å; T50-F54 HydrophobicContact CG2-CE1 3.56Å; T50-F54 HydrophobicContact CG2-CE2 4.11Å; T50-F54 HydrophobicContact CG2-CZ 3.42Å; T50-F54 VanDerWaalsContact CG2-CZ 3.42Å; T50-F54 VanDerWaalsContact O-CD1 3.28Å; T50-F54 WeakPolarHBondContact O-CD1 3.38Å; T50-F54 WeakPolarHBondContact O-CG 3.14Å; T50-F54 PolarHBondContact O-N 3.29Å; T50-F146 HydrophobicContact CG2-CZ 4.24Å; T50-L237 HydrophobicContact CG2-CB 4.29Å; T50-L237 HydrophobicContact CG2-CD2 4.1Å; T50-L237 HydrophobicContact CG2-CG 4.02Å
51V91.7Very high90.1Very high85 Ų8543.8 Ų43.852%0.51526%0.258SS..Hα-helixtrans-63.2-39.1176.5169.90000111.3L47 I49 Q53 F54 A55L47-V51 WeakPolarHBondContact O-CB 3.25Å; L47-V51 VanDerWaalsContact O-CG2 3.27Å; L47-V51 WeakPolarHBondContact O-CG2 3.33Å; L47-V51 PolarHBondContact O-N 3.21Å; I49-V51 PolarHBondContact O-N 3.44Å; V51-Q53 VanDerWaalsContact C-N 3.33Å; V51-Q53 PolarHBondContact O-N 3.32Å; V51-F54 WeakPolarHBondContact O-CB 3.46Å; V51-F54 PolarHBondContact O-N 2.96Å; V51-A55 PolarHBondContact O-N 3.28Å
52L92.8Very high90.1Very high107 Ų10744 Ų4456%0.5625%0.253SS*.Hα-helixtrans-61.2-43.3174.1-178.964.9000111.3G48 I49 T50 F54 A55 I56G48-L52 WeakPolarHBondContact O-CB 3.21Å; G48-L52 PolarHBondContact O-N 3.41Å; I49-L52 WeakPolarHBondContact O-CB 3.05Å; I49-L52 PolarHBondContact O-N 2.82Å; T50-L52 VanDerWaalsContact C-N 3.32Å; T50-L52 PolarHBondContact O-N 3.3Å; L52-F54 VanDerWaalsContact C-N 3.32Å; L52-F54 PolarHBondContact O-N 3.41Å; L52-A55 PolarHBondContact O-N 2.97Å; L52-I56 HydrophobicContact CG-CD1 4.17Å; L52-I56 WeakPolarHBondContact O-CG1 3.5Å; L52-I56 PolarHBondContact O-N 3.43Å
53Q92.7Very high90Very high3 Ų348.2 Ų48.21%0.01428%0.276CS..Hα-helixtrans-63.7-37.6175.3-65.2178.7-74.600111.8I49 T50 V51 I56 T57 L112 T116 Y238I49-Q53 WeakPolarHBondContact O-CG 3.33Å; I49-Q53 PolarHBondContact O-N 3.01Å; T50-Q53 WeakPolarHBondContact O-CB 3.31Å; T50-Q53 PolarHBondContact O-N 3.46Å; V51-Q53 VanDerWaalsContact C-N 3.33Å; V51-Q53 PolarHBondContact O-N 3.32Å; Q53-I56 PolarHBondContact O-N 3.5Å; Q53-T57 WeakPolarHBondContact O-CB 3.17Å; Q53-T57 PolarHBondContact O-N 2.91Å; Q53-T57 PolarHBondContact O-OG1 3.21Å; Q53-L112 HydrophobicContact CG-CD2 4.07Å; Q53-T116 HydrophobicContact CB-CG2 4.22Å; Q53-T116 HydrophobicContact CG-CG2 4.27Å; Q53-T116 PolarHBondContact NE2-OG1 3.49Å; Q53-Y238 HydrophobicContact CB-CD2 3.32Å; Q53-Y238 HydrophobicContact CB-CE2 3.59Å; Q53-Y238 HydrophobicContact CB-CG 3.98Å; Q53-Y238 HydrophobicContact CG-CD2 4.31Å; Q53-Y238 VanDerWaalsContact OE1-CB 3.29Å
54F91.3Very high89.6Confident14 Ų1449.6 Ų49.66%0.06128%0.281CS..Hα-helixtrans-61.3-45.6173.6-64.9-6.4000111.6T50 V51 L52 I56 T57 F58 F146 Y238 W241T50-F54 HydrophobicContact CG2-CD1 4.34Å; T50-F54 HydrophobicContact CG2-CE1 3.56Å; T50-F54 HydrophobicContact CG2-CE2 4.11Å; T50-F54 HydrophobicContact CG2-CZ 3.42Å; T50-F54 VanDerWaalsContact CG2-CZ 3.42Å; T50-F54 VanDerWaalsContact O-CD1 3.28Å; T50-F54 WeakPolarHBondContact O-CD1 3.38Å; T50-F54 WeakPolarHBondContact O-CG 3.14Å; T50-F54 PolarHBondContact O-N 3.29Å; V51-F54 WeakPolarHBondContact O-CB 3.46Å; V51-F54 PolarHBondContact O-N 2.96Å; L52-F54 VanDerWaalsContact C-N 3.32Å; L52-F54 PolarHBondContact O-N 3.41Å; F54-I56 PolarHBondContact O-N 2.85Å; F54-T57 PolarHBondContact O-N 3.5Å; F54-F58 WeakPolarHBondContact O-CB 3.38Å; F54-F58 PolarHBondContact O-N 3.06Å; F54-F146 AromaticContact CE2-CD1 3.95Å; F54-F146 HydrophobicContact CE2-CD1 3.95Å; F54-F146 AromaticContact CE2-CE1 3.83Å; F54-F146 HydrophobicContact CE2-CE1 3.83Å; F54-F146 HydrophobicContact CE2-CE2 4.44Å; F54-F146 HydrophobicContact CE2-CG 4.3Å; F54-F146 HydrophobicContact CE2-CZ 4.1Å; F54-F146 HydrophobicContact CZ-CD1 4.42Å; F54-F146 HydrophobicContact CZ-CD2 4.28Å; F54-F146 HydrophobicContact CZ-CE1 4.11Å; F54-F146 AromaticContact CZ-CE2 3.97Å; F54-F146 HydrophobicContact CZ-CE2 3.97Å; F54-F146 HydrophobicContact CZ-CG 4.48Å; F54-F146 AromaticContact CZ-CZ 3.89Å; F54-F146 HydrophobicContact CZ-CZ 3.89Å; F54-Y238 AromaticContact CD1-CD2 3.66Å; F54-Y238 HydrophobicContact CD1-CD2 3.66Å; F54-Y238 AromaticContact CD1-CE2 3.97Å; F54-Y238 HydrophobicContact CD1-CE2 3.97Å; F54-Y238 AromaticContact CE1-CD2 3.7Å; F54-Y238 HydrophobicContact CE1-CD2 3.7Å; F54-Y238 HydrophobicContact CE1-CE2 4.36Å; F54-W241 HydrophobicContact CD1-CB 4.48Å; F54-W241 AromaticContact CD1-CD2 3.44Å; F54-W241 HydrophobicContact CD1-CD2 3.44Å; F54-W241 VanDerWaalsContact CD1-CD2 3.44Å; F54-W241 AromaticContact CD1-CE3 3.32Å; F54-W241 HydrophobicContact CD1-CE3 3.32Å; F54-W241 AromaticContact CD1-CG 3.96Å; F54-W241 HydrophobicContact CD1-CG 3.96Å; F54-W241 HydrophobicContact CD1-CH2 4.35Å; F54-W241 HydrophobicContact CD1-CZ2 4.44Å; F54-W241 AromaticContact CD1-CZ3 3.8Å; F54-W241 HydrophobicContact CD1-CZ3 3.8Å; F54-W241 HydrophobicContact CD2-CD2 4.44Å; F54-W241 HydrophobicContact CD2-CG 4.49Å; F54-W241 HydrophobicContact CE1-CB 3.37Å; F54-W241 AromaticContact CE1-CD2 3.19Å; F54-W241 HydrophobicContact CE1-CD2 3.19Å; F54-W241 AromaticContact CE1-CE3 3.29Å; F54-W241 HydrophobicContact CE1-CE3 3.29Å; F54-W241 AromaticContact CE1-CG 3.23Å; F54-W241 HydrophobicContact CE1-CG 3.23Å; F54-W241 HydrophobicContact CE1-CZ3 4.23Å; F54-W241 HydrophobicContact CE2-CB 4.28Å; F54-W241 AromaticContact CE2-CD1 3.88Å; F54-W241 HydrophobicContact CE2-CD2 4.22Å; F54-W241 AromaticContact CE2-CG 3.84Å; F54-W241 HydrophobicContact CE2-CG 3.84Å; F54-W241 HydrophobicContact CG-CD2 4.1Å; F54-W241 HydrophobicContact CG-CE3 4.27Å; F54-W241 HydrophobicContact CZ-CB 3.23Å; F54-W241 AromaticContact CZ-CD1 3.65Å; F54-W241 AromaticContact CZ-CD2 3.63Å; F54-W241 HydrophobicContact CZ-CD2 3.63Å; F54-W241 HydrophobicContact CZ-CE3 4.19Å; F54-W241 AromaticContact CZ-CG 3.15Å; F54-W241 HydrophobicContact CZ-CG 3.15Å
55A92.1Very high89Confident58 Ų5844.2 Ų44.248%0.47925%0.253SS..Hα-helixtrans-62.1-42.8179.200000111.9V51 L52 F58 G59V51-A55 PolarHBondContact O-N 3.28Å; L52-A55 PolarHBondContact O-N 2.97Å; A55-F58 PolarHBondContact O-N 3.15Å; A55-G59 PolarHBondContact O-N 3.3Å
56I92.9Very high88.3Confident86 Ų8644.8 Ų44.844%0.44126%0.256SS..Hα-helixtrans-62.6-45.5175.3-66.5165.7000110.5L52 Q53 F54 F58 G59 G60 T116L52-I56 HydrophobicContact CG-CD1 4.17Å; L52-I56 WeakPolarHBondContact O-CG1 3.5Å; L52-I56 PolarHBondContact O-N 3.43Å; Q53-I56 PolarHBondContact O-N 3.5Å; F54-I56 PolarHBondContact O-N 2.85Å; I56-F58 PolarHBondContact O-N 3.1Å; I56-G59 PolarHBondContact O-N 3.38Å; I56-G60 PolarHBondContact O-N 3.44Å; I56-T116 HydrophobicContact CB-CG2 4.09Å; I56-T116 HydrophobicContact CD1-CG2 4.35Å; I56-T116 HydrophobicContact CG2-CG2 3.79Å
57T91.5Very high87.5Confident1 Ų147.3 Ų47.31%0.00627%0.271CS..Hα-helixtrans-64.2-43.5-179.1-50.20000111.1Q53 F54 T61 I123 Y238 W241Q53-T57 WeakPolarHBondContact O-CB 3.17Å; Q53-T57 PolarHBondContact O-N 2.91Å; Q53-T57 PolarHBondContact O-OG1 3.21Å; F54-T57 PolarHBondContact O-N 3.5Å; T57-T61 VanDerWaalsContact O-CB 3.23Å; T57-T61 WeakPolarHBondContact O-CB 3.33Å; T57-T61 PolarHBondContact O-N 2.95Å; T57-T61 PolarHBondContact O-OG1 3.33Å; T57-I123 HydrophobicContact CG2-CD1 3.77Å; T57-Y238 WeakPolarHBondContact OG1-CE2 3.4Å; T57-Y238 PolarHBondContact OG1-OH 3.36Å; T57-W241 HydrophobicContact CG2-CH2 4.03Å; T57-W241 HydrophobicContact CG2-CZ3 4.04Å
58F89.3Confident86.2Confident78 Ų7853.4 Ų53.434%0.34230%0.298SS..Hα-helixtrans-62.2-52.7176.2-175.9-112.6000111.7F54 A55 I56 G60 T61 Y62 F139F54-F58 WeakPolarHBondContact O-CB 3.38Å; F54-F58 PolarHBondContact O-N 3.06Å; A55-F58 PolarHBondContact O-N 3.15Å; I56-F58 PolarHBondContact O-N 3.1Å; F58-G60 VanDerWaalsContact C-N 3.34Å; F58-G60 PolarHBondContact O-N 3.05Å; F58-T61 PolarHBondContact O-N 2.88Å; F58-Y62 VanDerWaalsContact O-CB 3.27Å; F58-Y62 WeakPolarHBondContact O-CB 3.06Å; F58-Y62 PolarHBondContact O-N 2.8Å; F58-F139 HydrophobicContact CB-CD2 4.44Å; F58-F139 HydrophobicContact CB-CE1 4.02Å; F58-F139 HydrophobicContact CB-CE2 3.64Å; F58-F139 HydrophobicContact CB-CZ 3.45Å; F58-F139 VanDerWaalsContact CB-CZ 3.45Å; F58-F139 HydrophobicContact CD2-CB 4.34Å; F58-F139 AromaticContact CD2-CD1 3.48Å; F58-F139 HydrophobicContact CD2-CD1 3.48Å; F58-F139 VanDerWaalsContact CD2-CD1 3.48Å; F58-F139 AromaticContact CD2-CD2 3.61Å; F58-F139 HydrophobicContact CD2-CD2 3.61Å; F58-F139 AromaticContact CD2-CE1 3.59Å; F58-F139 HydrophobicContact CD2-CE1 3.59Å; F58-F139 AromaticContact CD2-CE2 3.66Å; F58-F139 HydrophobicContact CD2-CE2 3.66Å; F58-F139 AromaticContact CD2-CG 3.52Å; F58-F139 HydrophobicContact CD2-CG 3.52Å; F58-F139 AromaticContact CD2-CZ 3.71Å; F58-F139 HydrophobicContact CD2-CZ 3.71Å; F58-F139 HydrophobicContact CE2-CB 4.33Å; F58-F139 AromaticContact CE2-CD1 3.82Å; F58-F139 HydrophobicContact CE2-CD1 3.82Å; F58-F139 HydrophobicContact CE2-CD2 4.41Å; F58-F139 HydrophobicContact CE2-CE1 4.28Å; F58-F139 AromaticContact CE2-CG 3.92Å; F58-F139 HydrophobicContact CE2-CG 3.92Å; F58-F139 HydrophobicContact CG-CD1 4.24Å; F58-F139 HydrophobicContact CG-CD2 4.46Å; F58-F139 AromaticContact CG-CE1 3.88Å; F58-F139 HydrophobicContact CG-CE1 3.88Å; F58-F139 HydrophobicContact CG-CE2 4.06Å; F58-F139 AromaticContact CG-CZ 3.82Å; F58-F139 HydrophobicContact CG-CZ 3.82Å
59G89.9Confident84.6Confident30 Ų3059.1 Ų59.131%0.30931%0.314SS..Hα-helixtrans-59.7-44.7-18000000111.9A55 I56 Y62 L63A55-G59 PolarHBondContact O-N 3.3Å; I56-G59 PolarHBondContact O-N 3.38Å; G59-Y62 PolarHBondContact O-N 2.77Å; G59-L63 WeakPolarHBondContact O-CB 3.39Å; G59-L63 VanDerWaalsContact O-CG 3.27Å; G59-L63 WeakPolarHBondContact O-CG 3.49Å; G59-L63 PolarHBondContact O-N 3.11Å
60G87.6Confident83.1Confident15 Ų1559.9 Ų59.916%0.15532%0.318CS..Hα-helixtrans-63.4-48.6176.200000112.4I56 F58 Y62 L63 F64I56-G60 PolarHBondContact O-N 3.44Å; F58-G60 VanDerWaalsContact C-N 3.34Å; F58-G60 PolarHBondContact O-N 3.05Å; G60-Y62 VanDerWaalsContact C-N 3.31Å; G60-Y62 PolarHBondContact O-N 2.89Å; G60-L63 PolarHBondContact O-N 3.38Å; G60-F64 WeakPolarHBondContact O-CD2 3.5Å; G60-F64 PolarHBondContact O-N 3.27Å
61T87Confident81.4Confident7 Ų760.7 Ų60.74%0.04332%0.323CS..Hα-helixtrans-59.3-43.6177.7-56.50000111.4T57 F58 F64 I65 I123 A127 V135T57-T61 VanDerWaalsContact O-CB 3.23Å; T57-T61 WeakPolarHBondContact O-CB 3.33Å; T57-T61 PolarHBondContact O-N 2.95Å; T57-T61 PolarHBondContact O-OG1 3.33Å; F58-T61 PolarHBondContact O-N 2.88Å; T61-F64 PolarHBondContact O-N 3.24Å; T61-I65 HydrophobicContact CG2-CD1 3.94Å; T61-I65 VanDerWaalsContact O-CG1 3.3Å; T61-I65 WeakPolarHBondContact O-CG1 3.29Å; T61-I65 PolarHBondContact O-N 3.01Å; T61-I123 HydrophobicContact CG2-CG2 3.94Å; T61-I123 WeakPolarHBondContact OG1-CG2 3.28Å; T61-A127 HydrophobicContact CG2-CB 3.75Å; T61-V135 HydrophobicContact CG2-CG1 4.15Å
62Y84.8Confident79.8Confident94 Ų9458 Ų5837%0.36931%0.313SS..Hα-helixtrans-66-41.8179.5-168.1-108.9000112.4F58 G59 G60 F64 I65 L66F58-Y62 VanDerWaalsContact O-CB 3.27Å; F58-Y62 WeakPolarHBondContact O-CB 3.06Å; F58-Y62 PolarHBondContact O-N 2.8Å; G59-Y62 PolarHBondContact O-N 2.77Å; G60-Y62 VanDerWaalsContact C-N 3.31Å; G60-Y62 PolarHBondContact O-N 2.89Å; Y62-F64 VanDerWaalsContact C-N 3.33Å; Y62-F64 PolarHBondContact O-N 2.98Å; Y62-I65 PolarHBondContact O-N 3.48Å; Y62-L66 HydrophobicContact CD1-CD1 3.67Å; Y62-L66 HydrophobicContact CD1-CG 4.28Å; Y62-L66 HydrophobicContact CE1-CD1 3.15Å; Y62-L66 HydrophobicContact CE1-CG 3.97Å; Y62-L66 HydrophobicContact CE2-CD1 4.35Å; Y62-L66 HydrophobicContact CE2-CG 4.36Å; Y62-L66 HydrophobicContact CG-CD1 4.46Å; Y62-L66 WeakPolarHBondContact O-CG 3.29Å; Y62-L66 PolarHBondContact O-N 3.41Å
63L83.8Confident78.1Confident105 Ų10557.2 Ų57.255%0.5532%0.315SS..Hα-helixtrans-59.8-43.3173.4-76.5171.6000111.8G59 G60 I65 L66 V67G59-L63 WeakPolarHBondContact O-CB 3.39Å; G59-L63 VanDerWaalsContact O-CG 3.27Å; G59-L63 WeakPolarHBondContact O-CG 3.49Å; G59-L63 PolarHBondContact O-N 3.11Å; G60-L63 PolarHBondContact O-N 3.38Å; L63-I65 VanDerWaalsContact C-N 3.32Å; L63-I65 PolarHBondContact O-N 3.31Å; L63-L66 PolarHBondContact O-N 2.9Å; L63-V67 WeakPolarHBondContact O-CB 3.32Å; L63-V67 VanDerWaalsContact O-CG2 3.25Å; L63-V67 WeakPolarHBondContact O-CG2 3.28Å; L63-V67 PolarHBondContact O-N 2.93Å
64F79Confident76.5Confident42 Ų4257.8 Ų57.818%0.18432%0.318CS..Hα-helixtrans-66.7-33.2179.4-88-116.6000113.1G60 T61 Y62 I70 I74 L121 A124G60-F64 WeakPolarHBondContact O-CD2 3.5Å; G60-F64 PolarHBondContact O-N 3.27Å; T61-F64 PolarHBondContact O-N 3.24Å; Y62-F64 VanDerWaalsContact C-N 3.33Å; Y62-F64 PolarHBondContact O-N 2.98Å; F64-I70 HydrophobicContact CB-CG2 4.49Å; F64-I70 HydrophobicContact CD1-CG2 3.39Å; F64-I70 HydrophobicContact CD2-CG2 4.39Å; F64-I70 HydrophobicContact CE1-CG2 3.55Å; F64-I70 HydrophobicContact CG-CG2 3.85Å; F64-I70 HydrophobicContact CZ-CG2 4.13Å; F64-I74 HydrophobicContact CD1-CD1 3.27Å; F64-I74 HydrophobicContact CE1-CD1 3.37Å; F64-L121 HydrophobicContact CE1-CD2 3.72Å; F64-L121 HydrophobicContact CE2-CD2 4.34Å; F64-L121 HydrophobicContact CZ-CD2 3.39Å; F64-A124 HydrophobicContact CB-CB 3.71Å; F64-A124 HydrophobicContact CD1-CB 3.73Å; F64-A124 HydrophobicContact CD2-CB 4.31Å; F64-A124 HydrophobicContact CE1-CB 4.44Å; F64-A124 HydrophobicContact CG-CB 3.66Å
65I75.9Confident74.9Confident10 Ų1062 Ų625%0.05134%0.336CS..Hα-helixtrans-72.3-48176.4-70.8168.7000111.1T61 Y62 L63 A127 E132 V135T61-I65 HydrophobicContact CG2-CD1 3.94Å; T61-I65 VanDerWaalsContact O-CG1 3.3Å; T61-I65 WeakPolarHBondContact O-CG1 3.29Å; T61-I65 PolarHBondContact O-N 3.01Å; Y62-I65 PolarHBondContact O-N 3.48Å; L63-I65 VanDerWaalsContact C-N 3.32Å; L63-I65 PolarHBondContact O-N 3.31Å; I65-A127 HydrophobicContact CD1-CB 4.06Å; I65-E132 HydrophobicContact CG2-CB 3.96Å; I65-E132 HydrophobicContact CG2-CG 3.4Å; I65-V135 HydrophobicContact CD1-CB 4.1Å; I65-V135 HydrophobicContact CD1-CG1 3.83Å; I65-V135 HydrophobicContact CD1-CG2 3.99Å
66L75.4Confident73.2Confident83 Ų8367.6 Ų67.644%0.43535%0.352SS..Hα-helixtrans-70.7-38.3-176.3-73.5-175.9000113.1Y62 L63 Q68Y62-L66 HydrophobicContact CD1-CD1 3.67Å; Y62-L66 HydrophobicContact CD1-CG 4.28Å; Y62-L66 HydrophobicContact CE1-CD1 3.15Å; Y62-L66 HydrophobicContact CE1-CG 3.97Å; Y62-L66 HydrophobicContact CE2-CD1 4.35Å; Y62-L66 HydrophobicContact CE2-CG 4.36Å; Y62-L66 HydrophobicContact CG-CD1 4.46Å; Y62-L66 WeakPolarHBondContact O-CG 3.29Å; Y62-L66 PolarHBondContact O-N 3.41Å; L63-L66 PolarHBondContact O-N 2.9Å; L66-Q68 PolarHBondContact O-N 2.97Å
67V75.2Confident71.5Confident53 Ų5365.3 Ų65.332%0.32134%0.343SS..  trans-8189.4-179.2-175.90000108.4L63 Q69 I70 S71L63-V67 WeakPolarHBondContact O-CB 3.32Å; L63-V67 VanDerWaalsContact O-CG2 3.25Å; L63-V67 WeakPolarHBondContact O-CG2 3.28Å; L63-V67 PolarHBondContact O-N 2.93Å; V67-Q69 HydrophobicContact CG1-CB 4.17Å; V67-Q69 PolarHBondContact O-N 3.49Å; V67-I70 HydrophobicContact CB-CB 4.3Å; V67-I70 HydrophobicContact CB-CD1 3.9Å; V67-I70 HydrophobicContact CB-CG1 4.11Å; V67-I70 HydrophobicContact CG1-CB 4.2Å; V67-I70 HydrophobicContact CG1-CD1 3.77Å; V67-I70 HydrophobicContact CG1-CG1 3.66Å; V67-I70 HydrophobicContact CG2-CD1 4.42Å; V67-I70 PolarHBondContact O-N 3.31Å; V67-S71 PolarHBondContact O-N 3.09Å
68Q61.7Low70.3Confident167 Ų16769.5 Ų69.578%0.7836%0.362SS*.Hα-helixtrans-52.3-31.1179-76.4-176.3-500113.4L66 I70 S71 G72L66-Q68 PolarHBondContact O-N 2.97Å; Q68-I70 VanDerWaalsContact C-N 3.35Å; Q68-S71 PolarHBondContact O-N 2.66Å; Q68-G72 PolarHBondContact O-N 2.89Å
69Q57.5Low69.4Low161 Ų16170.1 Ų70.175%0.75237%0.373SS*.Hα-helixtrans-61.4-41.8174.8-70.5174.5-25.100111.9V67 C73V67-Q69 HydrophobicContact CG1-CB 4.17Å; V67-Q69 PolarHBondContact O-N 3.49Å; Q69-C73 WeakPolarHBondContact O-CB 3.18Å; Q69-C73 PolarHBondContact O-N 2.87Å; Q69-C73 VanDerWaalsContact O-N 3.12Å; Q69-C73 PolarHBondContact O-SG 3.43Å
70I60.7Low68.6Low59 Ų5972 Ų7230%0.30338%0.375SS..Hα-helixtrans-72.2-44.5177.1-62.9174.1000109.8F64 V67 Q68 G72 C73 I74F64-I70 HydrophobicContact CB-CG2 4.49Å; F64-I70 HydrophobicContact CD1-CG2 3.39Å; F64-I70 HydrophobicContact CD2-CG2 4.39Å; F64-I70 HydrophobicContact CE1-CG2 3.55Å; F64-I70 HydrophobicContact CG-CG2 3.85Å; F64-I70 HydrophobicContact CZ-CG2 4.13Å; V67-I70 HydrophobicContact CB-CB 4.3Å; V67-I70 HydrophobicContact CB-CD1 3.9Å; V67-I70 HydrophobicContact CB-CG1 4.11Å; V67-I70 HydrophobicContact CG1-CB 4.2Å; V67-I70 HydrophobicContact CG1-CD1 3.77Å; V67-I70 HydrophobicContact CG1-CG1 3.66Å; V67-I70 HydrophobicContact CG2-CD1 4.42Å; V67-I70 PolarHBondContact O-N 3.31Å; Q68-I70 VanDerWaalsContact C-N 3.35Å; I70-G72 VanDerWaalsContact C-N 3.31Å; I70-G72 PolarHBondContact O-N 3.32Å; I70-C73 PolarHBondContact O-N 3.47Å; I70-I74 HydrophobicContact CG2-CD1 3.67Å; I70-I74 WeakPolarHBondContact O-CD1 3.28Å; I70-I74 VanDerWaalsContact O-CG1 3.32Å; I70-I74 WeakPolarHBondContact O-CG1 3.44Å; I70-I74 PolarHBondContact O-N 2.84Å; I70-I74 VanDerWaalsContact O-N 3.08Å
71S56.9Low67.9Low16 Ų1671.8 Ų71.811%0.11237%0.37CS..Hα-helixtrans-59.5-41.1177.2-172.10000112.3V67 Q68 I74 K75V67-S71 PolarHBondContact O-N 3.09Å; Q68-S71 PolarHBondContact O-N 2.66Å; S71-I74 PolarHBondContact O-N 2.95Å; S71-K75 WeakPolarHBondContact O-CG 3.2Å; S71-K75 PolarHBondContact O-N 3.02Å
72G58.7Low67.3Low29 Ų2977.3 Ų77.330%0.29939%0.39SS..Hα-helixtrans-64.2-45.8175.500000112.6Q68 I70 I74 K75 H76Q68-G72 PolarHBondContact O-N 2.89Å; I70-G72 VanDerWaalsContact C-N 3.31Å; I70-G72 PolarHBondContact O-N 3.32Å; G72-I74 PolarHBondContact O-N 3.29Å; G72-K75 PolarHBondContact O-N 3.37Å; G72-H76 PolarHBondContact O-CD2 3.43Å; G72-H76 VanDerWaalsContact O-CD2 3.3Å; G72-H76 PolarHBondContact O-N 3.46Å
73C56.1Low67.1Low90 Ų9076.8 Ų76.861%0.60840%0.397SS*.Hα-helixtrans-61.9-25.6176.6-75.90000113.7Q69 I70 P77Q69-C73 WeakPolarHBondContact O-CB 3.18Å; Q69-C73 PolarHBondContact O-N 2.87Å; Q69-C73 VanDerWaalsContact O-N 3.12Å; Q69-C73 PolarHBondContact O-SG 3.43Å; I70-C73 PolarHBondContact O-N 3.47Å; C73-P77 WeakPolarHBondContact O-CD 3.5Å; C73-P77 WeakPolarHBondContact O-CG 3.38Å
74I58.9Low66.7Low15 Ų1572 Ų728%0.07737%0.373CS..Hα-helixtrans-89.4-33179.9-66.8164.8000112.2F64 I70 S71 G72 H76 P77 I80 S125F64-I74 HydrophobicContact CD1-CD1 3.27Å; F64-I74 HydrophobicContact CE1-CD1 3.37Å; I70-I74 HydrophobicContact CG2-CD1 3.67Å; I70-I74 WeakPolarHBondContact O-CD1 3.28Å; I70-I74 VanDerWaalsContact O-CG1 3.32Å; I70-I74 WeakPolarHBondContact O-CG1 3.44Å; I70-I74 PolarHBondContact O-N 2.84Å; I70-I74 VanDerWaalsContact O-N 3.08Å; S71-I74 PolarHBondContact O-N 2.95Å; G72-I74 PolarHBondContact O-N 3.29Å; I74-H76 VanDerWaalsContact C-N 3.33Å; I74-H76 PolarHBondContact O-N 3.29Å; I74-P77 CarbonylContact O-C 3.59Å; I74-P77 WeakPolarHBondContact O-CD 3.5Å; I74-I80 HydrophobicContact CG2-CG2 4.42Å; I74-S125 WeakPolarHBondContact CG2-OG 3.32Å
75K57.3Low66.6Low102 Ų10271.5 Ų71.544%0.44337%0.374SS..Hα-helixtrans-67.2-33.5177.8-76.3-178-177-166.10113.1S71 G72S71-K75 WeakPolarHBondContact O-CG 3.2Å; S71-K75 PolarHBondContact O-N 3.02Å; G72-K75 PolarHBondContact O-N 3.37Å
76H56.3Low66.8Low176 Ų17673.7 Ų73.782%0.81539%0.388SS*.SBendtrans-67.5-41.6-176.5-87.1-65.4000113.4G72 I74G72-H76 PolarHBondContact O-CD2 3.43Å; G72-H76 VanDerWaalsContact O-CD2 3.3Å; G72-H76 PolarHBondContact O-N 3.46Å; I74-H76 VanDerWaalsContact C-N 3.33Å; I74-H76 PolarHBondContact O-N 3.29Å
77P58.7Low67.2Low38 Ų3872.5 Ų72.525%0.24738%0.381CS..  trans-101.692.2167.135.2-30.1000110.3C73 I74 T79 I80C73-P77 WeakPolarHBondContact O-CD 3.5Å; C73-P77 WeakPolarHBondContact O-CG 3.38Å; I74-P77 CarbonylContact O-C 3.59Å; I74-P77 WeakPolarHBondContact O-CD 3.5Å; P77-T79 VanDerWaalsContact CB-OG1 3.27Å; P77-T79 WeakPolarHBondContact CB-OG1 3.41Å; P77-T79 PolarHBondContact O-N 3Å; P77-I80 HydrophobicContact CB-CD1 4.44Å; P77-I80 HydrophobicContact CB-CG1 4.18Å; P77-I80 HydrophobicContact CG-CD1 3.45Å; P77-I80 VanDerWaalsContact CG-CD1 3.45Å; P77-I80 HydrophobicContact CG-CG1 3.69Å; P77-I80 PolarHBondContact O-N 2.89Å
78E66.3Low67.5Low89 Ų8970 Ų7042%0.41637%0.366SS..Hα-helixtrans-50.7-19.4164.8-62-176.3171.800111.9I80 L81 W82 F186 K190E78-I80 VanDerWaalsContact C-N 3.32Å; E78-I80 PolarHBondContact O-N 3.12Å; E78-L81 WeakPolarHBondContact O-CB 3.18Å; E78-L81 PolarHBondContact O-N 2.88Å; E78-W82 PolarHBondContact O-N 3.35Å; E78-F186 HydrophobicContact CB-CE1 4.12Å; E78-F186 HydrophobicContact CG-CE1 4.42Å; E78-K190 WeakPolarHBondContact OE1-CE 3.29Å; E78-K190 IonicContact OE1-NZ 2.68Å; E78-K190 PolarHBondContact OE1-NZ 2.98Å
79T70Confident68.4Low92 Ų9263.4 Ų63.456%0.56434%0.336SS*.Hα-helixtrans-59.7-31.217157.40000114P77 W82 V83P77-T79 VanDerWaalsContact CB-OG1 3.27Å; P77-T79 WeakPolarHBondContact CB-OG1 3.41Å; P77-T79 PolarHBondContact O-N 3Å; T79-W82 PolarHBondContact O-N 3.29Å; T79-V83 VanDerWaalsContact O-CB 3.31Å; T79-V83 WeakPolarHBondContact O-CB 3.3Å; T79-V83 WeakPolarHBondContact O-CG2 3.47Å; T79-V83 PolarHBondContact O-N 2.97Å
80I72.6Confident69.7Low70 Ų7059 Ų5936%0.35932%0.32SS..Hα-helixtrans-65.8-41177.9-69.1179.8000110.8I74 P77 E78 W82 S84I74-I80 HydrophobicContact CG2-CG2 4.42Å; P77-I80 HydrophobicContact CB-CD1 4.44Å; P77-I80 HydrophobicContact CB-CG1 4.18Å; P77-I80 HydrophobicContact CG-CD1 3.45Å; P77-I80 VanDerWaalsContact CG-CD1 3.45Å; P77-I80 HydrophobicContact CG-CG1 3.69Å; P77-I80 PolarHBondContact O-N 2.89Å; E78-I80 VanDerWaalsContact C-N 3.32Å; E78-I80 PolarHBondContact O-N 3.12Å; I80-W82 VanDerWaalsContact C-N 3.3Å; I80-W82 PolarHBondContact O-N 2.84Å; I80-S84 WeakPolarHBondContact O-CB 3.48Å; I80-S84 PolarHBondContact O-N 3.42Å; I80-S84 PolarHBondContact O-OG 3.5Å
81L73.5Confident70.9Confident10 Ų1057 Ų575%0.05231%0.31CS..Hα-helixtrans-58.6-48.5175.4-168156.7000109.8E78 S84 S85 S125 L129 Q182 F186E78-L81 WeakPolarHBondContact O-CB 3.18Å; E78-L81 PolarHBondContact O-N 2.88Å; L81-S84 PolarHBondContact O-OG 3.49Å; L81-S84 VanDerWaalsContact O-OG 3.09Å; L81-S85 VanDerWaalsContact O-CB 3.28Å; L81-S85 WeakPolarHBondContact O-CB 3.26Å; L81-S85 PolarHBondContact O-N 3.5Å; L81-S85 PolarHBondContact O-OG 3.45Å; L81-S125 WeakPolarHBondContact CA-OG 3.27Å; L81-S125 WeakPolarHBondContact CB-OG 3.43Å; L81-S125 WeakPolarHBondContact CG-OG 3.02Å; L81-L129 HydrophobicContact CD1-CD1 4.33Å; L81-Q182 HydrophobicContact CD2-CG 4.31Å; L81-F186 HydrophobicContact CD1-CZ 4.41Å; L81-F186 HydrophobicContact CD2-CE2 4.07Å; L81-F186 HydrophobicContact CD2-CZ 4.17Å
82W74.8Confident72.1Confident122 Ų12256.8 Ų56.846%0.46231%0.307SS..Hα-helixtrans-65.3-48.1-177.9-127.378.6000112E78 T79 I80 S85 V86 F186E78-W82 PolarHBondContact O-N 3.35Å; T79-W82 PolarHBondContact O-N 3.29Å; I80-W82 VanDerWaalsContact C-N 3.3Å; I80-W82 PolarHBondContact O-N 2.84Å; W82-S85 PolarHBondContact O-N 3.3Å; W82-V86 HydrophobicContact CD2-CG2 4.43Å; W82-V86 HydrophobicContact CE3-CG2 3.77Å; W82-V86 HydrophobicContact CZ3-CG2 3.93Å; W82-V86 WeakPolarHBondContact O-CB 3.23Å; W82-V86 VanDerWaalsContact O-CG2 3.23Å; W82-V86 WeakPolarHBondContact O-CG2 3.2Å; W82-V86 PolarHBondContact O-N 3Å; W82-F186 AromaticContact CD1-CD2 3.95Å; W82-F186 AromaticContact CD1-CE2 3.76Å; W82-F186 AromaticContact NE1-CD2 3.92Å
83V79.1Confident73.2Confident83 Ų8358 Ų5850%0.50331%0.307SS..Hα-helixtrans-63.7-46.4-179.3170.90000110.9T79 S85 V86 I87T79-V83 VanDerWaalsContact O-CB 3.31Å; T79-V83 WeakPolarHBondContact O-CB 3.3Å; T79-V83 WeakPolarHBondContact O-CG2 3.47Å; T79-V83 PolarHBondContact O-N 2.97Å; V83-S85 PolarHBondContact O-N 3.44Å; V83-V86 PolarHBondContact O-N 3.02Å; V83-I87 HydrophobicContact CG1-CD1 3.58Å; V83-I87 HydrophobicContact CG1-CG1 4.37Å; V83-I87 WeakPolarHBondContact O-CB 3.23Å; V83-I87 WeakPolarHBondContact O-CD1 3.43Å; V83-I87 WeakPolarHBondContact O-CG1 3.27Å; V83-I87 PolarHBondContact O-N 3.49Å
84S77.2Confident74.5Confident6 Ų656.8 Ų56.84%0.04229%0.293CS..Hα-helixtrans-64.5-40.9178.757.80000112.4I80 L81 I87 Y88I80-S84 WeakPolarHBondContact O-CB 3.48Å; I80-S84 PolarHBondContact O-N 3.42Å; I80-S84 PolarHBondContact O-OG 3.5Å; L81-S84 PolarHBondContact O-OG 3.49Å; L81-S84 VanDerWaalsContact O-OG 3.09Å; S84-I87 PolarHBondContact O-N 3.38Å; S84-Y88 WeakPolarHBondContact O-CB 3.44Å; S84-Y88 PolarHBondContact O-N 2.89Å
85S75.3Confident75.5Confident31 Ų3156.9 Ų56.922%0.21729%0.293CS..Hα-helixtrans-66.3-43.6178.2-58.70000112.2L81 W82 V83 Y88 L89L81-S85 VanDerWaalsContact O-CB 3.28Å; L81-S85 WeakPolarHBondContact O-CB 3.26Å; L81-S85 PolarHBondContact O-N 3.5Å; L81-S85 PolarHBondContact O-OG 3.45Å; W82-S85 PolarHBondContact O-N 3.3Å; V83-S85 PolarHBondContact O-N 3.44Å; S85-Y88 PolarHBondContact O-N 3.47Å; S85-L89 WeakPolarHBondContact O-CB 3.26Å; S85-L89 PolarHBondContact O-N 3.18Å
86V79.7Confident76.4Confident55 Ų5555 Ų5533%0.33329%0.286SS..Hα-helixtrans-65.1-44.1176.81710000110.9W82 V83 Y88 L89 V90W82-V86 HydrophobicContact CD2-CG2 4.43Å; W82-V86 HydrophobicContact CE3-CG2 3.77Å; W82-V86 HydrophobicContact CZ3-CG2 3.93Å; W82-V86 WeakPolarHBondContact O-CB 3.23Å; W82-V86 VanDerWaalsContact O-CG2 3.23Å; W82-V86 WeakPolarHBondContact O-CG2 3.2Å; W82-V86 PolarHBondContact O-N 3Å; V83-V86 PolarHBondContact O-N 3.02Å; V86-Y88 PolarHBondContact O-N 3.32Å; V86-L89 PolarHBondContact O-N 3.06Å; V86-V90 HydrophobicContact CG1-CG2 4.41Å; V86-V90 VanDerWaalsContact O-CG2 3.29Å; V86-V90 WeakPolarHBondContact O-CG2 3.4Å; V86-V90 PolarHBondContact O-N 3.21Å
87I84.3Confident77.5Confident58 Ų5852.7 Ų52.730%0.29727%0.274SS..Hα-helixtrans-61.1-47176.9-70167.6000110.5V83 S84 L89 V90 L91 F118V83-I87 HydrophobicContact CG1-CD1 3.58Å; V83-I87 HydrophobicContact CG1-CG1 4.37Å; V83-I87 WeakPolarHBondContact O-CB 3.23Å; V83-I87 WeakPolarHBondContact O-CD1 3.43Å; V83-I87 WeakPolarHBondContact O-CG1 3.27Å; V83-I87 PolarHBondContact O-N 3.49Å; S84-I87 PolarHBondContact O-N 3.38Å; I87-L89 VanDerWaalsContact C-N 3.31Å; I87-L89 PolarHBondContact O-N 3.24Å; I87-V90 PolarHBondContact O-N 2.98Å; I87-L91 HydrophobicContact CG2-CD1 3.92Å; I87-L91 HydrophobicContact CG2-CG 4.4Å; I87-L91 WeakPolarHBondContact O-CG 3.37Å; I87-L91 PolarHBondContact O-N 2.92Å; I87-F118 HydrophobicContact CB-CD1 4.29Å; I87-F118 HydrophobicContact CB-CE1 4.45Å; I87-F118 HydrophobicContact CD1-CE1 3.98Å; I87-F118 HydrophobicContact CD1-CZ 4.44Å; I87-F118 HydrophobicContact CG2-CB 4.48Å; I87-F118 HydrophobicContact CG2-CD1 3.74Å; I87-F118 HydrophobicContact CG2-CD2 3.78Å; I87-F118 HydrophobicContact CG2-CE1 3.81Å; I87-F118 HydrophobicContact CG2-CE2 3.82Å; I87-F118 HydrophobicContact CG2-CG 3.75Å; I87-F118 HydrophobicContact CG2-CZ 3.85Å
88Y82.8Confident78.7Confident2 Ų254.1 Ų54.11%0.00828%0.282CS..Hα-helixtrans-58.2-44.7177.4175.3-106.4000111.6S84 S85 V86 V90 L91 Q92 M115 N239 W242S84-Y88 WeakPolarHBondContact O-CB 3.44Å; S84-Y88 PolarHBondContact O-N 2.89Å; S85-Y88 PolarHBondContact O-N 3.47Å; V86-Y88 PolarHBondContact O-N 3.32Å; Y88-V90 PolarHBondContact O-N 3.19Å; Y88-L91 WeakPolarHBondContact O-CB 3.38Å; Y88-L91 PolarHBondContact O-N 3.13Å; Y88-Q92 WeakPolarHBondContact O-CB 3.4Å; Y88-Q92 PolarHBondContact O-N 2.94Å; Y88-M115 HydrophobicContact CD2-CE 4.08Å; Y88-M115 HydrophobicContact CD2-SD 4.04Å; Y88-M115 HydrophobicContact CE2-CE 3.41Å; Y88-M115 VanDerWaalsContact CE2-CE 3.41Å; Y88-M115 HydrophobicContact CE2-SD 3.95Å; Y88-N239 PolarHBondContact OH-OD1 3.31Å; Y88-N239 VanDerWaalsContact OH-OD1 3.06Å; Y88-W242 AromaticContact CD1-CH2 3.72Å; Y88-W242 HydrophobicContact CD1-CH2 3.72Å; Y88-W242 AromaticContact CD1-CZ2 3.62Å; Y88-W242 HydrophobicContact CD1-CZ2 3.62Å; Y88-W242 HydrophobicContact CD1-CZ3 4.22Å; Y88-W242 AromaticContact CE1-CD2 3.61Å; Y88-W242 HydrophobicContact CE1-CD2 3.61Å; Y88-W242 AromaticContact CE1-CE2 3.54Å; Y88-W242 AromaticContact CE1-CE3 3.62Å; Y88-W242 HydrophobicContact CE1-CE3 3.62Å; Y88-W242 HydrophobicContact CE1-CG 4.35Å; Y88-W242 AromaticContact CE1-CH2 3.56Å; Y88-W242 HydrophobicContact CE1-CH2 3.56Å; Y88-W242 AromaticContact CE1-CZ2 3.54Å; Y88-W242 HydrophobicContact CE1-CZ2 3.54Å; Y88-W242 AromaticContact CE1-CZ3 3.62Å; Y88-W242 HydrophobicContact CE1-CZ3 3.62Å; Y88-W242 AromaticContact CZ-CD2 3.85Å; Y88-W242 AromaticContact CZ-CE2 3.94Å
89L80.7Confident79Confident28 Ų2852.2 Ų52.215%0.14728%0.277CS..Hα-helixtrans-66.4-40.7-179.9-164.5146.9000112.5S85 V86 I87 L91 Q92 L93 L179S85-L89 WeakPolarHBondContact O-CB 3.26Å; S85-L89 PolarHBondContact O-N 3.18Å; V86-L89 PolarHBondContact O-N 3.06Å; I87-L89 VanDerWaalsContact C-N 3.31Å; I87-L89 PolarHBondContact O-N 3.24Å; L89-L91 VanDerWaalsContact C-N 3.3Å; L89-L91 PolarHBondContact O-N 3.37Å; L89-Q92 WeakPolarHBondContact O-CB 3.33Å; L89-Q92 PolarHBondContact O-N 2.87Å; L89-L93 HydrophobicContact CD2-CD1 3.5Å; L89-L93 HydrophobicContact CD2-CG 3.95Å; L89-L93 WeakPolarHBondContact O-CG 3.48Å; L89-L93 PolarHBondContact O-N 3.3Å; L89-L179 HydrophobicContact CD1-CD1 3.22Å; L89-L179 HydrophobicContact CD1-CD2 3.9Å; L89-L179 HydrophobicContact CD1-CG 3.3Å; L89-L179 HydrophobicContact CD2-CD1 3.95Å; L89-L179 HydrophobicContact CG-CD1 4.23Å
90V84.7Confident79.3Confident69 Ų6949.6 Ų49.642%0.41827%0.268SS..Hα-helixtrans-60.7-43.9173.6169.70000110.3V86 I87 Y88 Q92 L93 I94V86-V90 HydrophobicContact CG1-CG2 4.41Å; V86-V90 VanDerWaalsContact O-CG2 3.29Å; V86-V90 WeakPolarHBondContact O-CG2 3.4Å; V86-V90 PolarHBondContact O-N 3.21Å; I87-V90 PolarHBondContact O-N 2.98Å; Y88-V90 PolarHBondContact O-N 3.19Å; V90-Q92 VanDerWaalsContact C-N 3.29Å; V90-Q92 PolarHBondContact O-N 3.05Å; V90-L93 PolarHBondContact O-N 3.43Å; V90-I94 HydrophobicContact CG1-CD1 3.86Å; V90-I94 WeakPolarHBondContact O-CG1 3.36Å; V90-I94 PolarHBondContact O-N 2.85Å
91L84.4Confident79.3Confident17 Ų1749.6 Ų49.69%0.08927%0.269CS..Hα-helixtrans-63.6-36176.2-70168.1000111.8I87 Y88 L89 W95 Y111 L114 M115 F118I87-L91 HydrophobicContact CG2-CD1 3.92Å; I87-L91 HydrophobicContact CG2-CG 4.4Å; I87-L91 WeakPolarHBondContact O-CG 3.37Å; I87-L91 PolarHBondContact O-N 2.92Å; Y88-L91 WeakPolarHBondContact O-CB 3.38Å; Y88-L91 PolarHBondContact O-N 3.13Å; L89-L91 VanDerWaalsContact C-N 3.3Å; L89-L91 PolarHBondContact O-N 3.37Å; L91-W95 WeakPolarHBondContact O-CB 3.05Å; L91-W95 PolarHBondContact O-N 3.43Å; L91-Y111 VanDerWaalsContact C-OH 3.3Å; L91-Y111 WeakPolarHBondContact CA-OH 3.21Å; L91-Y111 HydrophobicContact CB-CE1 4.13Å; L91-Y111 HydrophobicContact CD2-CE1 4.04Å; L91-Y111 HydrophobicContact CD2-CE2 4.05Å; L91-Y111 WeakPolarHBondContact CD2-OH 3.16Å; L91-Y111 PolarHBondContact O-OH 2.92Å; L91-L114 HydrophobicContact CD1-CD2 4.22Å; L91-L114 HydrophobicContact CD1-CG 4.14Å; L91-L114 HydrophobicContact CD2-CD2 3.91Å; L91-M115 HydrophobicContact CB-CG 4.38Å; L91-M115 HydrophobicContact CB-SD 3.28Å; L91-M115 WeakPolarHBondContact CB-SD 3.45Å; L91-M115 HydrophobicContact CD1-SD 4.22Å; L91-M115 HydrophobicContact CG-SD 4.35Å; L91-F118 HydrophobicContact CD1-CB 4.39Å; L91-F118 HydrophobicContact CD1-CD2 3.6Å; L91-F118 HydrophobicContact CD1-CE2 4.27Å; L91-F118 HydrophobicContact CD1-CG 4.3Å
92Q82Confident79.1Confident10 Ų1049.2 Ų49.25%0.04727%0.267CS..Hα-helixtrans-66.1-43.6174.6-177.1179.8-17.500112Y88 L89 V90 W95 M96 M115 D175 N239Y88-Q92 WeakPolarHBondContact O-CB 3.4Å; Y88-Q92 PolarHBondContact O-N 2.94Å; L89-Q92 WeakPolarHBondContact O-CB 3.33Å; L89-Q92 PolarHBondContact O-N 2.87Å; V90-Q92 VanDerWaalsContact C-N 3.29Å; V90-Q92 PolarHBondContact O-N 3.05Å; Q92-W95 WeakPolarHBondContact O-CB 3.4Å; Q92-W95 PolarHBondContact O-N 2.97Å; Q92-M96 PolarHBondContact O-N 3.21Å; Q92-M115 HydrophobicContact CB-CE 4.22Å; Q92-D175 PolarHBondContact NE2-OD1 3.25Å; Q92-D175 PolarHBondContact NE2-OD2 3.27Å; Q92-N239 VanDerWaalsContact CD-ND2 3.3Å; Q92-N239 PolarHBondContact NE2-ND2 3.27Å; Q92-N239 PolarHBondContact NE2-OD1 3.21Å; Q92-N239 PolarHBondContact OE1-OD1 3.17Å
93L82.4Confident79.2Confident56 Ų5649.1 Ų49.129%0.29327%0.266SS..Hα-helixtrans-61.5-46.5176.3-74.7168.8000111.2L89 V90 W95 M96 F97 L172L89-L93 HydrophobicContact CD2-CD1 3.5Å; L89-L93 HydrophobicContact CD2-CG 3.95Å; L89-L93 WeakPolarHBondContact O-CG 3.48Å; L89-L93 PolarHBondContact O-N 3.3Å; V90-L93 PolarHBondContact O-N 3.43Å; L93-W95 VanDerWaalsContact C-N 3.26Å; L93-W95 PolarHBondContact O-N 3.41Å; L93-M96 PolarHBondContact O-N 3.26Å; L93-M96 VanDerWaalsContact O-N 3.13Å; L93-F97 HydrophobicContact CB-CD2 4.44Å; L93-F97 HydrophobicContact CD2-CD2 4.44Å; L93-F97 HydrophobicContact CD2-CE2 3.83Å; L93-F97 WeakPolarHBondContact O-CD2 3.4Å; L93-F97 PolarHBondContact O-N 2.94Å; L93-L172 HydrophobicContact CD2-CD2 4.13Å
94I82.8Confident79.2Confident63 Ų6351.9 Ų51.932%0.32327%0.272SS..Hα-helixtrans-60-40.3176.3-68.4164.2000110.3V90 M96 V98 L101 Y111V90-I94 HydrophobicContact CG1-CD1 3.86Å; V90-I94 WeakPolarHBondContact O-CG1 3.36Å; V90-I94 PolarHBondContact O-N 2.85Å; I94-M96 VanDerWaalsContact C-N 3.31Å; I94-M96 PolarHBondContact O-N 3.36Å; I94-V98 WeakPolarHBondContact O-CA 3.41Å; I94-V98 WeakPolarHBondContact O-CB 3.42Å; I94-V98 PolarHBondContact O-N 3.11Å; I94-L101 HydrophobicContact CG2-CD1 3.74Å; I94-Y111 WeakPolarHBondContact CB-OH 3.34Å; I94-Y111 HydrophobicContact CG2-CE2 3.97Å; I94-Y111 WeakPolarHBondContact CG2-OH 3.2Å
95W80.2Confident79.2Confident18 Ų1860.4 Ų60.47%0.06830%0.304CS..Hα-helixtrans-62.4-39.7176.8-158.5-58.5000111.7L91 Q92 L93 S102 Y111 L112 M115 V231L91-W95 WeakPolarHBondContact O-CB 3.05Å; L91-W95 PolarHBondContact O-N 3.43Å; Q92-W95 WeakPolarHBondContact O-CB 3.4Å; Q92-W95 PolarHBondContact O-N 2.97Å; L93-W95 VanDerWaalsContact C-N 3.26Å; L93-W95 PolarHBondContact O-N 3.41Å; W95-S102 WeakPolarHBondContact CZ2-OG 3.35Å; W95-Y111 HydrophobicContact CB-CE1 4.41Å; W95-Y111 HydrophobicContact CD2-CD1 4.22Å; W95-Y111 HydrophobicContact CD2-CE1 4.2Å; W95-Y111 AromaticContact CE3-CD1 3.15Å; W95-Y111 HydrophobicContact CE3-CD1 3.15Å; W95-Y111 AromaticContact CE3-CE1 3.3Å; W95-Y111 HydrophobicContact CE3-CE1 3.3Å; W95-Y111 HydrophobicContact CE3-CG 4.23Å; W95-Y111 HydrophobicContact CH2-CD1 4.32Å; W95-Y111 AromaticContact CZ3-CD1 3.24Å; W95-Y111 HydrophobicContact CZ3-CD1 3.24Å; W95-Y111 AromaticContact CZ3-CE1 3.91Å; W95-Y111 HydrophobicContact CZ3-CE1 3.91Å; W95-Y111 HydrophobicContact CZ3-CG 4.13Å; W95-L112 HydrophobicContact CH2-CB 4.08Å; W95-L112 HydrophobicContact CZ3-CB 4.5Å; W95-M115 HydrophobicContact CE3-CG 3.65Å; W95-M115 HydrophobicContact CZ3-CB 4.32Å; W95-M115 HydrophobicContact CZ3-CG 3.71Å; W95-V231 HydrophobicContact CH2-CG1 4.09Å; W95-V231 HydrophobicContact CZ2-CG1 4.14Å; W95-V231 WeakPolarHBondContact CZ2-O 3.44Å
96M76.7Confident79.6Confident61 Ų6161.7 Ų61.730%0.331%0.312SS..Hα-helixtrans-71.5-42.9-179.7-164.6-179.5-15600112.9Q92 L93 I94 L168 L172Q92-M96 PolarHBondContact O-N 3.21Å; L93-M96 PolarHBondContact O-N 3.26Å; L93-M96 VanDerWaalsContact O-N 3.13Å; I94-M96 VanDerWaalsContact C-N 3.31Å; I94-M96 PolarHBondContact O-N 3.36Å; M96-L168 HydrophobicContact CE-CB 4.29Å; M96-L168 HydrophobicContact CE-CD2 4.29Å; M96-L168 HydrophobicContact CE-CG 3.66Å; M96-L172 HydrophobicContact SD-CD2 4.03Å; M96-L172 HydrophobicContact SD-CG 4.35Å
97F80.2Confident79.8Confident129 Ų12965.8 Ų65.857%0.56632%0.322SS*.Hα-helixtrans-88.2-22.7-175.8-71.4-67.6000113.9L93 P99L93-F97 HydrophobicContact CB-CD2 4.44Å; L93-F97 HydrophobicContact CD2-CD2 4.44Å; L93-F97 HydrophobicContact CD2-CE2 3.83Å; L93-F97 WeakPolarHBondContact O-CD2 3.4Å; L93-F97 PolarHBondContact O-N 2.94Å; F97-P99 VanDerWaalsContact C-CD 3.45Å; F97-P99 WeakPolarHBondContact O-CD 3.42Å
98V82.2Confident79.8Confident68 Ų6864 Ų6441%0.41231%0.313SS..  trans-125.368.7-176.2-165.70000110.7I94 G100 L101I94-V98 WeakPolarHBondContact O-CA 3.41Å; I94-V98 WeakPolarHBondContact O-CB 3.42Å; I94-V98 PolarHBondContact O-N 3.11Å; V98-G100 PolarHBondContact O-N 3.05Å; V98-L101 HydrophobicContact CB-CD1 4.04Å; V98-L101 HydrophobicContact CG1-CD1 3.73Å; V98-L101 HydrophobicContact CG1-CG 3.89Å; V98-L101 PolarHBondContact O-N 3.25Å
99P73.3Confident80Confident49 Ų4967.3 Ų67.332%0.31833%0.331SS..Hα-helixtrans-62.3-19.8178.126.1-34.8000112.5F97 L101 S102 R103 L232F97-P99 VanDerWaalsContact C-CD 3.45Å; F97-P99 WeakPolarHBondContact O-CD 3.42Å; P99-L101 VanDerWaalsContact C-N 3.25Å; P99-L101 PolarHBondContact O-N 3.41Å; P99-S102 WeakPolarHBondContact O-CB 3.4Å; P99-S102 PolarHBondContact O-N 3Å; P99-S102 VanDerWaalsContact O-N 3.08Å; P99-R103 WeakPolarHBondContact O-CG 3.38Å; P99-R103 PolarHBondContact O-N 3.47Å; P99-L232 HydrophobicContact CB-CD2 4.14Å
100G76.3Confident80.3Confident37 Ų3772 Ų7238%0.38135%0.353SS..Hα-helixtrans-59.8-29.6176.500000114.5V98 R103V98-G100 PolarHBondContact O-N 3.05Å; G100-R103 PolarHBondContact O-N 2.84Å
101L72.1Confident80.3Confident69 Ų6970.2 Ų70.236%0.36134%0.339SS..Hα-helixtrans-69.1-38.2174.6-77.3163.2000111.4I94 V98 P99 R103I94-L101 HydrophobicContact CG2-CD1 3.74Å; V98-L101 HydrophobicContact CB-CD1 4.04Å; V98-L101 HydrophobicContact CG1-CD1 3.73Å; V98-L101 HydrophobicContact CG1-CG 3.89Å; V98-L101 PolarHBondContact O-N 3.25Å; P99-L101 VanDerWaalsContact C-N 3.25Å; P99-L101 PolarHBondContact O-N 3.41Å; L101-R103 PolarHBondContact O-N 2.62Å
102S70.3Confident80.5Confident3 Ų370.3 Ų70.32%0.02134%0.34CS..Hα-helixtrans-72.3-15.6179178.50000113.7W95 P99 N108 L232W95-S102 WeakPolarHBondContact CZ2-OG 3.35Å; P99-S102 WeakPolarHBondContact O-CB 3.4Å; P99-S102 PolarHBondContact O-N 3Å; P99-S102 VanDerWaalsContact O-N 3.08Å; S102-N108 WeakPolarHBondContact O-CB 3.44Å; S102-L232 WeakPolarHBondContact OG-CA 3.45Å; S102-L232 WeakPolarHBondContact OG-CB 3.21Å; S102-L232 PolarHBondContact OG-N 3.38Å; S102-L232 VanDerWaalsContact OG-N 3.13Å
103R77.5Confident80.9Confident119 Ų11974.7 Ų74.745%0.44936%0.362SS..Hα-helixtrans-93.2-20.1-177.4-71173.7176.7-166-8.8113.6P99 G100 L101 D229P99-R103 WeakPolarHBondContact O-CG 3.38Å; P99-R103 PolarHBondContact O-N 3.47Å; G100-R103 PolarHBondContact O-N 2.84Å; L101-R103 PolarHBondContact O-N 2.62Å; R103-D229 WeakPolarHBondContact CG-OD1 3.16Å; R103-D229 IonicContact CZ-OD1 3.26Å; R103-D229 VanDerWaalsContact CZ-OD1 3.26Å; R103-D229 IonicContact CZ-OD2 3.78Å; R103-D229 IonicContact NE-OD1 2.67Å; R103-D229 PolarHBondContact NE-OD1 3.01Å; R103-D229 IonicContact NE-OD2 3.95Å; R103-D229 IonicContact NH2-OD1 3.07Å; R103-D229 PolarHBondContact NH2-OD1 3.38Å; R103-D229 VanDerWaalsContact NH2-OD1 3.07Å; R103-D229 IonicContact NH2-OD2 2.86Å; R103-D229 PolarHBondContact NH2-OD2 3.02Å
104K79Confident81.2Confident141 Ų14175.6 Ų75.661%0.61337%0.367SS*.SBendtrans-99.1120.8-174.5-68.5-175.1-179.1-177.70111.2Y107 N108K104-Y107 HydrophobicContact CB-CD2 4.23Å; K104-Y107 WeakPolarHBondContact O-CB 3.45Å; K104-Y107 PolarHBondContact O-N 3.39Å; K104-N108 PolarHBondContact O-N 3.35Å
105Y77.5Confident81.5Confident186 Ų18672.9 Ų72.973%0.72935%0.353SS*.THydrogen-bonded Turntrans-71.7140.8165.5-174.9-94.6000110N108 I109Y105-N108 WeakPolarHBondContact CA-OD1 3.46Å; Y105-I109 HydrophobicContact CD2-CG1 4.34Å; Y105-I109 HydrophobicContact CE2-CG1 4.25Å
106P82.9Confident82Confident57 Ų5772.3 Ų72.337%0.3735%0.352SS..THydrogen-bonded Turncis-90.2-0.6-0.236.1-35.6000114.5N108 I109 M110P106-N108 PolarHBondContact O-N 2.82Å; P106-I109 PolarHBondContact O-N 3.24Å; P106-M110 PolarHBondContact O-N 3.05Å
107Y83.8Confident82.6Confident141 Ų14173.8 Ų73.855%0.55336%0.36SS*.Hα-helixtrans-57.3-36.9-174.6-60.4-75000112.8K104 I109 M110 Y111K104-Y107 HydrophobicContact CB-CD2 4.23Å; K104-Y107 WeakPolarHBondContact O-CB 3.45Å; K104-Y107 PolarHBondContact O-N 3.39Å; Y107-I109 PolarHBondContact O-N 3.32Å; Y107-M110 PolarHBondContact O-N 3.19Å; Y107-Y111 VanDerWaalsContact O-CB 3.28Å; Y107-Y111 WeakPolarHBondContact O-CB 3.15Å; Y107-Y111 PolarHBondContact O-N 2.86Å
108N85.1Confident83Confident20 Ų2069.8 Ų69.811%0.10734%0.342CS..Hα-helixtrans-56.5-45.8177.364.5-13.3000113.3S102 K104 Y105 P106 L112 V231S102-N108 WeakPolarHBondContact O-CB 3.44Å; K104-N108 PolarHBondContact O-N 3.35Å; Y105-N108 WeakPolarHBondContact CA-OD1 3.46Å; P106-N108 PolarHBondContact O-N 2.82Å; N108-L112 WeakPolarHBondContact O-CB 3.37Å; N108-L112 PolarHBondContact O-N 2.98Å; N108-V231 HydrophobicContact CB-CB 4.18Å; N108-V231 HydrophobicContact CB-CG1 3.95Å; N108-V231 HydrophobicContact CB-CG2 4.3Å
109I85.8Confident83.3Confident73 Ų7366.5 Ų66.537%0.37432%0.323SS..Hα-helixtrans-72.1-44.3179.3-59.4-53.6000110.7Y105 P106 Y107 Y111 L112 I113 V231Y105-I109 HydrophobicContact CD2-CG1 4.34Å; Y105-I109 HydrophobicContact CE2-CG1 4.25Å; P106-I109 PolarHBondContact O-N 3.24Å; Y107-I109 PolarHBondContact O-N 3.32Å; I109-Y111 VanDerWaalsContact C-N 3.26Å; I109-Y111 PolarHBondContact O-N 3.45Å; I109-L112 PolarHBondContact O-N 3.21Å; I109-I113 HydrophobicContact CG2-CD1 3.93Å; I109-I113 HydrophobicContact CG2-CG1 4.46Å; I109-I113 WeakPolarHBondContact O-CG1 3.49Å; I109-I113 PolarHBondContact O-N 2.92Å; I109-V231 HydrophobicContact CD1-CG2 4.12Å
110M86.8Confident84.1Confident126 Ų12664.7 Ų64.762%0.62131%0.311SS*.Hα-helixtrans-58.1-43.2177.6-69.3-17572.800111.3P106 Y107 I113 L114P106-M110 PolarHBondContact O-N 3.05Å; Y107-M110 PolarHBondContact O-N 3.19Å; M110-I113 PolarHBondContact O-N 3.04Å; M110-L114 WeakPolarHBondContact O-CB 3.28Å; M110-L114 PolarHBondContact O-N 3.45Å
111Y85.9Confident84.6Confident31 Ų3165.6 Ų65.612%0.12231%0.306CS..Hα-helixtrans-67.3-40.9178.4-153.4-69000111.7L91 I94 W95 Y107 I109 I113 L114 M115L91-Y111 VanDerWaalsContact C-OH 3.3Å; L91-Y111 WeakPolarHBondContact CA-OH 3.21Å; L91-Y111 HydrophobicContact CB-CE1 4.13Å; L91-Y111 HydrophobicContact CD2-CE1 4.04Å; L91-Y111 HydrophobicContact CD2-CE2 4.05Å; L91-Y111 WeakPolarHBondContact CD2-OH 3.16Å; L91-Y111 PolarHBondContact O-OH 2.92Å; I94-Y111 WeakPolarHBondContact CB-OH 3.34Å; I94-Y111 HydrophobicContact CG2-CE2 3.97Å; I94-Y111 WeakPolarHBondContact CG2-OH 3.2Å; W95-Y111 HydrophobicContact CB-CE1 4.41Å; W95-Y111 HydrophobicContact CD2-CD1 4.22Å; W95-Y111 HydrophobicContact CD2-CE1 4.2Å; W95-Y111 AromaticContact CE3-CD1 3.15Å; W95-Y111 HydrophobicContact CE3-CD1 3.15Å; W95-Y111 AromaticContact CE3-CE1 3.3Å; W95-Y111 HydrophobicContact CE3-CE1 3.3Å; W95-Y111 HydrophobicContact CE3-CG 4.23Å; W95-Y111 HydrophobicContact CH2-CD1 4.32Å; W95-Y111 AromaticContact CZ3-CD1 3.24Å; W95-Y111 HydrophobicContact CZ3-CD1 3.24Å; W95-Y111 AromaticContact CZ3-CE1 3.91Å; W95-Y111 HydrophobicContact CZ3-CE1 3.91Å; W95-Y111 HydrophobicContact CZ3-CG 4.13Å; Y107-Y111 VanDerWaalsContact O-CB 3.28Å; Y107-Y111 WeakPolarHBondContact O-CB 3.15Å; Y107-Y111 PolarHBondContact O-N 2.86Å; I109-Y111 VanDerWaalsContact C-N 3.26Å; I109-Y111 PolarHBondContact O-N 3.45Å; Y111-I113 VanDerWaalsContact C-N 3.34Å; Y111-I113 PolarHBondContact O-N 2.84Å; Y111-L114 PolarHBondContact O-N 2.63Å; Y111-M115 HydrophobicContact CD1-CG 3.66Å; Y111-M115 HydrophobicContact CE1-CG 3.61Å; Y111-M115 HydrophobicContact CE1-SD 4.14Å; Y111-M115 WeakPolarHBondContact O-CB 3.38Å; Y111-M115 WeakPolarHBondContact O-CG 3.4Å; Y111-M115 PolarHBondContact O-N 2.68Å
112L88.2Confident85.3Confident20 Ų2062.4 Ų62.411%0.10529%0.29CS..Hα-helixtrans-61-42.4176.2-169.9142.7000112I49 Q53 W95 N108 I109 T116 V231I49-L112 HydrophobicContact CG2-CD1 3.72Å; I49-L112 HydrophobicContact CG2-CD2 4.32Å; Q53-L112 HydrophobicContact CG-CD2 4.07Å; W95-L112 HydrophobicContact CH2-CB 4.08Å; W95-L112 HydrophobicContact CZ3-CB 4.5Å; N108-L112 WeakPolarHBondContact O-CB 3.37Å; N108-L112 PolarHBondContact O-N 2.98Å; I109-L112 PolarHBondContact O-N 3.21Å; L112-T116 WeakPolarHBondContact O-CB 3.31Å; L112-T116 PolarHBondContact O-N 2.68Å; L112-T116 PolarHBondContact O-OG1 3.48Å; L112-V231 HydrophobicContact CB-CG1 4.24Å; L112-V231 HydrophobicContact CD1-CG1 3.7Å
113I89.3Confident86.1Confident102 Ų10262.4 Ų62.452%0.52329%0.29SS..Hα-helixtrans-62.2-47.8174.7-67.9167.2000110.2I109 M110 Y111 M115 T116 L117I109-I113 HydrophobicContact CG2-CD1 3.93Å; I109-I113 HydrophobicContact CG2-CG1 4.46Å; I109-I113 WeakPolarHBondContact O-CG1 3.49Å; I109-I113 PolarHBondContact O-N 2.92Å; M110-I113 PolarHBondContact O-N 3.04Å; Y111-I113 VanDerWaalsContact C-N 3.34Å; Y111-I113 PolarHBondContact O-N 2.84Å; I113-M115 PolarHBondContact O-N 2.63Å; I113-T116 PolarHBondContact O-N 2.84Å; I113-L117 WeakPolarHBondContact O-CB 3.44Å; I113-L117 PolarHBondContact O-N 3.43Å
114L89.5Confident86.5Confident74 Ų7456.8 Ų56.839%0.38727%0.269SS..Hα-helixtrans-60.5-45.5-179.3-162.666.8000111.5L91 M110 Y111 T116 L117 F118L91-L114 HydrophobicContact CD1-CD2 4.22Å; L91-L114 HydrophobicContact CD1-CG 4.14Å; L91-L114 HydrophobicContact CD2-CD2 3.91Å; M110-L114 WeakPolarHBondContact O-CB 3.28Å; M110-L114 PolarHBondContact O-N 3.45Å; Y111-L114 PolarHBondContact O-N 2.63Å; L114-T116 PolarHBondContact O-N 2.67Å; L114-L117 PolarHBondContact O-N 3.04Å; L114-F118 HydrophobicContact CD1-CD2 3.98Å; L114-F118 HydrophobicContact CD1-CE2 3.47Å; L114-F118 VanDerWaalsContact CD1-CE2 3.47Å; L114-F118 HydrophobicContact CD2-CE2 4.43Å; L114-F118 HydrophobicContact CG-CD2 3.84Å; L114-F118 HydrophobicContact CG-CE2 3.72Å; L114-F118 VanDerWaalsContact O-CD2 3.27Å; L114-F118 WeakPolarHBondContact O-CD2 3.37Å; L114-F118 PolarHBondContact O-N 3.2Å
115M88Confident86.7Confident7 Ų750.2 Ų50.23%0.03424%0.241CC..Hα-helixtrans-57.6-48.8174.3-83.7-67.2-80.100111.7Y88 L91 Q92 W95 Y111 I113 L117 F118 S119Y88-M115 HydrophobicContact CD2-CE 4.08Å; Y88-M115 HydrophobicContact CD2-SD 4.04Å; Y88-M115 HydrophobicContact CE2-CE 3.41Å; Y88-M115 VanDerWaalsContact CE2-CE 3.41Å; Y88-M115 HydrophobicContact CE2-SD 3.95Å; L91-M115 HydrophobicContact CB-CG 4.38Å; L91-M115 HydrophobicContact CB-SD 3.28Å; L91-M115 WeakPolarHBondContact CB-SD 3.45Å; L91-M115 HydrophobicContact CD1-SD 4.22Å; L91-M115 HydrophobicContact CG-SD 4.35Å; Q92-M115 HydrophobicContact CB-CE 4.22Å; W95-M115 HydrophobicContact CE3-CG 3.65Å; W95-M115 HydrophobicContact CZ3-CB 4.32Å; W95-M115 HydrophobicContact CZ3-CG 3.71Å; Y111-M115 HydrophobicContact CD1-CG 3.66Å; Y111-M115 HydrophobicContact CE1-CG 3.61Å; Y111-M115 HydrophobicContact CE1-SD 4.14Å; Y111-M115 WeakPolarHBondContact O-CB 3.38Å; Y111-M115 WeakPolarHBondContact O-CG 3.4Å; Y111-M115 PolarHBondContact O-N 2.68Å; I113-M115 PolarHBondContact O-N 2.63Å; M115-L117 VanDerWaalsContact C-N 3.29Å; M115-L117 PolarHBondContact O-N 3.37Å; M115-F118 PolarHBondContact O-N 3.42Å; M115-S119 WeakPolarHBondContact O-CB 3.41Å; M115-S119 PolarHBondContact O-N 3.23Å; M115-S119 PolarHBondContact O-OG 2.89Å
116T91.5Very high86.9Confident6 Ų641.8 Ų41.84%0.03721%0.208CC..Hα-helixtrans-64.2-36.1-178.8-500000111.5Q53 I56 L112 I113 L114 S119 T120Q53-T116 HydrophobicContact CB-CG2 4.22Å; Q53-T116 HydrophobicContact CG-CG2 4.27Å; Q53-T116 PolarHBondContact NE2-OG1 3.49Å; I56-T116 HydrophobicContact CB-CG2 4.09Å; I56-T116 HydrophobicContact CD1-CG2 4.35Å; I56-T116 HydrophobicContact CG2-CG2 3.79Å; L112-T116 WeakPolarHBondContact O-CB 3.31Å; L112-T116 PolarHBondContact O-N 2.68Å; L112-T116 PolarHBondContact O-OG1 3.48Å; I113-T116 PolarHBondContact O-N 2.84Å; L114-T116 PolarHBondContact O-N 2.67Å; T116-S119 VanDerWaalsContact C-OG 3.32Å; T116-S119 VanDerWaalsContact CA-OG 3.31Å; T116-S119 WeakPolarHBondContact CA-OG 3.42Å; T116-S119 PolarHBondContact O-OG 2.96Å; T116-T120 VanDerWaalsContact O-CB 3.26Å; T116-T120 WeakPolarHBondContact O-CB 3.46Å; T116-T120 PolarHBondContact O-N 3.35Å; T116-T120 VanDerWaalsContact O-N 3.09Å; T116-T120 PolarHBondContact O-OG1 2.91Å
117L89.2Confident87Confident91 Ų9139 Ų3948%0.47619%0.191SC..Hα-helixtrans-69.1-51.6178.6-171.5153.5000111I113 L114 M115 T120 L121I113-L117 WeakPolarHBondContact O-CB 3.44Å; I113-L117 PolarHBondContact O-N 3.43Å; L114-L117 PolarHBondContact O-N 3.04Å; M115-L117 VanDerWaalsContact C-N 3.29Å; M115-L117 PolarHBondContact O-N 3.37Å; L117-T120 PolarHBondContact O-N 3.44Å; L117-L121 HydrophobicContact CD2-CD1 3.66Å; L117-L121 HydrophobicContact CD2-CG 4.3Å; L117-L121 WeakPolarHBondContact O-CG 3.37Å; L117-L121 PolarHBondContact O-N 3.01Å
118F89.5Confident86.9Confident45 Ų4532.5 Ų32.520%0.19717%0.165CC..Hα-helixtrans-69.3-34.4-179.3-76.6-67.8000112.9I87 L91 L114 M115 T120 L121 A122I87-F118 HydrophobicContact CB-CD1 4.29Å; I87-F118 HydrophobicContact CB-CE1 4.45Å; I87-F118 HydrophobicContact CD1-CE1 3.98Å; I87-F118 HydrophobicContact CD1-CZ 4.44Å; I87-F118 HydrophobicContact CG2-CB 4.48Å; I87-F118 HydrophobicContact CG2-CD1 3.74Å; I87-F118 HydrophobicContact CG2-CD2 3.78Å; I87-F118 HydrophobicContact CG2-CE1 3.81Å; I87-F118 HydrophobicContact CG2-CE2 3.82Å; I87-F118 HydrophobicContact CG2-CG 3.75Å; I87-F118 HydrophobicContact CG2-CZ 3.85Å; L91-F118 HydrophobicContact CD1-CB 4.39Å; L91-F118 HydrophobicContact CD1-CD2 3.6Å; L91-F118 HydrophobicContact CD1-CE2 4.27Å; L91-F118 HydrophobicContact CD1-CG 4.3Å; L114-F118 HydrophobicContact CD1-CD2 3.98Å; L114-F118 HydrophobicContact CD1-CE2 3.47Å; L114-F118 VanDerWaalsContact CD1-CE2 3.47Å; L114-F118 HydrophobicContact CD2-CE2 4.43Å; L114-F118 HydrophobicContact CG-CD2 3.84Å; L114-F118 HydrophobicContact CG-CE2 3.72Å; L114-F118 VanDerWaalsContact O-CD2 3.27Å; L114-F118 WeakPolarHBondContact O-CD2 3.37Å; L114-F118 PolarHBondContact O-N 3.2Å; M115-F118 PolarHBondContact O-N 3.42Å; F118-T120 VanDerWaalsContact C-N 3.33Å; F118-L121 HydrophobicContact CD1-CD1 4.29Å; F118-L121 PolarHBondContact O-N 3.18Å; F118-A122 WeakPolarHBondContact O-CB 3.43Å; F118-A122 PolarHBondContact O-N 3.46Å
119S87.6Confident86.6Confident0 Ų033.7 Ų33.70%017%0.172CC..Hα-helixtrans-64.4-39.5173.665.40000112M115 T116 A122 I123 Y238 W242M115-S119 WeakPolarHBondContact O-CB 3.41Å; M115-S119 PolarHBondContact O-N 3.23Å; M115-S119 PolarHBondContact O-OG 2.89Å; T116-S119 VanDerWaalsContact C-OG 3.32Å; T116-S119 VanDerWaalsContact CA-OG 3.31Å; T116-S119 WeakPolarHBondContact CA-OG 3.42Å; T116-S119 PolarHBondContact O-OG 2.96Å; S119-A122 PolarHBondContact O-N 2.88Å; S119-I123 WeakPolarHBondContact O-CB 3.37Å; S119-I123 PolarHBondContact O-N 2.97Å; S119-Y238 WeakPolarHBondContact CB-OH 3.27Å; S119-Y238 WeakPolarHBondContact OG-CE1 3.46Å; S119-Y238 PolarHBondContact OG-OH 3.4Å; S119-W242 PolarHBondContact O-NE1 2.89Å
120T90.2Very high86.5Confident11 Ų1130.3 Ų30.37%0.06715%0.154CC..Hα-helixtrans-65.2-43.5175.2-59.50000110.4T116 L117 F118 A124T116-T120 VanDerWaalsContact O-CB 3.26Å; T116-T120 WeakPolarHBondContact O-CB 3.46Å; T116-T120 PolarHBondContact O-N 3.35Å; T116-T120 VanDerWaalsContact O-N 3.09Å; T116-T120 PolarHBondContact O-OG1 2.91Å; L117-T120 PolarHBondContact O-N 3.44Å; F118-T120 VanDerWaalsContact C-N 3.33Å; T120-A124 WeakPolarHBondContact O-CA 3.29Å; T120-A124 WeakPolarHBondContact O-CB 3.3Å; T120-A124 PolarHBondContact O-N 3.29Å
121L87.2Confident86.2Confident55 Ų5527 Ų2729%0.28814%0.136SC..Hα-helixtrans-62.8-42.8175.6-70.9176.8000112.3F64 L117 F118 A124 S125F64-L121 HydrophobicContact CE1-CD2 3.72Å; F64-L121 HydrophobicContact CE2-CD2 4.34Å; F64-L121 HydrophobicContact CZ-CD2 3.39Å; L117-L121 HydrophobicContact CD2-CD1 3.66Å; L117-L121 HydrophobicContact CD2-CG 4.3Å; L117-L121 WeakPolarHBondContact O-CG 3.37Å; L117-L121 PolarHBondContact O-N 3.01Å; F118-L121 HydrophobicContact CD1-CD1 4.29Å; F118-L121 PolarHBondContact O-N 3.18Å; L121-A124 PolarHBondContact O-N 3.37Å; L121-S125 VanDerWaalsContact O-CB 3.25Å; L121-S125 WeakPolarHBondContact O-CB 3.3Å; L121-S125 PolarHBondContact O-N 3.37Å
122A85.6Confident86.1Confident3 Ų329.3 Ų29.33%0.02515%0.148CC..Hα-helixtrans-64-50179.300000111.4F118 S119 S125 D126 W242F118-A122 WeakPolarHBondContact O-CB 3.43Å; F118-A122 PolarHBondContact O-N 3.46Å; S119-A122 PolarHBondContact O-N 2.88Å; A122-S125 PolarHBondContact O-N 3.49Å; A122-D126 PolarHBondContact O-N 3.22Å; A122-W242 HydrophobicContact CB-CZ2 4.26Å
123I88Confident85.9Confident3 Ų330.9 Ų30.92%0.01516%0.164CC..Hα-helixtrans-62.2-46.8175.3-79170.6000110.9T57 T61 S119 S125 D126 A127 W242 F245 L246T57-I123 HydrophobicContact CG2-CD1 3.77Å; T61-I123 HydrophobicContact CG2-CG2 3.94Å; T61-I123 WeakPolarHBondContact OG1-CG2 3.28Å; S119-I123 WeakPolarHBondContact O-CB 3.37Å; S119-I123 PolarHBondContact O-N 2.97Å; I123-S125 VanDerWaalsContact C-N 3.26Å; I123-S125 PolarHBondContact O-N 2.91Å; I123-D126 PolarHBondContact O-N 2.96Å; I123-A127 WeakPolarHBondContact O-CB 3.34Å; I123-A127 PolarHBondContact O-N 2.95Å; I123-W242 HydrophobicContact CD1-CG 3.97Å; I123-W242 VanDerWaalsContact CG1-NE1 3.33Å; I123-F245 HydrophobicContact CD1-CD1 3.78Å; I123-F245 HydrophobicContact CD1-CE1 4.22Å; I123-F245 HydrophobicContact CG1-CD1 4.15Å; I123-F245 HydrophobicContact CG1-CE1 4.28Å; I123-F245 HydrophobicContact CG2-CD1 4.19Å; I123-F245 HydrophobicContact CG2-CE1 3.53Å; I123-F245 HydrophobicContact CG2-CZ 4.4Å; I123-L246 HydrophobicContact CG1-CD1 4.48Å
124A86.2Confident85.7Confident0 Ų026.4 Ų26.40%014%0.141CC..Hα-helixtrans-59.1-43.3-178.100000111F64 T120 L121 A127 T128F64-A124 HydrophobicContact CB-CB 3.71Å; F64-A124 HydrophobicContact CD1-CB 3.73Å; F64-A124 HydrophobicContact CD2-CB 4.31Å; F64-A124 HydrophobicContact CE1-CB 4.44Å; F64-A124 HydrophobicContact CG-CB 3.66Å; T120-A124 WeakPolarHBondContact O-CA 3.29Å; T120-A124 WeakPolarHBondContact O-CB 3.3Å; T120-A124 PolarHBondContact O-N 3.29Å; L121-A124 PolarHBondContact O-N 3.37Å; A124-A127 PolarHBondContact O-N 3.34Å; A124-T128 WeakPolarHBondContact O-CG2 3.46Å; A124-T128 PolarHBondContact O-N 3.43Å; A124-T128 VanDerWaalsContact O-N 3.15Å
125S82.4Confident85.7Confident4 Ų423.1 Ų23.13%0.02812%0.124CC..Hα-helixtrans-61-48.1176.3-170.10000111.7I74 L81 L121 A122 I123 T128I74-S125 WeakPolarHBondContact CG2-OG 3.32Å; L81-S125 WeakPolarHBondContact CA-OG 3.27Å; L81-S125 WeakPolarHBondContact CB-OG 3.43Å; L81-S125 WeakPolarHBondContact CG-OG 3.02Å; L121-S125 VanDerWaalsContact O-CB 3.25Å; L121-S125 WeakPolarHBondContact O-CB 3.3Å; L121-S125 PolarHBondContact O-N 3.37Å; A122-S125 PolarHBondContact O-N 3.49Å; I123-S125 VanDerWaalsContact C-N 3.26Å; I123-S125 PolarHBondContact O-N 2.91Å; S125-T128 PolarHBondContact O-N 3Å; S125-T128 PolarHBondContact O-OG1 3.37Å
126D82.2Confident85.7Confident8 Ų825.8 Ų25.84%0.04314%0.138CC..Hα-helixtrans-64.8-43.3178.2-164.655.7000111.5A122 I123 T128 L129 Y130 W250A122-D126 PolarHBondContact O-N 3.22Å; I123-D126 PolarHBondContact O-N 2.96Å; D126-T128 PolarHBondContact O-N 3.44Å; D126-T128 VanDerWaalsContact O-N 3.15Å; D126-L129 VanDerWaalsContact O-CB 3.23Å; D126-L129 WeakPolarHBondContact O-CB 3.38Å; D126-L129 WeakPolarHBondContact O-CG 3.48Å; D126-L129 PolarHBondContact O-N 3.07Å; D126-Y130 VanDerWaalsContact O-CD2 3.29Å; D126-Y130 WeakPolarHBondContact O-CD2 3.49Å; D126-W250 PolarHBondContact OD2-NE1 2.84Å
127A84.8Confident85.6Confident0 Ų028.3 Ų28.30%015%0.154CC..Hα-helixtrans-62-25179.700000113.3T61 I65 I123 A124 L129 Y130 V135 M249T61-A127 HydrophobicContact CG2-CB 3.75Å; I65-A127 HydrophobicContact CD1-CB 4.06Å; I123-A127 WeakPolarHBondContact O-CB 3.34Å; I123-A127 PolarHBondContact O-N 2.95Å; A124-A127 PolarHBondContact O-N 3.34Å; A127-L129 PolarHBondContact O-N 2.79Å; A127-Y130 PolarHBondContact O-N 2.8Å; A127-V135 HydrophobicContact CB-CG1 4.14Å; A127-V135 HydrophobicContact CB-CG2 3.93Å; A127-M249 HydrophobicContact CB-CE 4.34Å
128T82Confident85.7Confident4 Ų425.5 Ų25.53%0.02514%0.139CC..THydrogen-bonded Turntrans-63.6-20.1174.171.20000113.8A124 S125 D126 Y130A124-T128 WeakPolarHBondContact O-CG2 3.46Å; A124-T128 PolarHBondContact O-N 3.43Å; A124-T128 VanDerWaalsContact O-N 3.15Å; S125-T128 PolarHBondContact O-N 3Å; S125-T128 PolarHBondContact O-OG1 3.37Å; D126-T128 PolarHBondContact O-N 3.44Å; D126-T128 VanDerWaalsContact O-N 3.15Å; T128-Y130 VanDerWaalsContact C-N 3.29Å
129L79.4Confident85.7Confident45 Ų4524.8 Ų24.824%0.23614%0.135CC..THydrogen-bonded Turntrans-75.5-19175.5-56.4177.7000112.2L81 D126 A127 Y185 K258L81-L129 HydrophobicContact CD1-CD1 4.33Å; D126-L129 VanDerWaalsContact O-CB 3.23Å; D126-L129 WeakPolarHBondContact O-CB 3.38Å; D126-L129 WeakPolarHBondContact O-CG 3.48Å; D126-L129 PolarHBondContact O-N 3.07Å; A127-L129 PolarHBondContact O-N 2.79Å; L129-Y185 HydrophobicContact CD1-CE1 4.4Å; L129-K258 PolarHBondContact O-N 2.94Å
130Y82.4Confident85.9Confident1 Ų126.4 Ų26.40%0.00415%0.152CC..BIsolated β-bridgetrans-106.6161.6-173.9-61.8-102.5000112.4D126 A127 T128 M249 S253 G256 L257 K258D126-Y130 VanDerWaalsContact O-CD2 3.29Å; D126-Y130 WeakPolarHBondContact O-CD2 3.49Å; A127-Y130 PolarHBondContact O-N 2.8Å; T128-Y130 VanDerWaalsContact C-N 3.29Å; Y130-M249 HydrophobicContact CD1-CE 3.9Å; Y130-M249 HydrophobicContact CD2-CE 3.2Å; Y130-M249 HydrophobicContact CE1-CE 4.17Å; Y130-M249 WeakPolarHBondContact CE1-O 3.41Å; Y130-M249 HydrophobicContact CE2-CE 3.56Å; Y130-M249 HydrophobicContact CG-CE 3.39Å; Y130-M249 PolarHBondContact OH-O 2.78Å; Y130-S253 PolarHBondContact OH-OG 3.1Å; Y130-G256 VanDerWaalsContact CA-O 3.32Å; Y130-G256 WeakPolarHBondContact CA-O 3.3Å; Y130-L257 HydrophobicContact CD1-CD1 4.06Å; Y130-L257 HydrophobicContact CE1-CD1 3.6Å; Y130-K258 VanDerWaalsContact O-CD 3.3Å; Y130-K258 WeakPolarHBondContact O-CD 3.46Å; Y130-K258 WeakPolarHBondContact O-CE 3.37Å; Y130-K258 PolarHBondContact O-NZ 3.19Å
131F80.8Confident86.1Confident57 Ų5728.3 Ų28.325%0.2516%0.164CC..  trans-66.7140.2167.6-68.2-75.5000111.9A133 I134 V135 G256 K258 V270F131-A133 VanDerWaalsContact C-N 3.26Å; F131-A133 PolarHBondContact O-N 3.05Å; F131-I134 HydrophobicContact CB-CD1 4.08Å; F131-I134 HydrophobicContact CB-CG1 4.25Å; F131-I134 HydrophobicContact CD2-CD1 4.27Å; F131-I134 WeakPolarHBondContact O-CB 3.43Å; F131-I134 PolarHBondContact O-N 2.8Å; F131-V135 PolarHBondContact O-N 3.08Å; F131-V135 VanDerWaalsContact O-N 3.11Å; F131-G256 VanDerWaalsContact CD2-O 3.28Å; F131-G256 WeakPolarHBondContact CD2-O 3.32Å; F131-G256 PolarHBondContact N-O 2.95Å; F131-G256 VanDerWaalsContact N-O 3.1Å; F131-K258 HydrophobicContact CD1-CG 3.76Å; F131-K258 HydrophobicContact CD2-CG 4.25Å; F131-K258 HydrophobicContact CE1-CG 3.72Å; F131-K258 HydrophobicContact CE2-CG 4.2Å; F131-K258 HydrophobicContact CG-CG 4.03Å; F131-K258 HydrophobicContact CZ-CB 4.47Å; F131-K258 HydrophobicContact CZ-CG 3.95Å; F131-V270 HydrophobicContact CD2-CG1 4.44Å; F131-V270 HydrophobicContact CD2-CG2 3.97Å; F131-V270 HydrophobicContact CE2-CG2 3.91Å; F131-V270 HydrophobicContact CG-CG2 4.37Å; F131-V270 HydrophobicContact CZ-CG2 4.26Å
132E83.7Confident86.3Confident80 Ų8025.7 Ų25.737%0.37415%0.15SC..Hα-helixtrans-59.6-39-175.6-41-175.1173.700111.6I65 I134 V135 N136I65-E132 HydrophobicContact CG2-CB 3.96Å; I65-E132 HydrophobicContact CG2-CG 3.4Å; E132-I134 PolarHBondContact O-N 2.8Å; E132-V135 PolarHBondContact O-N 3.06Å; E132-N136 PolarHBondContact O-N 2.84Å
133A84.3Confident86.6Confident53 Ų5327.5 Ų27.544%0.43816%0.161SC..Hα-helixtrans-58.4-37.9175.200000112F131 V137F131-A133 VanDerWaalsContact C-N 3.26Å; F131-A133 PolarHBondContact O-N 3.05Å; A133-V137 WeakPolarHBondContact O-CB 3.31Å; A133-V137 WeakPolarHBondContact O-CG2 3.31Å; A133-V137 PolarHBondContact O-N 3.08Å
134I86Confident86.8Confident7 Ų731.5 Ų31.54%0.03619%0.185CC..Hα-helixtrans-75.4-42.6-177.9-63174.9000110.1F131 E132 N136 V137 M138 V270 V274F131-I134 HydrophobicContact CB-CD1 4.08Å; F131-I134 HydrophobicContact CB-CG1 4.25Å; F131-I134 HydrophobicContact CD2-CD1 4.27Å; F131-I134 WeakPolarHBondContact O-CB 3.43Å; F131-I134 PolarHBondContact O-N 2.8Å; E132-I134 PolarHBondContact O-N 2.8Å; I134-N136 VanDerWaalsContact C-N 3.3Å; I134-N136 PolarHBondContact O-N 2.97Å; I134-V137 PolarHBondContact O-N 3.45Å; I134-M138 HydrophobicContact CG2-CG 4.15Å; I134-M138 WeakPolarHBondContact O-CB 3.3Å; I134-M138 VanDerWaalsContact O-CG 3.29Å; I134-M138 WeakPolarHBondContact O-CG 3.41Å; I134-M138 PolarHBondContact O-N 3.34Å; I134-V270 HydrophobicContact CD1-CG1 3.99Å; I134-V270 HydrophobicContact CG1-CG1 4.25Å; I134-V274 HydrophobicContact CG1-CG2 4.47Å
135V88.3Confident87.1Confident5 Ų534.1 Ų34.13%0.0320%0.199CC..Hα-helixtrans-56.3-46.9174.5-179.50000110.6T61 I65 A127 F131 E132 M138 F139 F245 M249T61-V135 HydrophobicContact CG2-CG1 4.15Å; I65-V135 HydrophobicContact CD1-CB 4.1Å; I65-V135 HydrophobicContact CD1-CG1 3.83Å; I65-V135 HydrophobicContact CD1-CG2 3.99Å; A127-V135 HydrophobicContact CB-CG1 4.14Å; A127-V135 HydrophobicContact CB-CG2 3.93Å; F131-V135 PolarHBondContact O-N 3.08Å; F131-V135 VanDerWaalsContact O-N 3.11Å; E132-V135 PolarHBondContact O-N 3.06Å; V135-M138 PolarHBondContact O-N 3.03Å; V135-F139 WeakPolarHBondContact O-CB 3.39Å; V135-F139 PolarHBondContact O-N 2.86Å; V135-F245 HydrophobicContact CG1-CZ 4.27Å; V135-M249 HydrophobicContact CG2-CE 3.82Å; V135-M249 HydrophobicContact CG2-SD 4.26Å
136N88.1Confident87.6Confident63 Ų6334.1 Ų34.134%0.33720%0.199SC..Hα-helixtrans-64.4-42.4179.3-72.1-14000112.5E132 I134 F139 G140E132-N136 PolarHBondContact O-N 2.84Å; I134-N136 VanDerWaalsContact C-N 3.3Å; I134-N136 PolarHBondContact O-N 2.97Å; N136-F139 PolarHBondContact O-N 2.92Å; N136-G140 PolarHBondContact O-N 3.3Å
137V89.3Confident88Confident59 Ų5937.8 Ų37.836%0.35822%0.218SC..Hα-helixtrans-64.5-46.1176.6171.40000110.6A133 I134 F139 G140 V141 V274A133-V137 WeakPolarHBondContact O-CB 3.31Å; A133-V137 WeakPolarHBondContact O-CG2 3.31Å; A133-V137 PolarHBondContact O-N 3.08Å; I134-V137 PolarHBondContact O-N 3.45Å; V137-F139 VanDerWaalsContact C-N 3.3Å; V137-F139 PolarHBondContact O-N 3.41Å; V137-G140 PolarHBondContact O-N 2.8Å; V137-G140 VanDerWaalsContact O-N 3.17Å; V137-V141 HydrophobicContact CG1-CG2 4.35Å; V137-V141 WeakPolarHBondContact O-CG2 3.47Å; V137-V141 PolarHBondContact O-N 3.43Å; V137-V274 HydrophobicContact CG2-CG1 4.47Å
138M90.9Very high88.3Confident33 Ų3342.7 Ų42.716%0.16324%0.244CC..Hα-helixtrans-65.8-34.2179.3-68.7-55.1135.300112.3I134 V135 V141 S142 F245 L248 M249 S252I134-M138 HydrophobicContact CG2-CG 4.15Å; I134-M138 WeakPolarHBondContact O-CB 3.3Å; I134-M138 VanDerWaalsContact O-CG 3.29Å; I134-M138 WeakPolarHBondContact O-CG 3.41Å; I134-M138 PolarHBondContact O-N 3.34Å; V135-M138 PolarHBondContact O-N 3.03Å; M138-V141 PolarHBondContact O-N 3.36Å; M138-S142 WeakPolarHBondContact O-CB 3.04Å; M138-S142 PolarHBondContact O-N 3.35Å; M138-F245 HydrophobicContact CB-CE2 4.24Å; M138-L248 HydrophobicContact SD-CB 4.08Å; M138-M249 HydrophobicContact CB-CG 4.41Å; M138-M249 HydrophobicContact CB-SD 3.91Å; M138-M249 HydrophobicContact CG-SD 4.14Å; M138-S252 WeakPolarHBondContact CE-OG 3.37Å; M138-S252 PolarHBondContact SD-OG 2.99Å
139F91.3Very high88.7Confident29 Ų2943.1 Ų43.113%0.12725%0.246CC..Hα-helixtrans-62.9-48.7172.6-167.4-85.6000110.1F58 V135 N136 V137 V141 S142 V143 W241 F245F58-F139 HydrophobicContact CB-CD2 4.44Å; F58-F139 HydrophobicContact CB-CE1 4.02Å; F58-F139 HydrophobicContact CB-CE2 3.64Å; F58-F139 HydrophobicContact CB-CZ 3.45Å; F58-F139 VanDerWaalsContact CB-CZ 3.45Å; F58-F139 HydrophobicContact CD2-CB 4.34Å; F58-F139 AromaticContact CD2-CD1 3.48Å; F58-F139 HydrophobicContact CD2-CD1 3.48Å; F58-F139 VanDerWaalsContact CD2-CD1 3.48Å; F58-F139 AromaticContact CD2-CD2 3.61Å; F58-F139 HydrophobicContact CD2-CD2 3.61Å; F58-F139 AromaticContact CD2-CE1 3.59Å; F58-F139 HydrophobicContact CD2-CE1 3.59Å; F58-F139 AromaticContact CD2-CE2 3.66Å; F58-F139 HydrophobicContact CD2-CE2 3.66Å; F58-F139 AromaticContact CD2-CG 3.52Å; F58-F139 HydrophobicContact CD2-CG 3.52Å; F58-F139 AromaticContact CD2-CZ 3.71Å; F58-F139 HydrophobicContact CD2-CZ 3.71Å; F58-F139 HydrophobicContact CE2-CB 4.33Å; F58-F139 AromaticContact CE2-CD1 3.82Å; F58-F139 HydrophobicContact CE2-CD1 3.82Å; F58-F139 HydrophobicContact CE2-CD2 4.41Å; F58-F139 HydrophobicContact CE2-CE1 4.28Å; F58-F139 AromaticContact CE2-CG 3.92Å; F58-F139 HydrophobicContact CE2-CG 3.92Å; F58-F139 HydrophobicContact CG-CD1 4.24Å; F58-F139 HydrophobicContact CG-CD2 4.46Å; F58-F139 AromaticContact CG-CE1 3.88Å; F58-F139 HydrophobicContact CG-CE1 3.88Å; F58-F139 HydrophobicContact CG-CE2 4.06Å; F58-F139 AromaticContact CG-CZ 3.82Å; F58-F139 HydrophobicContact CG-CZ 3.82Å; V135-F139 WeakPolarHBondContact O-CB 3.39Å; V135-F139 PolarHBondContact O-N 2.86Å; N136-F139 PolarHBondContact O-N 2.92Å; V137-F139 VanDerWaalsContact C-N 3.3Å; V137-F139 PolarHBondContact O-N 3.41Å; F139-V141 PolarHBondContact O-N 3.39Å; F139-S142 PolarHBondContact O-N 2.94Å; F139-S142 PolarHBondContact O-OG 3.43Å; F139-V143 HydrophobicContact CD1-CG2 4.08Å; F139-V143 HydrophobicContact CE1-CG2 3.67Å; F139-V143 HydrophobicContact CZ-CG2 4.21Å; F139-V143 WeakPolarHBondContact O-CG2 3.07Å; F139-V143 PolarHBondContact O-N 3.28Å; F139-V143 VanDerWaalsContact O-N 3.08Å; F139-W241 HydrophobicContact CD2-CH2 4.26Å; F139-W241 AromaticContact CD2-CZ2 3.85Å; F139-W241 HydrophobicContact CD2-CZ2 3.85Å; F139-W241 AromaticContact CE2-CH2 3.51Å; F139-W241 HydrophobicContact CE2-CH2 3.51Å; F139-W241 AromaticContact CE2-CZ2 3.26Å; F139-W241 HydrophobicContact CE2-CZ2 3.26Å; F139-W241 HydrophobicContact CZ-CH2 4.19Å; F139-W241 AromaticContact CZ-CZ2 3.75Å; F139-W241 HydrophobicContact CZ-CZ2 3.75Å; F139-F245 HydrophobicContact CB-CD2 4.44Å; F139-F245 HydrophobicContact CB-CE2 3.83Å; F139-F245 HydrophobicContact CD2-CD2 4.21Å; F139-F245 AromaticContact CD2-CE2 3.94Å; F139-F245 HydrophobicContact CD2-CE2 3.94Å; F139-F245 HydrophobicContact CG-CE2 4.36Å
140G92.1Very high89.1Confident34 Ų3442 Ų4235%0.35124%0.24SC..Hα-helixtrans-55.6-46.6173.900000112.9N136 V137 S142 V143 T144N136-G140 PolarHBondContact O-N 3.3Å; V137-G140 PolarHBondContact O-N 2.8Å; V137-G140 VanDerWaalsContact O-N 3.17Å; G140-S142 PolarHBondContact O-N 2.97Å; G140-V143 PolarHBondContact O-N 2.74Å; G140-T144 WeakPolarHBondContact O-CG2 3.29Å; G140-T144 PolarHBondContact O-N 3.31Å; G140-T144 PolarHBondContact O-OG1 3.04Å
141V92.6Very high89.3Confident52 Ų5245.7 Ų45.732%0.31527%0.266SS..Hα-helixtrans-63.2-40.5177.4174.30000111.8V137 M138 F139 V143 T144 L145 L248V137-V141 HydrophobicContact CG1-CG2 4.35Å; V137-V141 WeakPolarHBondContact O-CG2 3.47Å; V137-V141 PolarHBondContact O-N 3.43Å; M138-V141 PolarHBondContact O-N 3.36Å; F139-V141 PolarHBondContact O-N 3.39Å; V141-V143 PolarHBondContact O-N 2.8Å; V141-T144 WeakPolarHBondContact CA-OG1 3.34Å; V141-T144 PolarHBondContact O-N 3.07Å; V141-T144 PolarHBondContact O-OG1 3.45Å; V141-L145 HydrophobicContact CG1-CD1 3.87Å; V141-L145 HydrophobicContact CG1-CG 4.31Å; V141-L145 WeakPolarHBondContact O-CB 3.44Å; V141-L145 WeakPolarHBondContact O-CG 3.47Å; V141-L145 PolarHBondContact O-N 3.15Å; V141-L248 HydrophobicContact CG1-CD1 4.07Å; V141-L248 HydrophobicContact CG1-CD2 4.27Å
142S92.7Very high89.5Confident0 Ų046 Ų460%027%0.272CS..Hα-helixtrans-64.1-41178.9750000112.2M138 F139 G140 F146 W241M138-S142 WeakPolarHBondContact O-CB 3.04Å; M138-S142 PolarHBondContact O-N 3.35Å; F139-S142 PolarHBondContact O-N 2.94Å; F139-S142 PolarHBondContact O-OG 3.43Å; G140-S142 PolarHBondContact O-N 2.97Å; S142-F146 VanDerWaalsContact O-CB 3.27Å; S142-F146 WeakPolarHBondContact O-CB 3.44Å; S142-F146 PolarHBondContact O-N 3.09Å; S142-W241 PolarHBondContact OG-NE1 2.98Å
143V92.4Very high89.6Confident40 Ų4042.6 Ų42.624%0.24226%0.257CS..Hα-helixtrans-70.9-40.91791740000110.8F139 G140 V141 F146 N147F139-V143 HydrophobicContact CD1-CG2 4.08Å; F139-V143 HydrophobicContact CE1-CG2 3.67Å; F139-V143 HydrophobicContact CZ-CG2 4.21Å; F139-V143 WeakPolarHBondContact O-CG2 3.07Å; F139-V143 PolarHBondContact O-N 3.28Å; F139-V143 VanDerWaalsContact O-N 3.08Å; G140-V143 PolarHBondContact O-N 2.74Å; V141-V143 PolarHBondContact O-N 2.8Å; V143-F146 PolarHBondContact O-N 3.27Å; V143-N147 WeakPolarHBondContact O-CB 3.33Å; V143-N147 PolarHBondContact O-N 2.96Å; V143-N147 PolarHBondContact O-ND2 3.08Å
144T92Very high89.3Confident88 Ų8843.8 Ų43.854%0.5426%0.261SS..Hα-helixtrans-66-41.5176.456.10000111.8G140 V141 N147 L148G140-T144 WeakPolarHBondContact O-CG2 3.29Å; G140-T144 PolarHBondContact O-N 3.31Å; G140-T144 PolarHBondContact O-OG1 3.04Å; V141-T144 WeakPolarHBondContact CA-OG1 3.34Å; V141-T144 PolarHBondContact O-N 3.07Å; V141-T144 PolarHBondContact O-OG1 3.45Å; T144-N147 PolarHBondContact O-N 3.22Å; T144-L148 VanDerWaalsContact O-CB 3.3Å; T144-L148 WeakPolarHBondContact O-CB 3.47Å; T144-L148 PolarHBondContact O-N 2.95Å
145L92.1Very high89.1Confident54 Ų5449.3 Ų49.328%0.28330%0.295SS..Hα-helixtrans-64-41.5174-76.6174.4000112.2V141 L148 V149 L244 L248V141-L145 HydrophobicContact CG1-CD1 3.87Å; V141-L145 HydrophobicContact CG1-CG 4.31Å; V141-L145 WeakPolarHBondContact O-CB 3.44Å; V141-L145 WeakPolarHBondContact O-CG 3.47Å; V141-L145 PolarHBondContact O-N 3.15Å; L145-L148 HydrophobicContact CD2-CD2 4.36Å; L145-L148 WeakPolarHBondContact O-CB 3.37Å; L145-L148 PolarHBondContact O-N 3.27Å; L145-V149 WeakPolarHBondContact O-CG2 3.45Å; L145-V149 PolarHBondContact O-N 3.3Å; L145-L244 HydrophobicContact CB-CD2 4.07Å; L145-L248 HydrophobicContact CD1-CD1 4.12Å; L145-L248 HydrophobicContact CD1-CD2 4.26Å
146F92.5Very high88.5Confident5 Ų552.7 Ų52.72%0.02231%0.313CS..Hα-helixtrans-61-46.7176.2-176.4-93.8000111.9T50 F54 S142 V143 V149 I150 L210 L237 W241T50-F146 HydrophobicContact CG2-CZ 4.24Å; F54-F146 AromaticContact CE2-CD1 3.95Å; F54-F146 HydrophobicContact CE2-CD1 3.95Å; F54-F146 AromaticContact CE2-CE1 3.83Å; F54-F146 HydrophobicContact CE2-CE1 3.83Å; F54-F146 HydrophobicContact CE2-CE2 4.44Å; F54-F146 HydrophobicContact CE2-CG 4.3Å; F54-F146 HydrophobicContact CE2-CZ 4.1Å; F54-F146 HydrophobicContact CZ-CD1 4.42Å; F54-F146 HydrophobicContact CZ-CD2 4.28Å; F54-F146 HydrophobicContact CZ-CE1 4.11Å; F54-F146 AromaticContact CZ-CE2 3.97Å; F54-F146 HydrophobicContact CZ-CE2 3.97Å; F54-F146 HydrophobicContact CZ-CG 4.48Å; F54-F146 AromaticContact CZ-CZ 3.89Å; F54-F146 HydrophobicContact CZ-CZ 3.89Å; S142-F146 VanDerWaalsContact O-CB 3.27Å; S142-F146 WeakPolarHBondContact O-CB 3.44Å; S142-F146 PolarHBondContact O-N 3.09Å; V143-F146 PolarHBondContact O-N 3.27Å; F146-V149 PolarHBondContact O-N 3.08Å; F146-I150 HydrophobicContact CD1-CD1 3.71Å; F146-I150 HydrophobicContact CE1-CD1 3.33Å; F146-I150 HydrophobicContact CE1-CG1 4.39Å; F146-I150 HydrophobicContact CZ-CD1 4.03Å; F146-I150 WeakPolarHBondContact O-CG1 3.46Å; F146-I150 PolarHBondContact O-N 3.19Å; F146-L210 HydrophobicContact CD2-CD1 3.58Å; F146-L210 HydrophobicContact CD2-CD2 3.78Å; F146-L210 HydrophobicContact CD2-CG 4.31Å; F146-L210 HydrophobicContact CE2-CD1 3.49Å; F146-L210 VanDerWaalsContact CE2-CD1 3.49Å; F146-L237 HydrophobicContact CE2-CD1 3.71Å; F146-L237 HydrophobicContact CE2-CD2 4.47Å; F146-L237 HydrophobicContact CE2-CG 3.85Å; F146-L237 HydrophobicContact CZ-CD1 3.84Å; F146-L237 HydrophobicContact CZ-CD2 3.79Å; F146-L237 HydrophobicContact CZ-CG 3.64Å; F146-W241 HydrophobicContact CD2-CB 4Å; F146-W241 HydrophobicContact CE2-CB 4.14Å
147N90.7Very high87.5Confident84 Ų8458.4 Ų58.445%0.44934%0.337SS..Hα-helixtrans-63.9-40.5174.9-75.5-30.6000112.2V143 T144 V149 I150 C151V143-N147 WeakPolarHBondContact O-CB 3.33Å; V143-N147 PolarHBondContact O-N 2.96Å; V143-N147 PolarHBondContact O-ND2 3.08Å; T144-N147 PolarHBondContact O-N 3.22Å; N147-V149 VanDerWaalsContact C-N 3.29Å; N147-V149 PolarHBondContact O-N 3.49Å; N147-I150 PolarHBondContact O-N 2.7Å; N147-C151 PolarHBondContact O-N 3.41Å; N147-C151 PolarHBondContact O-SG 3.39Å; N147-C151 VanDerWaalsContact O-SG 3.39Å
148L91.2Very high86.5Confident103 Ų10361.4 Ų61.454%0.53935%0.346SS..Hα-helixtrans-59.6-41.5175.9-177.870.4000111.4T144 L145 C151 T152T144-L148 VanDerWaalsContact O-CB 3.3Å; T144-L148 WeakPolarHBondContact O-CB 3.47Å; T144-L148 PolarHBondContact O-N 2.95Å; L145-L148 HydrophobicContact CD2-CD2 4.36Å; L145-L148 WeakPolarHBondContact O-CB 3.37Å; L145-L148 PolarHBondContact O-N 3.27Å; L148-C151 PolarHBondContact O-N 3.41Å; L148-T152 WeakPolarHBondContact O-CB 3.34Å; L148-T152 PolarHBondContact O-N 3.45Å; L148-T152 PolarHBondContact O-OG1 3.38Å
149V89.9Confident85.1Confident13 Ų1362.5 Ų62.58%0.07935%0.352CS..Hα-helixtrans-64.6-42.9175.9168.20000111.4L145 F146 N147 C151 T152 I153 L210 L211 V214L145-V149 WeakPolarHBondContact O-CG2 3.45Å; L145-V149 PolarHBondContact O-N 3.3Å; F146-V149 PolarHBondContact O-N 3.08Å; N147-V149 VanDerWaalsContact C-N 3.29Å; N147-V149 PolarHBondContact O-N 3.49Å; V149-C151 PolarHBondContact O-N 2.81Å; V149-T152 PolarHBondContact O-N 3.2Å; V149-I153 HydrophobicContact CG1-CD1 3.99Å; V149-I153 PolarHBondContact O-N 3.04Å; V149-L210 HydrophobicContact CB-CD2 4.02Å; V149-L210 HydrophobicContact CB-CG 4.37Å; V149-L210 HydrophobicContact CG1-CD2 4.07Å; V149-L210 HydrophobicContact CG1-CG 3.85Å; V149-L210 HydrophobicContact CG2-CD2 4.01Å; V149-L211 HydrophobicContact CG1-CD2 3.71Å; V149-L211 HydrophobicContact CG1-CG 3.95Å; V149-L211 HydrophobicContact CG2-CD2 4.45Å; V149-L211 HydrophobicContact CG2-CG 4.5Å; V149-V214 HydrophobicContact CG1-CG2 4.36Å
150I87.7Confident83.8Confident22 Ų2264.8 Ų64.811%0.11336%0.362CS..Hα-helixtrans-59.6-47.4174.2-69.8170.4000111.1L47 F146 N147 T152 I153 S154 V214 F218L47-I150 HydrophobicContact CD2-CD1 3.85Å; F146-I150 HydrophobicContact CD1-CD1 3.71Å; F146-I150 HydrophobicContact CE1-CD1 3.33Å; F146-I150 HydrophobicContact CE1-CG1 4.39Å; F146-I150 HydrophobicContact CZ-CD1 4.03Å; F146-I150 WeakPolarHBondContact O-CG1 3.46Å; F146-I150 PolarHBondContact O-N 3.19Å; N147-I150 PolarHBondContact O-N 2.7Å; I150-T152 VanDerWaalsContact C-N 3.33Å; I150-T152 PolarHBondContact O-N 3.17Å; I150-I153 PolarHBondContact O-N 3.01Å; I150-S154 WeakPolarHBondContact O-CB 3.38Å; I150-S154 PolarHBondContact O-N 3.08Å; I150-S154 PolarHBondContact O-OG 3.2Å; I150-V214 HydrophobicContact CG1-CG1 4.01Å; I150-V214 HydrophobicContact CG1-CG2 4.33Å; I150-F218 HydrophobicContact CG2-CE2 3.98Å; I150-F218 HydrophobicContact CG2-CZ 3.62Å
151C87Confident82.4Confident79 Ų7963.1 Ų63.153%0.53435%0.346SS..Hα-helixtrans-59.7-44.1176.6-73.50000111.5N147 L148 V149 I153 S154 V155N147-C151 PolarHBondContact O-N 3.41Å; N147-C151 PolarHBondContact O-SG 3.39Å; N147-C151 VanDerWaalsContact O-SG 3.39Å; L148-C151 PolarHBondContact O-N 3.41Å; V149-C151 PolarHBondContact O-N 2.81Å; C151-I153 PolarHBondContact O-N 2.86Å; C151-S154 PolarHBondContact O-N 3.35Å; C151-V155 WeakPolarHBondContact O-CG2 3.22Å; C151-V155 PolarHBondContact O-N 3.47Å
152T85.8Confident81.2Confident62 Ų6266.9 Ų66.938%0.3836%0.358SS..Hα-helixtrans-61.5-45.1-179.8-57.80000110.9L148 V149 I150 V155 L156L148-T152 WeakPolarHBondContact O-CB 3.34Å; L148-T152 PolarHBondContact O-N 3.45Å; L148-T152 PolarHBondContact O-OG1 3.38Å; V149-T152 PolarHBondContact O-N 3.2Å; I150-T152 VanDerWaalsContact C-N 3.33Å; I150-T152 PolarHBondContact O-N 3.17Å; T152-V155 PolarHBondContact O-N 2.85Å; T152-L156 WeakPolarHBondContact O-CB 3.16Å; T152-L156 PolarHBondContact O-N 2.97Å
153I84Confident80Confident10 Ų1073.6 Ų73.65%0.05138%0.384CS..Hα-helixtrans-70-34.5179.2-74.8165.7000112.7V149 I150 C151 V155 L156 L211 V214 K215V149-I153 HydrophobicContact CG1-CD1 3.99Å; V149-I153 PolarHBondContact O-N 3.04Å; I150-I153 PolarHBondContact O-N 3.01Å; C151-I153 PolarHBondContact O-N 2.86Å; I153-V155 PolarHBondContact O-N 3.13Å; I153-L156 PolarHBondContact O-N 2.95Å; I153-L211 HydrophobicContact CD1-CB 4.37Å; I153-L211 HydrophobicContact CD1-CD2 3.91Å; I153-L211 WeakPolarHBondContact CD1-O 3.33Å; I153-L211 HydrophobicContact CG1-CD2 3.98Å; I153-V214 HydrophobicContact CB-CG1 4.22Å; I153-V214 HydrophobicContact CD1-CB 3.49Å; I153-V214 VanDerWaalsContact CD1-CB 3.49Å; I153-V214 HydrophobicContact CD1-CG1 3.46Å; I153-V214 VanDerWaalsContact CD1-CG1 3.46Å; I153-V214 HydrophobicContact CG1-CG1 4.45Å; I153-V214 HydrophobicContact CG2-CG1 4.23Å; I153-K215 HydrophobicContact CD1-CB 4.39Å; I153-K215 HydrophobicContact CG2-CB 4.36Å; I153-K215 HydrophobicContact CG2-CD 3.78Å
154S79Confident78.9Confident77 Ų7776.5 Ų76.554%0.53839%0.391SS..Hα-helixtrans-61.7-31.3175.8-57.80000111.6I150 C151I150-S154 WeakPolarHBondContact O-CB 3.38Å; I150-S154 PolarHBondContact O-N 3.08Å; I150-S154 PolarHBondContact O-OG 3.2Å; C151-S154 PolarHBondContact O-N 3.35Å
155V81.2Confident78.1Confident123 Ų12377 Ų7775%0.74539%0.394SS*.Hα-helixtrans-89.1-36.3176.5178.90000111.9C151 T152 I153 Q157C151-V155 WeakPolarHBondContact O-CG2 3.22Å; C151-V155 PolarHBondContact O-N 3.47Å; T152-V155 PolarHBondContact O-N 2.85Å; I153-V155 PolarHBondContact O-N 3.13Å; V155-Q157 PolarHBondContact O-N 3.21Å
156L75.9Confident77.4Confident76 Ų7678.9 Ų78.940%0.39840%0.403SS..  trans-84.3111.4-170.4-166.467.4000112.1T152 I153 F158 F160 K215T152-L156 WeakPolarHBondContact O-CB 3.16Å; T152-L156 PolarHBondContact O-N 2.97Å; I153-L156 PolarHBondContact O-N 2.95Å; L156-F158 HydrophobicContact CD2-CB 4.37Å; L156-F158 HydrophobicContact CG-CB 4.06Å; L156-F158 PolarHBondContact O-N 3.46Å; L156-F160 HydrophobicContact CD2-CE2 3.75Å; L156-F160 HydrophobicContact CD2-CZ 4.1Å; L156-K215 PolarHBondContact O-NZ 2.72Å
157Q66.9Low76.7Confident184 Ų18479.2 Ų79.286%0.8641%0.406SS*.  trans-75.6-0.3178.8-63.4-171.4-8.100114.5V155V155-Q157 PolarHBondContact O-N 3.21Å
158F68.2Low76Confident121 Ų12177.8 Ų77.853%0.53140%0.398SS..  trans-72.5135.7-176.6-164-91.5000112.5L156 F160 K215L156-F158 HydrophobicContact CD2-CB 4.37Å; L156-F158 HydrophobicContact CG-CB 4.06Å; L156-F158 PolarHBondContact O-N 3.46Å; F158-F160 HydrophobicContact CB-CE2 4.01Å; F158-F160 HydrophobicContact CB-CZ 4.21Å; F158-F160 AromaticContact CD1-CD1 3.63Å; F158-F160 HydrophobicContact CD1-CD1 3.63Å; F158-F160 AromaticContact CD1-CD2 3.9Å; F158-F160 HydrophobicContact CD1-CD2 3.9Å; F158-F160 AromaticContact CD1-CE1 3.38Å; F158-F160 HydrophobicContact CD1-CE1 3.38Å; F158-F160 AromaticContact CD1-CE2 3.66Å; F158-F160 HydrophobicContact CD1-CE2 3.66Å; F158-F160 AromaticContact CD1-CG 3.88Å; F158-F160 HydrophobicContact CD1-CG 3.88Å; F158-F160 AromaticContact CD1-CZ 3.4Å; F158-F160 HydrophobicContact CD1-CZ 3.4Å; F158-F160 AromaticContact CE1-CD1 3.72Å; F158-F160 HydrophobicContact CE1-CD1 3.72Å; F158-F160 AromaticContact CE1-CE1 3.58Å; F158-F160 HydrophobicContact CE1-CE1 3.58Å; F158-F160 HydrophobicContact CE1-CG 4.32Å; F158-F160 HydrophobicContact CE1-CZ 4.08Å; F158-F160 HydrophobicContact CG-CE1 4.43Å; F158-F160 HydrophobicContact CG-CE2 4.27Å; F158-F160 HydrophobicContact CG-CZ 4.1Å; F158-F160 PolarHBondContact O-N 2.93Å; F158-K215 VanDerWaalsContact O-CE 3.27Å; F158-K215 WeakPolarHBondContact O-CE 3.46Å; F158-K215 PolarHBondContact O-NZ 3.43Å
159D62.9Low75.7Confident57 Ų5779.9 Ų79.931%0.30540%0.403SS..  trans-95.689.6-178.6-84.7-18.2000112.4T161 G220 G221D159-T161 VanDerWaalsContact C-N 3.27Å; D159-T161 PolarHBondContact O-N 3.43Å; D159-G220 VanDerWaalsContact OD1-C 3.32Å; D159-G221 VanDerWaalsContact OD1-CA 3.22Å; D159-G221 WeakPolarHBondContact OD1-CA 3.4Å; D159-G221 PolarHBondContact OD1-N 2.98Å
160F63.4Low75.3Confident76 Ų7680.7 Ų80.733%0.33341%0.408SS..G310 helixtrans-73.3-16.9173.5-62.2-77.2000113.8L156 F158 K162 Y163 Y212L156-F160 HydrophobicContact CD2-CE2 3.75Å; L156-F160 HydrophobicContact CD2-CZ 4.1Å; F158-F160 HydrophobicContact CB-CE2 4.01Å; F158-F160 HydrophobicContact CB-CZ 4.21Å; F158-F160 AromaticContact CD1-CD1 3.63Å; F158-F160 HydrophobicContact CD1-CD1 3.63Å; F158-F160 AromaticContact CD1-CD2 3.9Å; F158-F160 HydrophobicContact CD1-CD2 3.9Å; F158-F160 AromaticContact CD1-CE1 3.38Å; F158-F160 HydrophobicContact CD1-CE1 3.38Å; F158-F160 AromaticContact CD1-CE2 3.66Å; F158-F160 HydrophobicContact CD1-CE2 3.66Å; F158-F160 AromaticContact CD1-CG 3.88Å; F158-F160 HydrophobicContact CD1-CG 3.88Å; F158-F160 AromaticContact CD1-CZ 3.4Å; F158-F160 HydrophobicContact CD1-CZ 3.4Å; F158-F160 AromaticContact CE1-CD1 3.72Å; F158-F160 HydrophobicContact CE1-CD1 3.72Å; F158-F160 AromaticContact CE1-CE1 3.58Å; F158-F160 HydrophobicContact CE1-CE1 3.58Å; F158-F160 HydrophobicContact CE1-CG 4.32Å; F158-F160 HydrophobicContact CE1-CZ 4.08Å; F158-F160 HydrophobicContact CG-CE1 4.43Å; F158-F160 HydrophobicContact CG-CE2 4.27Å; F158-F160 HydrophobicContact CG-CZ 4.1Å; F158-F160 PolarHBondContact O-N 2.93Å; F160-K162 PolarHBondContact O-N 3.46Å; F160-Y163 PolarHBondContact O-N 3.25Å; F160-Y212 HydrophobicContact CB-CD2 4.42Å; F160-Y212 WeakPolarHBondContact O-CE2 3.24Å
161T63.3Low75Confident0 Ų080 Ų800%041%0.405CS..G310 helixtrans-64.5-14.6-172.343.60000115D159 Y163 Y164 Y212 K215 M216 G221 K222 F223D159-T161 VanDerWaalsContact C-N 3.27Å; D159-T161 PolarHBondContact O-N 3.43Å; T161-Y163 PolarHBondContact O-N 3.47Å; T161-Y164 PolarHBondContact O-N 3.45Å; T161-Y212 VanDerWaalsContact CA-CE2 3.48Å; T161-Y212 HydrophobicContact CG2-CE2 4.46Å; T161-Y212 PolarHBondContact O-OH 2.96Å; T161-Y212 VanDerWaalsContact O-OH 3.07Å; T161-K215 HydrophobicContact CG2-CG 4.22Å; T161-M216 HydrophobicContact CG2-CG 3.51Å; T161-G221 VanDerWaalsContact OG1-CA 3.29Å; T161-G221 WeakPolarHBondContact OG1-CA 3.46Å; T161-K222 PolarHBondContact OG1-N 3.18Å; T161-F223 WeakPolarHBondContact O-CD2 3.48Å
162K66.5Low74.7Confident130 Ų13078.4 Ų78.457%0.56539%0.391SS*.G310 helixtrans-58.4-21.1175.4-73-178.8-177.5173.40113.3F160 K222F160-K162 PolarHBondContact O-N 3.46Å; K162-K222 HydrophobicContact CG-CD 4.28Å
163Y68Low74.6Confident141 Ų14180.1 Ų80.155%0.55339%0.393SS*.G310 helixtrans-10235.4-174.2-59.1-70.5000113.8F160 T161 T165 I166 N167F160-Y163 PolarHBondContact O-N 3.25Å; T161-Y163 PolarHBondContact O-N 3.47Å; Y163-T165 VanDerWaalsContact C-N 3.31Å; Y163-T165 PolarHBondContact O-N 2.97Å; Y163-I166 HydrophobicContact CD1-CD1 3.57Å; Y163-I166 HydrophobicContact CD1-CG1 4.46Å; Y163-I166 HydrophobicContact CE1-CD1 4.42Å; Y163-I166 HydrophobicContact CG-CD1 4.11Å; Y163-I166 WeakPolarHBondContact O-CA 3.47Å; Y163-I166 WeakPolarHBondContact O-CB 3.34Å; Y163-I166 PolarHBondContact O-N 3.48Å; Y163-N167 PolarHBondContact O-N 2.94Å
164Y69.8Low74.6Confident102 Ų10279.7 Ų79.740%0.439%0.391SS..Hα-helixtrans-50.6-46.1-178.7-178.4-101000113.9T161 I166 N167 L168 Y212 M216T161-Y164 PolarHBondContact O-N 3.45Å; Y164-I166 VanDerWaalsContact C-N 3.26Å; Y164-I166 PolarHBondContact O-N 3.26Å; Y164-N167 WeakPolarHBondContact O-CB 3.48Å; Y164-N167 PolarHBondContact O-N 2.85Å; Y164-N167 VanDerWaalsContact O-N 3.09Å; Y164-L168 PolarHBondContact O-N 3.25Å; Y164-Y212 WeakPolarHBondContact CA-OH 3.35Å; Y164-Y212 VanDerWaalsContact CB-OH 3.22Å; Y164-Y212 WeakPolarHBondContact CB-OH 3.09Å; Y164-Y212 HydrophobicContact CD2-CE1 4.07Å; Y164-Y212 WeakPolarHBondContact CD2-OH 3.37Å; Y164-Y212 PolarHBondContact N-OH 3.04Å; Y164-M216 HydrophobicContact CD2-SD 4.03Å; Y164-M216 HydrophobicContact CE2-CE 4.41Å; Y164-M216 HydrophobicContact CE2-SD 4.26Å
165T73.8Confident74.6Confident97 Ų9776.5 Ų76.560%0.59537%0.368SS*.Hα-helixtrans-61.2-37.3178.8-37.70000111.7Y163 L168 F169Y163-T165 VanDerWaalsContact C-N 3.31Å; Y163-T165 PolarHBondContact O-N 2.97Å; T165-L168 PolarHBondContact O-N 3.2Å; T165-F169 HydrophobicContact CG2-CD2 4.49Å; T165-F169 HydrophobicContact CG2-CE2 4.33Å; T165-F169 VanDerWaalsContact O-CD2 3.32Å; T165-F169 WeakPolarHBondContact O-CD2 3.42Å; T165-F169 PolarHBondContact O-N 3.36Å
166I78.2Confident74.7Confident94 Ų9475.8 Ų75.848%0.48236%0.358SS..Hα-helixtrans-66.5-41.6176.4-56.1-176.1000110Y163 Y164 L168 F169 V170Y163-I166 HydrophobicContact CD1-CD1 3.57Å; Y163-I166 HydrophobicContact CD1-CG1 4.46Å; Y163-I166 HydrophobicContact CE1-CD1 4.42Å; Y163-I166 HydrophobicContact CG-CD1 4.11Å; Y163-I166 WeakPolarHBondContact O-CA 3.47Å; Y163-I166 WeakPolarHBondContact O-CB 3.34Å; Y163-I166 PolarHBondContact O-N 3.48Å; Y164-I166 VanDerWaalsContact C-N 3.26Å; Y164-I166 PolarHBondContact O-N 3.26Å; I166-L168 VanDerWaalsContact C-N 3.29Å; I166-L168 PolarHBondContact O-N 3.03Å; I166-F169 PolarHBondContact O-N 3.05Å; I166-V170 HydrophobicContact CG2-CG2 4.18Å; I166-V170 VanDerWaalsContact O-CG2 3.31Å; I166-V170 WeakPolarHBondContact O-CG2 3.28Å; I166-V170 PolarHBondContact O-N 2.85Å
167N77.9Confident75Confident13 Ų1373.3 Ų73.37%0.0735%0.345CS..Hα-helixtrans-61.2-37.4177-176.758.6000112.5Y163 Y164 V170 S171 Y212 E213Y163-N167 PolarHBondContact O-N 2.94Å; Y164-N167 WeakPolarHBondContact O-CB 3.48Å; Y164-N167 PolarHBondContact O-N 2.85Å; Y164-N167 VanDerWaalsContact O-N 3.09Å; N167-V170 PolarHBondContact O-N 3.05Å; N167-S171 WeakPolarHBondContact O-CB 3.32Å; N167-S171 PolarHBondContact O-N 3.31Å; N167-Y212 HydrophobicContact CB-CD1 3.68Å; N167-Y212 HydrophobicContact CB-CD2 4.13Å; N167-Y212 HydrophobicContact CB-CE1 3.7Å; N167-Y212 HydrophobicContact CB-CE2 4.15Å; N167-Y212 HydrophobicContact CB-CG 3.93Å; N167-Y212 WeakPolarHBondContact ND2-CD1 3.41Å; N167-Y212 VanDerWaalsContact ND2-CE1 3.33Å; N167-Y212 WeakPolarHBondContact ND2-CE1 3.43Å; N167-E213 PolarHBondContact ND2-OE1 3.18Å
168L76.4Confident75.6Confident54 Ų5465.2 Ų65.228%0.28331%0.308SS..Hα-helixtrans-60.1-48174.1-168.5157.9000111M96 Y164 T165 I166 S171 L172M96-L168 HydrophobicContact CE-CB 4.29Å; M96-L168 HydrophobicContact CE-CD2 4.29Å; M96-L168 HydrophobicContact CE-CG 3.66Å; Y164-L168 PolarHBondContact O-N 3.25Å; T165-L168 PolarHBondContact O-N 3.2Å; I166-L168 VanDerWaalsContact C-N 3.29Å; I166-L168 PolarHBondContact O-N 3.03Å; L168-S171 PolarHBondContact O-N 3.37Å; L168-L172 HydrophobicContact CD2-CD1 3.71Å; L168-L172 HydrophobicContact CD2-CG 4.31Å; L168-L172 PolarHBondContact O-N 2.9Å; L168-L172 VanDerWaalsContact O-N 3.07Å
169F83.2Confident76.2Confident146 Ų14662 Ų6264%0.6430%0.296SS*.Hα-helixtrans-62.2-42.2175.3-84.8-78.4000112.6T165 I166 S171 L172 F173T165-F169 HydrophobicContact CG2-CD2 4.49Å; T165-F169 HydrophobicContact CG2-CE2 4.33Å; T165-F169 VanDerWaalsContact O-CD2 3.32Å; T165-F169 WeakPolarHBondContact O-CD2 3.42Å; T165-F169 PolarHBondContact O-N 3.36Å; I166-F169 PolarHBondContact O-N 3.05Å; F169-S171 VanDerWaalsContact C-N 3.32Å; F169-S171 PolarHBondContact O-N 3.29Å; F169-L172 PolarHBondContact O-N 3.3Å; F169-F173 VanDerWaalsContact O-CB 3.29Å; F169-F173 WeakPolarHBondContact O-CB 3.48Å; F169-F173 PolarHBondContact O-N 3.07Å
170V82.6Confident77.2Confident31 Ų3163.8 Ų63.819%0.18831%0.305CS..Hα-helixtrans-61.9-41.1176.7170.30000110.9I166 N167 F173 I174 F205I166-V170 HydrophobicContact CG2-CG2 4.18Å; I166-V170 VanDerWaalsContact O-CG2 3.31Å; I166-V170 WeakPolarHBondContact O-CG2 3.28Å; I166-V170 PolarHBondContact O-N 2.85Å; N167-V170 PolarHBondContact O-N 3.05Å; V170-F173 PolarHBondContact O-N 3.28Å; V170-I174 HydrophobicContact CG1-CD1 3.85Å; V170-I174 HydrophobicContact CG1-CG1 4.47Å; V170-I174 WeakPolarHBondContact O-CD1 3.48Å; V170-I174 VanDerWaalsContact O-CG1 3.26Å; V170-I174 WeakPolarHBondContact O-CG1 3.4Å; V170-I174 PolarHBondContact O-N 3.37Å; V170-F205 HydrophobicContact CG1-CB 4.17Å; V170-F205 HydrophobicContact CG1-CD1 4.25Å
171S80.4Confident77.8Confident7 Ų760.3 Ų60.35%0.04929%0.29CS..Hα-helixtrans-61.6-50.3176.1-175.60000111.8N167 L168 F169 F173 I174 D175 K209N167-S171 WeakPolarHBondContact O-CB 3.32Å; N167-S171 PolarHBondContact O-N 3.31Å; L168-S171 PolarHBondContact O-N 3.37Å; F169-S171 VanDerWaalsContact C-N 3.32Å; F169-S171 PolarHBondContact O-N 3.29Å; S171-F173 VanDerWaalsContact C-N 3.25Å; S171-F173 PolarHBondContact O-N 2.88Å; S171-I174 PolarHBondContact O-N 2.94Å; S171-D175 VanDerWaalsContact O-CG 3.24Å; S171-D175 PolarHBondContact O-N 2.73Å; S171-K209 WeakPolarHBondContact OG-CE 3.31Å; S171-K209 PolarHBondContact OG-NZ 3.47Å
172L81.8Confident78.5Confident45 Ų4561.1 Ų61.124%0.23629%0.294CS..Hα-helixtrans-61.7-37.3177.9-70.9176.3000111.6L93 M96 L168 F169 D175 M176L93-L172 HydrophobicContact CD2-CD2 4.13Å; M96-L172 HydrophobicContact SD-CD2 4.03Å; M96-L172 HydrophobicContact SD-CG 4.35Å; L168-L172 HydrophobicContact CD2-CD1 3.71Å; L168-L172 HydrophobicContact CD2-CG 4.31Å; L168-L172 PolarHBondContact O-N 2.9Å; L168-L172 VanDerWaalsContact O-N 3.07Å; F169-L172 PolarHBondContact O-N 3.3Å; L172-D175 PolarHBondContact O-N 2.89Å; L172-M176 WeakPolarHBondContact O-CB 3.26Å; L172-M176 WeakPolarHBondContact O-CG 3.43Å; L172-M176 PolarHBondContact O-N 3.21Å
173F84.1Confident79.1Confident99 Ų9956.6 Ų56.643%0.43428%0.279SS..Hα-helixtrans-63.8-46177.1-178.4-101.4000112.1F169 V170 S171 M176 V177 F205F169-F173 VanDerWaalsContact O-CB 3.29Å; F169-F173 WeakPolarHBondContact O-CB 3.48Å; F169-F173 PolarHBondContact O-N 3.07Å; V170-F173 PolarHBondContact O-N 3.28Å; S171-F173 VanDerWaalsContact C-N 3.25Å; S171-F173 PolarHBondContact O-N 2.88Å; F173-M176 PolarHBondContact O-N 2.81Å; F173-V177 HydrophobicContact CD1-CG2 4.15Å; F173-V177 HydrophobicContact CD2-CG2 4.5Å; F173-V177 HydrophobicContact CE1-CG2 3.75Å; F173-V177 HydrophobicContact CE2-CG2 4.13Å; F173-V177 HydrophobicContact CZ-CG2 3.74Å; F173-V177 VanDerWaalsContact O-CG2 3.3Å; F173-V177 WeakPolarHBondContact O-CG2 3.44Å; F173-V177 PolarHBondContact O-N 2.67Å; F173-F205 HydrophobicContact CD1-CD2 4.46Å; F173-F205 HydrophobicContact CE1-CD2 4.14Å; F173-F205 AromaticContact CE1-CE2 3.91Å; F173-F205 HydrophobicContact CE1-CE2 3.91Å; F173-F205 HydrophobicContact CE1-CZ 4.2Å
174I82.8Confident79.7Confident1 Ų153.2 Ų53.21%0.00527%0.27CS..Hα-helixtrans-59.6-50.1176.1-67.5159.1000110.3V170 S171 M176 V177 L178 F205 T206 K209V170-I174 HydrophobicContact CG1-CD1 3.85Å; V170-I174 HydrophobicContact CG1-CG1 4.47Å; V170-I174 WeakPolarHBondContact O-CD1 3.48Å; V170-I174 VanDerWaalsContact O-CG1 3.26Å; V170-I174 WeakPolarHBondContact O-CG1 3.4Å; V170-I174 PolarHBondContact O-N 3.37Å; S171-I174 PolarHBondContact O-N 2.94Å; I174-M176 PolarHBondContact O-N 3.14Å; I174-V177 PolarHBondContact O-N 2.93Å; I174-V177 VanDerWaalsContact O-N 3.12Å; I174-L178 HydrophobicContact CG2-CD1 4.01Å; I174-L178 HydrophobicContact CG2-CG 4.33Å; I174-L178 WeakPolarHBondContact O-CG 3.31Å; I174-L178 PolarHBondContact O-N 3.46Å; I174-F205 HydrophobicContact CD1-CB 3.76Å; I174-F205 HydrophobicContact CG1-CB 3.6Å; I174-T206 HydrophobicContact CD1-CG2 4.22Å; I174-T206 HydrophobicContact CG1-CG2 4.46Å; I174-T206 HydrophobicContact CG2-CG2 3.78Å; I174-K209 HydrophobicContact CD1-CB 4.09Å; I174-K209 HydrophobicContact CD1-CD 3.83Å
175D80Confident80Confident9 Ų948.7 Ų48.75%0.04825%0.252CS..Hα-helixtrans-60.5-38-177.5-63.3-22.8000110.9Q92 S171 L172 L179Q92-D175 PolarHBondContact NE2-OD1 3.25Å; Q92-D175 PolarHBondContact NE2-OD2 3.27Å; S171-D175 VanDerWaalsContact O-CG 3.24Å; S171-D175 PolarHBondContact O-N 2.73Å; L172-D175 PolarHBondContact O-N 2.89Å; D175-L179 PolarHBondContact O-N 3.46Å
176M82.6Confident80Confident109 Ų10946.5 Ų46.554%0.53723%0.234SC..Hα-helixtrans-68.7-43.2174-72.9-67.9178.200112.9L172 F173 I174 L178 L179 I180L172-M176 WeakPolarHBondContact O-CB 3.26Å; L172-M176 WeakPolarHBondContact O-CG 3.43Å; L172-M176 PolarHBondContact O-N 3.21Å; F173-M176 PolarHBondContact O-N 2.81Å; I174-M176 PolarHBondContact O-N 3.14Å; M176-L178 VanDerWaalsContact C-N 3.28Å; M176-L178 PolarHBondContact O-N 2.86Å; M176-L179 PolarHBondContact O-N 3.07Å; M176-I180 WeakPolarHBondContact O-CB 3.35Å; M176-I180 WeakPolarHBondContact O-CD1 3.35Å; M176-I180 WeakPolarHBondContact O-CG1 3.34Å; M176-I180 PolarHBondContact O-N 3.46Å
177V81.7Confident80Confident23 Ų2348.3 Ų48.314%0.13924%0.244CC..Hα-helixtrans-61.6-40.1176.5168.60000110.7F173 I174 G181 A202F173-V177 HydrophobicContact CD1-CG2 4.15Å; F173-V177 HydrophobicContact CD2-CG2 4.5Å; F173-V177 HydrophobicContact CE1-CG2 3.75Å; F173-V177 HydrophobicContact CE2-CG2 4.13Å; F173-V177 HydrophobicContact CZ-CG2 3.74Å; F173-V177 VanDerWaalsContact O-CG2 3.3Å; F173-V177 WeakPolarHBondContact O-CG2 3.44Å; F173-V177 PolarHBondContact O-N 2.67Å; I174-V177 PolarHBondContact O-N 2.93Å; I174-V177 VanDerWaalsContact O-N 3.12Å; V177-G181 PolarHBondContact O-N 3.34Å; V177-A202 HydrophobicContact CG1-CB 4.2Å
178L79.6Confident79.9Confident14 Ų1452.1 Ų52.17%0.07326%0.264CS..Hα-helixtrans-65.1-48.6174.9-64.8177.3000110.8I174 M176 I180 G181 Q182 A202 W242 N243 T247 W250I174-L178 HydrophobicContact CG2-CD1 4.01Å; I174-L178 HydrophobicContact CG2-CG 4.33Å; I174-L178 WeakPolarHBondContact O-CG 3.31Å; I174-L178 PolarHBondContact O-N 3.46Å; M176-L178 VanDerWaalsContact C-N 3.28Å; M176-L178 PolarHBondContact O-N 2.86Å; L178-I180 VanDerWaalsContact C-N 3.33Å; L178-I180 PolarHBondContact O-N 3.29Å; L178-G181 PolarHBondContact O-N 2.95Å; L178-Q182 PolarHBondContact O-N 3.12Å; L178-A202 HydrophobicContact CD2-CB 4.49Å; L178-W242 HydrophobicContact CD1-CZ3 4.35Å; L178-N243 WeakPolarHBondContact CD1-OD1 3.28Å; L178-T247 HydrophobicContact CD2-CG2 3.99Å; L178-W250 HydrophobicContact CB-CH2 3.86Å; L178-W250 HydrophobicContact CB-CZ3 4.22Å; L178-W250 HydrophobicContact CD2-CE3 3.83Å; L178-W250 HydrophobicContact CD2-CH2 3.56Å; L178-W250 HydrophobicContact CD2-CZ2 4.35Å; L178-W250 HydrophobicContact CD2-CZ3 3.31Å; L178-W250 HydrophobicContact CG-CH2 4.31Å; L178-W250 HydrophobicContact CG-CZ3 4.33Å; L178-W250 WeakPolarHBondContact O-CH2 3.13Å
179L80.6Confident79.5Confident53 Ų5354.8 Ų54.828%0.27729%0.287SS..Hα-helixtrans-56.4-46175.9-92.9169.1000113.3L89 D175 M176 S183L89-L179 HydrophobicContact CD1-CD1 3.22Å; L89-L179 HydrophobicContact CD1-CD2 3.9Å; L89-L179 HydrophobicContact CD1-CG 3.3Å; L89-L179 HydrophobicContact CD2-CD1 3.95Å; L89-L179 HydrophobicContact CG-CD1 4.23Å; D175-L179 PolarHBondContact O-N 3.46Å; M176-L179 PolarHBondContact O-N 3.07Å; L179-S183 VanDerWaalsContact O-CB 3.27Å; L179-S183 WeakPolarHBondContact O-CB 3.36Å; L179-S183 PolarHBondContact O-N 2.93Å; L179-S183 PolarHBondContact O-OG 3.49Å
180I83.5Confident78.8Confident96 Ų9652.7 Ų52.749%0.49228%0.277SS..Hα-helixtrans-66.8-44-179.7-68.1165.5000110M176 L178 Q182 S183 L184M176-I180 WeakPolarHBondContact O-CB 3.35Å; M176-I180 WeakPolarHBondContact O-CD1 3.35Å; M176-I180 WeakPolarHBondContact O-CG1 3.34Å; M176-I180 PolarHBondContact O-N 3.46Å; L178-I180 VanDerWaalsContact C-N 3.33Å; L178-I180 PolarHBondContact O-N 3.29Å; I180-Q182 PolarHBondContact O-N 2.88Å; I180-S183 PolarHBondContact O-N 3.44Å; I180-L184 HydrophobicContact CG2-CD1 3.7Å; I180-L184 HydrophobicContact CG2-CG 4.15Å; I180-L184 WeakPolarHBondContact O-CB 3.43Å; I180-L184 VanDerWaalsContact O-CG 3.31Å; I180-L184 WeakPolarHBondContact O-CG 3.42Å; I180-L184 PolarHBondContact O-N 2.92Å
181G77.2Confident78.3Confident3 Ų353.2 Ų53.23%0.03128%0.282CS..Hα-helixtrans-58.2-48.3177.100000112.1V177 L178 Y185V177-G181 PolarHBondContact O-N 3.34Å; L178-G181 PolarHBondContact O-N 2.95Å; G181-Y185 PolarHBondContact O-N 3.44Å
182Q78.5Confident78.1Confident17 Ų1755.1 Ų55.18%0.07929%0.292CS..Hα-helixtrans-64.8-42.3176.8-164.268.324.800111.7L81 L178 I180 Y185 F186 W250L81-Q182 HydrophobicContact CD2-CG 4.31Å; L178-Q182 PolarHBondContact O-N 3.12Å; I180-Q182 PolarHBondContact O-N 2.88Å; Q182-Y185 PolarHBondContact O-N 2.79Å; Q182-F186 HydrophobicContact CG-CD2 4.49Å; Q182-F186 HydrophobicContact CG-CE2 4.14Å; Q182-F186 VanDerWaalsContact O-CD2 3.27Å; Q182-F186 WeakPolarHBondContact O-CD2 3.46Å; Q182-F186 PolarHBondContact O-N 3.12Å; Q182-W250 HydrophobicContact CB-CH2 4.25Å; Q182-W250 HydrophobicContact CB-CZ2 4.27Å
183S79.1Confident78.1Confident35 Ų3556.5 Ų56.525%0.24530%0.302CS..Hα-helixtrans-64.3-44.7179.6-60.20000111.9L179 I180 Y185 F186 I187L179-S183 VanDerWaalsContact O-CB 3.27Å; L179-S183 WeakPolarHBondContact O-CB 3.36Å; L179-S183 PolarHBondContact O-N 2.93Å; L179-S183 PolarHBondContact O-OG 3.49Å; I180-S183 PolarHBondContact O-N 3.44Å; S183-Y185 VanDerWaalsContact C-N 3.33Å; S183-Y185 PolarHBondContact O-N 2.99Å; S183-F186 PolarHBondContact O-N 3.47Å; S183-I187 WeakPolarHBondContact O-CG1 3.4Å; S183-I187 PolarHBondContact O-N 3.39Å; S183-I187 VanDerWaalsContact O-N 3.09Å
184L79.9Confident78.1Confident69 Ų6952.9 Ų52.936%0.36129%0.288SS..Hα-helixtrans-65.8-34.6177.6-74.5175000112.1I180 F186 I187 L188 V194I180-L184 HydrophobicContact CG2-CD1 3.7Å; I180-L184 HydrophobicContact CG2-CG 4.15Å; I180-L184 WeakPolarHBondContact O-CB 3.43Å; I180-L184 VanDerWaalsContact O-CG 3.31Å; I180-L184 WeakPolarHBondContact O-CG 3.42Å; I180-L184 PolarHBondContact O-N 2.92Å; L184-F186 VanDerWaalsContact C-N 3.3Å; L184-F186 PolarHBondContact O-N 2.95Å; L184-I187 PolarHBondContact O-N 3.17Å; L184-L188 HydrophobicContact CB-CD1 4.28Å; L184-L188 HydrophobicContact CD2-CD1 4.27Å; L184-L188 VanDerWaalsContact O-CB 3.27Å; L184-L188 WeakPolarHBondContact O-CB 3.36Å; L184-L188 PolarHBondContact O-N 3.46Å; L184-V194 HydrophobicContact CB-CG1 3.69Å; L184-V194 HydrophobicContact CD1-CG1 4.48Å
185Y76.6Confident78.1Confident8 Ų852.8 Ų52.83%0.03129%0.288CS..Hα-helixtrans-58.8-41.1175.4174.3-104.3000112.2L129 G181 Q182 S183 K190 L195 L257L129-Y185 HydrophobicContact CD1-CE1 4.4Å; G181-Y185 PolarHBondContact O-N 3.44Å; Q182-Y185 PolarHBondContact O-N 2.79Å; S183-Y185 VanDerWaalsContact C-N 3.33Å; S183-Y185 PolarHBondContact O-N 2.99Å; Y185-K190 HydrophobicContact CE1-CB 4.45Å; Y185-K190 HydrophobicContact CE1-CG 4.23Å; Y185-K190 VanDerWaalsContact CE2-CA 3.49Å; Y185-K190 HydrophobicContact CE2-CB 3.91Å; Y185-K190 WeakPolarHBondContact O-CA 3.32Å; Y185-K190 PolarHBondContact O-N 3.21Å; Y185-L195 HydrophobicContact CD1-CD1 4.3Å; Y185-L195 HydrophobicContact CD2-CD1 3.41Å; Y185-L195 VanDerWaalsContact CD2-CD1 3.41Å; Y185-L195 HydrophobicContact CD2-CD2 4.34Å; Y185-L195 HydrophobicContact CD2-CG 3.59Å; Y185-L195 HydrophobicContact CE1-CD1 4.42Å; Y185-L195 HydrophobicContact CE2-CD1 3.56Å; Y185-L195 HydrophobicContact CE2-CG 4.24Å; Y185-L195 HydrophobicContact CG-CD1 3.8Å; Y185-L195 HydrophobicContact CG-CD2 4.12Å; Y185-L195 HydrophobicContact CG-CG 3.87Å; Y185-L257 HydrophobicContact CE2-CD2 4.19Å; Y185-L257 VanDerWaalsContact OH-CD2 3.25Å; Y185-L257 WeakPolarHBondContact OH-CD2 3.46Å
186F73.4Confident78.3Confident50 Ų5053.9 Ų53.922%0.21930%0.296CS..Hα-helixtrans-72.5-42175.5-75.6-73.9000112.8E78 L81 W82 Q182 S183 L184E78-F186 HydrophobicContact CB-CE1 4.12Å; E78-F186 HydrophobicContact CG-CE1 4.42Å; L81-F186 HydrophobicContact CD1-CZ 4.41Å; L81-F186 HydrophobicContact CD2-CE2 4.07Å; L81-F186 HydrophobicContact CD2-CZ 4.17Å; W82-F186 AromaticContact CD1-CD2 3.95Å; W82-F186 AromaticContact CD1-CE2 3.76Å; W82-F186 AromaticContact NE1-CD2 3.92Å; Q182-F186 HydrophobicContact CG-CD2 4.49Å; Q182-F186 HydrophobicContact CG-CE2 4.14Å; Q182-F186 VanDerWaalsContact O-CD2 3.27Å; Q182-F186 WeakPolarHBondContact O-CD2 3.46Å; Q182-F186 PolarHBondContact O-N 3.12Å; S183-F186 PolarHBondContact O-N 3.47Å; L184-F186 VanDerWaalsContact C-N 3.3Å; L184-F186 PolarHBondContact O-N 2.95Å
187I77.8Confident78.4Confident132 Ų13253.6 Ų53.668%0.67730%0.295SS*.Hα-helixtrans-67.8-42-178.6-66167.8000111.5S183 L184 S189S183-I187 WeakPolarHBondContact O-CG1 3.4Å; S183-I187 PolarHBondContact O-N 3.39Å; S183-I187 VanDerWaalsContact O-N 3.09Å; L184-I187 PolarHBondContact O-N 3.17Å; I187-S189 PolarHBondContact O-N 3.32Å; I187-S189 VanDerWaalsContact O-N 3.15Å
188L75.4Confident78.6Confident94 Ų9453 Ų5349%0.49229%0.293SS..THydrogen-bonded Turntrans-86.832.2-176.9-67.5166.2000112.8L184 K190 S191 V194L184-L188 HydrophobicContact CB-CD1 4.28Å; L184-L188 HydrophobicContact CD2-CD1 4.27Å; L184-L188 VanDerWaalsContact O-CB 3.27Å; L184-L188 WeakPolarHBondContact O-CB 3.36Å; L184-L188 PolarHBondContact O-N 3.46Å; L188-K190 PolarHBondContact O-N 3.13Å; L188-S191 PolarHBondContact O-N 2.73Å; L188-V194 HydrophobicContact CD1-CG2 3.73Å
189S68.9Low78.8Confident109 Ų10952.3 Ų52.376%0.76229%0.29SS*.THydrogen-bonded Turntrans5446.6173.4-172.90000114.1I187 S191I187-S189 PolarHBondContact O-N 3.32Å; I187-S189 VanDerWaalsContact O-N 3.15Å; S189-S191 PolarHBondContact O-N 3.02Å
190K68.5Low79.2Confident102 Ų10252.4 Ų52.444%0.44330%0.298SS..SBendtrans63.639.3173.8-55.5178.2-179.41790113.9E78 Y185 L188 N192E78-K190 WeakPolarHBondContact OE1-CE 3.29Å; E78-K190 IonicContact OE1-NZ 2.68Å; E78-K190 PolarHBondContact OE1-NZ 2.98Å; Y185-K190 HydrophobicContact CE1-CB 4.45Å; Y185-K190 HydrophobicContact CE1-CG 4.23Å; Y185-K190 VanDerWaalsContact CE2-CA 3.49Å; Y185-K190 HydrophobicContact CE2-CB 3.91Å; Y185-K190 WeakPolarHBondContact O-CA 3.32Å; Y185-K190 PolarHBondContact O-N 3.21Å; L188-K190 PolarHBondContact O-N 3.13Å; K190-N192 PolarHBondContact O-N 3.47Å; K190-N192 PolarHBondContact O-OD1 3.31Å
191S71.9Confident79.4Confident42 Ų4251.8 Ų51.829%0.29430%0.295SS..  trans-72.4109.3176.3-173.60000111.8L188 S189 T193 V194L188-S191 PolarHBondContact O-N 2.73Å; S189-S191 PolarHBondContact O-N 3.02Å; S191-T193 PolarHBondContact O-N 3.46Å; S191-T193 VanDerWaalsContact O-N 3.14Å; S191-T193 PolarHBondContact OG-OG1 3.31Å; S191-V194 WeakPolarHBondContact O-CB 3.27Å; S191-V194 PolarHBondContact O-N 3.42Å; S191-V194 VanDerWaalsContact O-N 3.13Å
192N77.3Confident79.9Confident47 Ų4751.7 Ų51.725%0.25129%0.294SS..Hα-helixtrans-58-27.6-179.3-57.1-1.6000113.1K190 V194 L195 C196 L257K190-N192 PolarHBondContact O-N 3.47Å; K190-N192 PolarHBondContact O-OD1 3.31Å; N192-V194 VanDerWaalsContact C-N 3.25Å; N192-V194 PolarHBondContact O-N 3.07Å; N192-L195 PolarHBondContact O-N 2.79Å; N192-C196 PolarHBondContact O-N 2.84Å; N192-L257 WeakPolarHBondContact OD1-CD2 3.27Å
193T80.4Confident80.5Confident74 Ų7453.4 Ų53.445%0.45430%0.303SS..Hα-helixtrans-65.1-31.9-179.4540000111.8S191 C196 I197S191-T193 PolarHBondContact O-N 3.46Å; S191-T193 VanDerWaalsContact O-N 3.14Å; S191-T193 PolarHBondContact OG-OG1 3.31Å; T193-C196 PolarHBondContact O-N 2.96Å; T193-I197 WeakPolarHBondContact O-CD1 3.31Å; T193-I197 VanDerWaalsContact O-CG1 3.23Å; T193-I197 WeakPolarHBondContact O-CG1 3.36Å; T193-I197 PolarHBondContact O-N 3.24Å
194V83.7Confident81Confident23 Ų2354.7 Ų54.714%0.13931%0.31CS..Hα-helixtrans-66.3-47.2-179.7178.70000111L184 L188 S191 N192 C196 I197 A198L184-V194 HydrophobicContact CB-CG1 3.69Å; L184-V194 HydrophobicContact CD1-CG1 4.48Å; L188-V194 HydrophobicContact CD1-CG2 3.73Å; S191-V194 WeakPolarHBondContact O-CB 3.27Å; S191-V194 PolarHBondContact O-N 3.42Å; S191-V194 VanDerWaalsContact O-N 3.13Å; N192-V194 VanDerWaalsContact C-N 3.25Å; N192-V194 PolarHBondContact O-N 3.07Å; V194-C196 PolarHBondContact O-N 3.09Å; V194-I197 PolarHBondContact O-N 3.3Å; V194-A198 WeakPolarHBondContact O-CB 3.41Å; V194-A198 PolarHBondContact O-N 2.92Å
195L83.3Confident81.4Confident0 Ų054.8 Ų54.80%031%0.308CS..Hα-helixtrans-62.7-43.9177.6-70.6174.8000111.1Y185 N192 I197 A198 G199 W250 S253Y185-L195 HydrophobicContact CD1-CD1 4.3Å; Y185-L195 HydrophobicContact CD2-CD1 3.41Å; Y185-L195 VanDerWaalsContact CD2-CD1 3.41Å; Y185-L195 HydrophobicContact CD2-CD2 4.34Å; Y185-L195 HydrophobicContact CD2-CG 3.59Å; Y185-L195 HydrophobicContact CE1-CD1 4.42Å; Y185-L195 HydrophobicContact CE2-CD1 3.56Å; Y185-L195 HydrophobicContact CE2-CG 4.24Å; Y185-L195 HydrophobicContact CG-CD1 3.8Å; Y185-L195 HydrophobicContact CG-CD2 4.12Å; Y185-L195 HydrophobicContact CG-CG 3.87Å; N192-L195 PolarHBondContact O-N 2.79Å; L195-I197 PolarHBondContact O-N 3.01Å; L195-A198 PolarHBondContact O-N 3.34Å; L195-G199 PolarHBondContact O-N 2.6Å; L195-W250 HydrophobicContact CB-CB 4.37Å; L195-W250 HydrophobicContact CB-CG 4.37Å; L195-W250 HydrophobicContact CD2-CD2 3.84Å; L195-W250 HydrophobicContact CD2-CE3 4.22Å; L195-W250 HydrophobicContact CD2-CG 4.19Å; L195-W250 HydrophobicContact CD2-CZ2 4.3Å; L195-S253 WeakPolarHBondContact CB-OG 3.39Å
196C83.8Confident82Confident32 Ų3254.5 Ų54.522%0.21631%0.307CS..Hα-helixtrans-60.9-45.3179.3-173.80000112N192 T193 V194 G199 A200 W250N192-C196 PolarHBondContact O-N 2.84Å; T193-C196 PolarHBondContact O-N 2.96Å; V194-C196 PolarHBondContact O-N 3.09Å; C196-G199 PolarHBondContact O-N 2.93Å; C196-A200 VanDerWaalsContact O-CB 3.26Å; C196-A200 WeakPolarHBondContact O-CB 3.43Å; C196-A200 PolarHBondContact O-N 3.46Å; C196-W250 WeakPolarHBondContact CA-O 3.33Å; C196-W250 PolarHBondContact N-O 3.04Å
197I85.8Confident82.8Confident102 Ų10254 Ų5452%0.52331%0.308SS..Hα-helixtrans-64.3-45.4177.4-67.6164.9000110.7T193 V194 L195 G199 A200 I201T193-I197 WeakPolarHBondContact O-CD1 3.31Å; T193-I197 VanDerWaalsContact O-CG1 3.23Å; T193-I197 WeakPolarHBondContact O-CG1 3.36Å; T193-I197 PolarHBondContact O-N 3.24Å; V194-I197 PolarHBondContact O-N 3.3Å; L195-I197 PolarHBondContact O-N 3.01Å; I197-G199 PolarHBondContact O-N 3.42Å; I197-A200 PolarHBondContact O-N 3.04Å; I197-I201 HydrophobicContact CG2-CD1 3.78Å; I197-I201 VanDerWaalsContact O-CG1 3.28Å; I197-I201 WeakPolarHBondContact O-CG1 3.37Å; I197-I201 PolarHBondContact O-N 3.25Å
198A84.9Confident83.2Confident11 Ų1152.6 Ų52.69%0.09130%0.301CS..Hα-helixtrans-61.4-45.1178.300000111.8V194 L195 I201 A202 W250V194-A198 WeakPolarHBondContact O-CB 3.41Å; V194-A198 PolarHBondContact O-N 2.92Å; L195-A198 PolarHBondContact O-N 3.34Å; A198-I201 PolarHBondContact O-N 3.03Å; A198-A202 VanDerWaalsContact O-CB 3.3Å; A198-A202 WeakPolarHBondContact O-CB 3.27Å; A198-A202 PolarHBondContact O-N 3.4Å; A198-W250 HydrophobicContact CB-CE3 4.03Å; A198-W250 HydrophobicContact CB-CZ3 4.08Å
199G84.8Confident83.7Confident0 Ų048.3 Ų48.30%028%0.279CS..Hα-helixtrans-63.6-43.4176.700000112.5L195 C196 I197 I201 A202 L203 I251L195-G199 PolarHBondContact O-N 2.6Å; C196-G199 PolarHBondContact O-N 2.93Å; I197-G199 PolarHBondContact O-N 3.42Å; G199-I201 VanDerWaalsContact C-N 3.33Å; G199-I201 PolarHBondContact O-N 3.18Å; G199-A202 PolarHBondContact O-N 3.44Å; G199-L203 WeakPolarHBondContact O-CB 3.43Å; G199-L203 PolarHBondContact O-N 2.95Å; G199-I251 VanDerWaalsContact C-CG1 3.47Å
200A87.8Confident84.7Confident54 Ų5443.1 Ų43.145%0.44624%0.242SC..Hα-helixtrans-63.4-38.7178.500000112.3C196 I197 P204 I251C196-A200 VanDerWaalsContact O-CB 3.26Å; C196-A200 WeakPolarHBondContact O-CB 3.43Å; C196-A200 PolarHBondContact O-N 3.46Å; I197-A200 PolarHBondContact O-N 3.04Å; A200-P204 VanDerWaalsContact O-CD 3.28Å; A200-P204 WeakPolarHBondContact O-CD 3.47Å; A200-I251 HydrophobicContact CB-CG1 4.41Å
201I88.7Confident85.6Confident84 Ų8439.9 Ų39.943%0.43123%0.23SC..Hα-helixtrans-68.4-42.7174.4-67.8167.5000110.6I197 A198 G199 P204 F205I197-I201 HydrophobicContact CG2-CD1 3.78Å; I197-I201 VanDerWaalsContact O-CG1 3.28Å; I197-I201 WeakPolarHBondContact O-CG1 3.37Å; I197-I201 PolarHBondContact O-N 3.25Å; A198-I201 PolarHBondContact O-N 3.03Å; G199-I201 VanDerWaalsContact C-N 3.33Å; G199-I201 PolarHBondContact O-N 3.18Å; I201-P204 VanDerWaalsContact O-CD 3.31Å; I201-P204 WeakPolarHBondContact O-CD 3.22Å; I201-P204 WeakPolarHBondContact O-CG 3.37Å; I201-F205 HydrophobicContact CG2-CE2 4.39Å; I201-F205 WeakPolarHBondContact O-CD2 3.22Å; I201-F205 WeakPolarHBondContact O-CE2 3.11Å
202A88.4Confident86.3Confident1 Ų138.5 Ų38.51%0.00822%0.218CC..Hα-helixtrans-74-31.4-17500000113.8V177 L178 A198 G199 F205 T206 T247V177-A202 HydrophobicContact CG1-CB 4.2Å; L178-A202 HydrophobicContact CD2-CB 4.49Å; A198-A202 VanDerWaalsContact O-CB 3.3Å; A198-A202 WeakPolarHBondContact O-CB 3.27Å; A198-A202 PolarHBondContact O-N 3.4Å; G199-A202 PolarHBondContact O-N 3.44Å; A202-F205 PolarHBondContact O-N 3.35Å; A202-T206 WeakPolarHBondContact O-CG2 3.33Å; A202-T206 PolarHBondContact O-N 2.85Å; A202-T247 HydrophobicContact CB-CG2 3.47Å; A202-T247 VanDerWaalsContact CB-CG2 3.47Å
203L89.9Confident86.8Confident52 Ų5236.8 Ų36.827%0.27221%0.209SC..Hα-helixtrans-52.2-51-176.8-173.7151.2000114.9G199 F205 T206 V207 L248 I251G199-L203 WeakPolarHBondContact O-CB 3.43Å; G199-L203 PolarHBondContact O-N 2.95Å; L203-F205 PolarHBondContact O-N 3.02Å; L203-T206 WeakPolarHBondContact CA-OG1 3.08Å; L203-T206 PolarHBondContact O-N 3.43Å; L203-T206 PolarHBondContact O-OG1 3.29Å; L203-V207 HydrophobicContact CD2-CG2 4.22Å; L203-V207 WeakPolarHBondContact O-CG2 3.44Å; L203-V207 PolarHBondContact O-N 3.39Å; L203-L248 HydrophobicContact CD1-CD2 3.94Å; L203-I251 HydrophobicContact CB-CD1 3.95Å; L203-I251 HydrophobicContact CD1-CD1 3.33Å; L203-I251 HydrophobicContact CG-CD1 4.28Å
204P89.8Confident87.2Confident62 Ų6233.4 Ų33.440%0.40319%0.188SC..Hα-helixtrans-60.1-36.6178.222.4-33.9000111.8A200 I201 L208A200-P204 VanDerWaalsContact O-CD 3.28Å; A200-P204 WeakPolarHBondContact O-CD 3.47Å; I201-P204 VanDerWaalsContact O-CD 3.31Å; I201-P204 WeakPolarHBondContact O-CD 3.22Å; I201-P204 WeakPolarHBondContact O-CG 3.37Å; P204-L208 WeakPolarHBondContact O-CB 3.47Å; P204-L208 VanDerWaalsContact O-CG 3.22Å; P204-L208 WeakPolarHBondContact O-CG 3.44Å; P204-L208 PolarHBondContact O-N 2.85Å
205F88.9Confident87.4Confident71 Ų7133 Ų3331%0.31118%0.184SC..Hα-helixtrans-72.4-38.7178.8-61.5-75.8000112.3V170 F173 I174 I201 A202 L203 L208 K209V170-F205 HydrophobicContact CG1-CB 4.17Å; V170-F205 HydrophobicContact CG1-CD1 4.25Å; F173-F205 HydrophobicContact CD1-CD2 4.46Å; F173-F205 HydrophobicContact CE1-CD2 4.14Å; F173-F205 AromaticContact CE1-CE2 3.91Å; F173-F205 HydrophobicContact CE1-CE2 3.91Å; F173-F205 HydrophobicContact CE1-CZ 4.2Å; I174-F205 HydrophobicContact CD1-CB 3.76Å; I174-F205 HydrophobicContact CG1-CB 3.6Å; I201-F205 HydrophobicContact CG2-CE2 4.39Å; I201-F205 WeakPolarHBondContact O-CD2 3.22Å; I201-F205 WeakPolarHBondContact O-CE2 3.11Å; A202-F205 PolarHBondContact O-N 3.35Å; L203-F205 PolarHBondContact O-N 3.02Å; F205-L208 PolarHBondContact O-N 3.05Å; F205-K209 WeakPolarHBondContact O-CB 3.41Å; F205-K209 PolarHBondContact O-N 3.29Å
206T89.1Confident87.4Confident2 Ų233.2 Ų33.21%0.01219%0.186CC..Hα-helixtrans-65.7-39.6176.757.10000111.7I174 A202 L203 K209 L210 N243 T247I174-T206 HydrophobicContact CD1-CG2 4.22Å; I174-T206 HydrophobicContact CG1-CG2 4.46Å; I174-T206 HydrophobicContact CG2-CG2 3.78Å; A202-T206 WeakPolarHBondContact O-CG2 3.33Å; A202-T206 PolarHBondContact O-N 2.85Å; L203-T206 WeakPolarHBondContact CA-OG1 3.08Å; L203-T206 PolarHBondContact O-N 3.43Å; L203-T206 PolarHBondContact O-OG1 3.29Å; T206-K209 PolarHBondContact O-N 2.95Å; T206-L210 WeakPolarHBondContact O-CB 3.4Å; T206-L210 PolarHBondContact O-N 3.06Å; T206-N243 HydrophobicContact CG2-CB 3.92Å; T206-T247 HydrophobicContact CG2-CG2 3.75Å
207V89Confident87.5Confident40 Ų4031.9 Ų31.924%0.24218%0.176CC..Hα-helixtrans-65.6-42.8174.9175.30000111.4L203 L210 L211 L244L203-V207 HydrophobicContact CD2-CG2 4.22Å; L203-V207 WeakPolarHBondContact O-CG2 3.44Å; L203-V207 PolarHBondContact O-N 3.39Å; V207-L210 PolarHBondContact O-N 2.94Å; V207-L211 HydrophobicContact CG1-CD1 4.19Å; V207-L211 WeakPolarHBondContact O-CG 3.44Å; V207-L211 PolarHBondContact O-N 3.32Å; V207-L244 HydrophobicContact CG2-CD1 3.97Å
208L86.7Confident87.2Confident102 Ų10230.1 Ų30.153%0.53417%0.165SC..Hα-helixtrans-63.6-43.5175.9-74.2173000112.4P204 F205 L210 L211 Y212P204-L208 WeakPolarHBondContact O-CB 3.47Å; P204-L208 VanDerWaalsContact O-CG 3.22Å; P204-L208 WeakPolarHBondContact O-CG 3.44Å; P204-L208 PolarHBondContact O-N 2.85Å; F205-L208 PolarHBondContact O-N 3.05Å; L208-L210 VanDerWaalsContact C-N 3.34Å; L208-L211 HydrophobicContact CD2-CD1 4.4Å; L208-L211 WeakPolarHBondContact O-CB 3.5Å; L208-L211 PolarHBondContact O-N 3.35Å; L208-Y212 PolarHBondContact O-N 3.19Å
209K86.8Confident86.6Confident4 Ų429.9 Ų29.92%0.01716%0.163CC..Hα-helixtrans-60-45.4174.4-179.1179171.1-177.80110.7S171 I174 F205 T206 L211 Y212 E213S171-K209 WeakPolarHBondContact OG-CE 3.31Å; S171-K209 PolarHBondContact OG-NZ 3.47Å; I174-K209 HydrophobicContact CD1-CB 4.09Å; I174-K209 HydrophobicContact CD1-CD 3.83Å; F205-K209 WeakPolarHBondContact O-CB 3.41Å; F205-K209 PolarHBondContact O-N 3.29Å; T206-K209 PolarHBondContact O-N 2.95Å; K209-L211 VanDerWaalsContact C-N 3.35Å; K209-L211 PolarHBondContact O-N 3.42Å; K209-Y212 WeakPolarHBondContact O-CB 3.23Å; K209-Y212 PolarHBondContact O-N 2.82Å; K209-E213 HydrophobicContact CG-CG 4.37Å; K209-E213 WeakPolarHBondContact O-CG 3.34Å; K209-E213 PolarHBondContact O-N 3.29Å
210L89.4Confident85.7Confident0 Ų032.2 Ų32.20%019%0.188CC..Hα-helixtrans-60.8-43.6177-18063.2000111.8F146 V149 T206 V207 L208 Y212 E213 V214 L237 C240 L244F146-L210 HydrophobicContact CD2-CD1 3.58Å; F146-L210 HydrophobicContact CD2-CD2 3.78Å; F146-L210 HydrophobicContact CD2-CG 4.31Å; F146-L210 HydrophobicContact CE2-CD1 3.49Å; F146-L210 VanDerWaalsContact CE2-CD1 3.49Å; V149-L210 HydrophobicContact CB-CD2 4.02Å; V149-L210 HydrophobicContact CB-CG 4.37Å; V149-L210 HydrophobicContact CG1-CD2 4.07Å; V149-L210 HydrophobicContact CG1-CG 3.85Å; V149-L210 HydrophobicContact CG2-CD2 4.01Å; T206-L210 WeakPolarHBondContact O-CB 3.4Å; T206-L210 PolarHBondContact O-N 3.06Å; V207-L210 PolarHBondContact O-N 2.94Å; L208-L210 VanDerWaalsContact C-N 3.34Å; L210-Y212 VanDerWaalsContact C-N 3.28Å; L210-Y212 PolarHBondContact O-N 2.96Å; L210-E213 PolarHBondContact O-N 3.05Å; L210-V214 HydrophobicContact CD1-CG2 3.77Å; L210-V214 HydrophobicContact CG-CG2 4.23Å; L210-V214 WeakPolarHBondContact O-CB 2.86Å; L210-V214 VanDerWaalsContact O-CG2 3.24Å; L210-V214 WeakPolarHBondContact O-CG2 3.41Å; L210-V214 PolarHBondContact O-N 2.96Å; L210-L237 HydrophobicContact CD1-CD1 3.87Å; L210-C240 HydrophobicContact CB-CB 4.3Å; L210-C240 HydrophobicContact CD1-CB 3.72Å; L210-L244 HydrophobicContact CD2-CD2 4.14Å
211L88.4Confident84.5Confident34 Ų3430.3 Ų30.318%0.17817%0.173CC..Hα-helixtrans-58.6-43.4175.8-78.1160.6000111.4V149 I153 V207 L208 K209 K215V149-L211 HydrophobicContact CG1-CD2 3.71Å; V149-L211 HydrophobicContact CG1-CG 3.95Å; V149-L211 HydrophobicContact CG2-CD2 4.45Å; V149-L211 HydrophobicContact CG2-CG 4.5Å; I153-L211 HydrophobicContact CD1-CB 4.37Å; I153-L211 HydrophobicContact CD1-CD2 3.91Å; I153-L211 WeakPolarHBondContact CD1-O 3.33Å; I153-L211 HydrophobicContact CG1-CD2 3.98Å; V207-L211 HydrophobicContact CG1-CD1 4.19Å; V207-L211 WeakPolarHBondContact O-CG 3.44Å; V207-L211 PolarHBondContact O-N 3.32Å; L208-L211 HydrophobicContact CD2-CD1 4.4Å; L208-L211 WeakPolarHBondContact O-CB 3.5Å; L208-L211 PolarHBondContact O-N 3.35Å; K209-L211 VanDerWaalsContact C-N 3.35Å; K209-L211 PolarHBondContact O-N 3.42Å; L211-K215 WeakPolarHBondContact O-CB 3.49Å; L211-K215 PolarHBondContact O-N 3.22Å; L211-K215 VanDerWaalsContact O-N 3.12Å
212Y86.3Confident83.3Confident13 Ų1334 Ų345%0.05119%0.186CC..Hα-helixtrans-64.8-49.5179.5-174.7-86.7000112.2F160 T161 Y164 N167 L208 K209 L210 K215 M216F160-Y212 HydrophobicContact CB-CD2 4.42Å; F160-Y212 WeakPolarHBondContact O-CE2 3.24Å; T161-Y212 VanDerWaalsContact CA-CE2 3.48Å; T161-Y212 HydrophobicContact CG2-CE2 4.46Å; T161-Y212 PolarHBondContact O-OH 2.96Å; T161-Y212 VanDerWaalsContact O-OH 3.07Å; Y164-Y212 WeakPolarHBondContact CA-OH 3.35Å; Y164-Y212 VanDerWaalsContact CB-OH 3.22Å; Y164-Y212 WeakPolarHBondContact CB-OH 3.09Å; Y164-Y212 HydrophobicContact CD2-CE1 4.07Å; Y164-Y212 WeakPolarHBondContact CD2-OH 3.37Å; Y164-Y212 PolarHBondContact N-OH 3.04Å; N167-Y212 HydrophobicContact CB-CD1 3.68Å; N167-Y212 HydrophobicContact CB-CD2 4.13Å; N167-Y212 HydrophobicContact CB-CE1 3.7Å; N167-Y212 HydrophobicContact CB-CE2 4.15Å; N167-Y212 HydrophobicContact CB-CG 3.93Å; N167-Y212 WeakPolarHBondContact ND2-CD1 3.41Å; N167-Y212 VanDerWaalsContact ND2-CE1 3.33Å; N167-Y212 WeakPolarHBondContact ND2-CE1 3.43Å; L208-Y212 PolarHBondContact O-N 3.19Å; K209-Y212 WeakPolarHBondContact O-CB 3.23Å; K209-Y212 PolarHBondContact O-N 2.82Å; L210-Y212 VanDerWaalsContact C-N 3.28Å; L210-Y212 PolarHBondContact O-N 2.96Å; Y212-K215 WeakPolarHBondContact O-CB 3.49Å; Y212-K215 PolarHBondContact O-N 3.35Å; Y212-M216 HydrophobicContact CD1-CE 3.74Å; Y212-M216 HydrophobicContact CD1-CG 4.35Å; Y212-M216 HydrophobicContact CD1-SD 4.19Å; Y212-M216 HydrophobicContact CE1-CE 3.32Å; Y212-M216 HydrophobicContact CE1-CG 3.89Å; Y212-M216 HydrophobicContact CE1-SD 3.33Å; Y212-M216 WeakPolarHBondContact CE1-SD 3.32Å; Y212-M216 PolarHBondContact O-N 3.47Å
213E87.7Confident82.2Confident12 Ų1238.7 Ų38.76%0.05621%0.207CC..Hα-helixtrans-67.1-43.4-177.1-67.6-61157.700112.1N167 K209 L210 K215 M216 V217 Y225 V236N167-E213 PolarHBondContact ND2-OE1 3.18Å; K209-E213 HydrophobicContact CG-CG 4.37Å; K209-E213 WeakPolarHBondContact O-CG 3.34Å; K209-E213 PolarHBondContact O-N 3.29Å; L210-E213 PolarHBondContact O-N 3.05Å; E213-K215 VanDerWaalsContact C-N 3.27Å; E213-K215 PolarHBondContact O-N 3.46Å; E213-M216 PolarHBondContact O-N 3.45Å; E213-M216 WeakPolarHBondContact OE1-CE 3.35Å; E213-M216 WeakPolarHBondContact OE2-CE 3.38Å; E213-V217 WeakPolarHBondContact O-CG2 3.37Å; E213-V217 PolarHBondContact O-N 3.27Å; E213-Y225 PolarHBondContact OE2-OH 3.12Å; E213-V236 HydrophobicContact CB-CG1 4.38Å; E213-V236 HydrophobicContact CG-CG1 3.77Å; E213-V236 VanDerWaalsContact OE2-CG1 3.23Å; E213-V236 WeakPolarHBondContact OE2-CG1 3.43Å
214V89Confident81.5Confident2 Ų240.4 Ų40.41%0.01221%0.209CC..Hα-helixtrans-60.1-39.6174.3172.50000110.5V149 I150 I153 L210 M216 V217 F218 L237V149-V214 HydrophobicContact CG1-CG2 4.36Å; I150-V214 HydrophobicContact CG1-CG1 4.01Å; I150-V214 HydrophobicContact CG1-CG2 4.33Å; I153-V214 HydrophobicContact CB-CG1 4.22Å; I153-V214 HydrophobicContact CD1-CB 3.49Å; I153-V214 VanDerWaalsContact CD1-CB 3.49Å; I153-V214 HydrophobicContact CD1-CG1 3.46Å; I153-V214 VanDerWaalsContact CD1-CG1 3.46Å; I153-V214 HydrophobicContact CG1-CG1 4.45Å; I153-V214 HydrophobicContact CG2-CG1 4.23Å; L210-V214 HydrophobicContact CD1-CG2 3.77Å; L210-V214 HydrophobicContact CG-CG2 4.23Å; L210-V214 WeakPolarHBondContact O-CB 2.86Å; L210-V214 VanDerWaalsContact O-CG2 3.24Å; L210-V214 WeakPolarHBondContact O-CG2 3.41Å; L210-V214 PolarHBondContact O-N 2.96Å; V214-M216 VanDerWaalsContact C-N 3.32Å; V214-M216 PolarHBondContact O-N 2.83Å; V214-V217 PolarHBondContact O-N 3.33Å; V214-F218 HydrophobicContact CG1-CD2 3.71Å; V214-F218 HydrophobicContact CG1-CE2 3.88Å; V214-F218 WeakPolarHBondContact O-CD2 3.49Å; V214-F218 PolarHBondContact O-N 3.2Å; V214-L237 HydrophobicContact CG2-CD1 3.48Å; V214-L237 VanDerWaalsContact CG2-CD1 3.48Å
215K86.3Confident81Confident14 Ų1439.3 Ų39.36%0.06120%0.197CC..Hα-helixtrans-65-33.8175.3-171.769.2176.2-170.50112.1I153 L156 F158 T161 L211 Y212 E213 G219I153-K215 HydrophobicContact CD1-CB 4.39Å; I153-K215 HydrophobicContact CG2-CB 4.36Å; I153-K215 HydrophobicContact CG2-CD 3.78Å; L156-K215 PolarHBondContact O-NZ 2.72Å; F158-K215 VanDerWaalsContact O-CE 3.27Å; F158-K215 WeakPolarHBondContact O-CE 3.46Å; F158-K215 PolarHBondContact O-NZ 3.43Å; T161-K215 HydrophobicContact CG2-CG 4.22Å; L211-K215 WeakPolarHBondContact O-CB 3.49Å; L211-K215 PolarHBondContact O-N 3.22Å; L211-K215 VanDerWaalsContact O-N 3.12Å; Y212-K215 WeakPolarHBondContact O-CB 3.49Å; Y212-K215 PolarHBondContact O-N 3.35Å; E213-K215 VanDerWaalsContact C-N 3.27Å; E213-K215 PolarHBondContact O-N 3.46Å; K215-G219 CarbonylContact O-C 3.46Å; K215-G219 WeakPolarHBondContact O-CA 3.3Å; K215-G219 PolarHBondContact O-N 3.43Å
216M83.6Confident80.5Confident6 Ų641.8 Ų41.83%0.0321%0.21CC..Hα-helixtrans-70.4-31.6174-72.5-161.6-58.500113.2T161 Y164 Y212 E213 V214 F223 Y225T161-M216 HydrophobicContact CG2-CG 3.51Å; Y164-M216 HydrophobicContact CD2-SD 4.03Å; Y164-M216 HydrophobicContact CE2-CE 4.41Å; Y164-M216 HydrophobicContact CE2-SD 4.26Å; Y212-M216 HydrophobicContact CD1-CE 3.74Å; Y212-M216 HydrophobicContact CD1-CG 4.35Å; Y212-M216 HydrophobicContact CD1-SD 4.19Å; Y212-M216 HydrophobicContact CE1-CE 3.32Å; Y212-M216 HydrophobicContact CE1-CG 3.89Å; Y212-M216 HydrophobicContact CE1-SD 3.33Å; Y212-M216 WeakPolarHBondContact CE1-SD 3.32Å; Y212-M216 PolarHBondContact O-N 3.47Å; E213-M216 PolarHBondContact O-N 3.45Å; E213-M216 WeakPolarHBondContact OE1-CE 3.35Å; E213-M216 WeakPolarHBondContact OE2-CE 3.38Å; V214-M216 VanDerWaalsContact C-N 3.32Å; V214-M216 PolarHBondContact O-N 2.83Å; M216-F223 HydrophobicContact SD-CB 4.34Å; M216-Y225 HydrophobicContact CB-CD2 3.79Å; M216-Y225 HydrophobicContact CB-CE2 3.61Å; M216-Y225 HydrophobicContact CE-CE2 3.84Å; M216-Y225 WeakPolarHBondContact CE-OH 3.37Å; M216-Y225 PolarHBondContact O-N 3.45Å
217V86Confident79.8Confident4 Ų448 Ų482%0.02424%0.239CC..Hα-helixtrans-72.3-55.4176.5175.50000111.5T43 V46 E213 V214 G219 Y225 A233T43-V217 HydrophobicContact CG2-CG1 4.28Å; V46-V217 HydrophobicContact CB-CG1 4.11Å; V46-V217 HydrophobicContact CG1-CG1 3.76Å; V46-V217 HydrophobicContact CG1-CG2 4.2Å; E213-V217 WeakPolarHBondContact O-CG2 3.37Å; E213-V217 PolarHBondContact O-N 3.27Å; V214-V217 PolarHBondContact O-N 3.33Å; V217-G219 PolarHBondContact O-N 2.96Å; V217-Y225 HydrophobicContact CG2-CD2 3.89Å; V217-Y225 HydrophobicContact CG2-CE2 4.04Å; V217-A233 HydrophobicContact CG2-CB 4.22Å
218F80.9Confident79.3Confident64 Ų6449 Ų4928%0.28125%0.252SS..Hα-helixtrans-66-28.2176.1-80.5-102.8000111.5T43 L47 I150 V214 R224T43-F218 HydrophobicContact CG2-CD1 4.06Å; T43-F218 HydrophobicContact CG2-CD2 4.07Å; T43-F218 HydrophobicContact CG2-CE1 3.94Å; T43-F218 HydrophobicContact CG2-CE2 3.95Å; T43-F218 HydrophobicContact CG2-CG 4.13Å; T43-F218 HydrophobicContact CG2-CZ 3.88Å; L47-F218 HydrophobicContact CD1-CE2 4.21Å; L47-F218 HydrophobicContact CD1-CZ 4Å; I150-F218 HydrophobicContact CG2-CE2 3.98Å; I150-F218 HydrophobicContact CG2-CZ 3.62Å; V214-F218 HydrophobicContact CG1-CD2 3.71Å; V214-F218 HydrophobicContact CG1-CE2 3.88Å; V214-F218 WeakPolarHBondContact O-CD2 3.49Å; V214-F218 PolarHBondContact O-N 3.2Å; F218-R224 PolarHBondContact O-NH2 2.78Å
219G71.5Confident79Confident6 Ų644.6 Ų44.66%0.06223%0.229CC..  trans76.7-154-177.800000113.4K215 V217K215-G219 CarbonylContact O-C 3.46Å; K215-G219 WeakPolarHBondContact O-CA 3.3Å; K215-G219 PolarHBondContact O-N 3.43Å; V217-G219 PolarHBondContact O-N 2.96Å
220G65.1Low78.9Confident50 Ų5046.2 Ų46.252%0.51524%0.237SC..  trans102.2-19.4-175.500000114D159D159-G220 VanDerWaalsContact OD1-C 3.32Å
221G63.6Low78.8Confident13 Ų1346.7 Ų46.713%0.13424%0.24CC..SBendtrans-112.7-170.8176.200000115.1D159 T161 F223D159-G221 VanDerWaalsContact OD1-CA 3.22Å; D159-G221 WeakPolarHBondContact OD1-CA 3.4Å; D159-G221 PolarHBondContact OD1-N 2.98Å; T161-G221 VanDerWaalsContact OG1-CA 3.29Å; T161-G221 WeakPolarHBondContact OG1-CA 3.46Å; G221-F223 PolarHBondContact O-N 3.37Å
222K62.9Low78.7Confident162 Ų16245.9 Ų45.970%0.70424%0.236SC*.SBendtrans-63.7-38.4-172.2-78-167.6176.3-1740114.1T161 K162T161-K222 PolarHBondContact OG1-N 3.18Å; K162-K222 HydrophobicContact CG-CD 4.28Å
223F65.4Low78.8Confident100 Ų10045.2 Ų45.244%0.43923%0.233SC..  trans-106.5130.1179.2-64.7-83.4000109.2T161 M216 G221T161-F223 WeakPolarHBondContact O-CD2 3.48Å; M216-F223 HydrophobicContact SD-CB 4.34Å; G221-F223 PolarHBondContact O-N 3.37Å
224R74.8Confident78.9Confident87 Ų8744.7 Ų44.733%0.32823%0.231SC..  trans-140.9148-179.1-61.6-177.467.2149.910.5108.6F218F218-R224 PolarHBondContact O-NH2 2.78Å
225Y79.1Confident78.9Confident39 Ų3944.9 Ų44.915%0.15323%0.233CC..  trans-67.3137.8168.7-71.4-69.3000110.3E213 M216 V217 D229 L232 A233E213-Y225 PolarHBondContact OE2-OH 3.12Å; M216-Y225 HydrophobicContact CB-CD2 3.79Å; M216-Y225 HydrophobicContact CB-CE2 3.61Å; M216-Y225 HydrophobicContact CE-CE2 3.84Å; M216-Y225 WeakPolarHBondContact CE-OH 3.37Å; M216-Y225 PolarHBondContact O-N 3.45Å; V217-Y225 HydrophobicContact CG2-CD2 3.89Å; V217-Y225 HydrophobicContact CG2-CE2 4.04Å; Y225-D229 HydrophobicContact CD1-CB 4.01Å; Y225-L232 HydrophobicContact CE1-CD2 4.29Å; Y225-L232 HydrophobicContact CE1-CG 4.21Å; Y225-A233 HydrophobicContact CD1-CB 4.19Å; Y225-A233 HydrophobicContact CD2-CB 3.84Å; Y225-A233 HydrophobicContact CE2-CB 4.23Å; Y225-A233 HydrophobicContact CG-CB 3.82Å
226E78.7Confident79.1Confident124 Ų12445.3 Ų45.358%0.57924%0.237SC*.  trans-80161.8172-68.2-177.6178.800110.5F42 A228 D229F42-E226 WeakPolarHBondContact CE2-O 3.21Å; E226-A228 PolarHBondContact O-N 2.98Å; E226-D229 WeakPolarHBondContact O-CA 3.36Å; E226-D229 WeakPolarHBondContact O-CB 3.29Å; E226-D229 PolarHBondContact O-N 3.27Å
227Q75.4Confident79.4Confident131 Ų13145.1 Ų45.161%0.61224%0.236SC*.G310 helixtrans-62.2-27.8178.7-165.8167.14.900112.6F42 D229 L230F42-Q227 HydrophobicContact CD2-CB 4.49Å; F42-Q227 HydrophobicContact CD2-CG 4.27Å; Q227-D229 PolarHBondContact O-N 3.5Å; Q227-L230 PolarHBondContact O-N 3.2Å
228A76.9Confident79.7Confident63 Ų6345 Ų4552%0.52124%0.235SC..G310 helixtrans-67.1-19.6172.200000113.3E226 L230E226-A228 PolarHBondContact O-N 2.98Å; A228-L230 VanDerWaalsContact C-N 3.34Å
229D81.4Confident80.1Confident8 Ų842.5 Ų42.54%0.04323%0.225CC..G310 helixtrans-94.818.2-178.8-67.2-31.1000112.4R103 Y225 E226 Q227 V231 L232 A233R103-D229 WeakPolarHBondContact CG-OD1 3.16Å; R103-D229 IonicContact CZ-OD1 3.26Å; R103-D229 VanDerWaalsContact CZ-OD1 3.26Å; R103-D229 IonicContact CZ-OD2 3.78Å; R103-D229 IonicContact NE-OD1 2.67Å; R103-D229 PolarHBondContact NE-OD1 3.01Å; R103-D229 IonicContact NE-OD2 3.95Å; R103-D229 IonicContact NH2-OD1 3.07Å; R103-D229 PolarHBondContact NH2-OD1 3.38Å; R103-D229 VanDerWaalsContact NH2-OD1 3.07Å; R103-D229 IonicContact NH2-OD2 2.86Å; R103-D229 PolarHBondContact NH2-OD2 3.02Å; Y225-D229 HydrophobicContact CD1-CB 4.01Å; E226-D229 WeakPolarHBondContact O-CA 3.36Å; E226-D229 WeakPolarHBondContact O-CB 3.29Å; E226-D229 PolarHBondContact O-N 3.27Å; Q227-D229 PolarHBondContact O-N 3.5Å; D229-V231 VanDerWaalsContact C-N 3.33Å; D229-V231 PolarHBondContact O-N 2.86Å; D229-L232 HydrophobicContact CB-CB 4.01Å; D229-L232 HydrophobicContact CB-CD2 3.98Å; D229-L232 HydrophobicContact CB-CG 4.45Å; D229-L232 WeakPolarHBondContact O-CB 3.05Å; D229-L232 PolarHBondContact O-N 3.39Å; D229-L232 VanDerWaalsContact O-N 3.12Å; D229-A233 VanDerWaalsContact O-CB 3.31Å; D229-A233 WeakPolarHBondContact O-CB 3.36Å; D229-A233 PolarHBondContact O-N 2.88Å
230L85.2Confident81Confident39 Ų3942.3 Ų42.320%0.20422%0.222CC..Hα-helixtrans-55.5-46.3-178.8-178149.6000112.6F42 N45 V46 I49 Q227 A228 A234F42-L230 HydrophobicContact CD2-CB 4.24Å; F42-L230 HydrophobicContact CD2-CD1 4.21Å; F42-L230 HydrophobicContact CD2-CG 4.46Å; F42-L230 HydrophobicContact CE2-CB 3.77Å; F42-L230 HydrophobicContact CE2-CG 4.32Å; N45-L230 HydrophobicContact CB-CD1 3.75Å; N45-L230 HydrophobicContact CB-CG 4.46Å; V46-L230 HydrophobicContact CG2-CG 4.18Å; I49-L230 HydrophobicContact CD1-CD2 3.34Å; Q227-L230 PolarHBondContact O-N 3.2Å; A228-L230 VanDerWaalsContact C-N 3.34Å; L230-A234 PolarHBondContact O-N 2.8Å; L230-A234 VanDerWaalsContact O-N 3.13Å
231V86.5Confident82.3Confident10 Ų1040 Ų406%0.06120%0.198CC..Hα-helixtrans-71.6-36.5178.3179.80000111.1W95 N108 I109 L112 D229 A234 G235W95-V231 HydrophobicContact CH2-CG1 4.09Å; W95-V231 HydrophobicContact CZ2-CG1 4.14Å; W95-V231 WeakPolarHBondContact CZ2-O 3.44Å; N108-V231 HydrophobicContact CB-CB 4.18Å; N108-V231 HydrophobicContact CB-CG1 3.95Å; N108-V231 HydrophobicContact CB-CG2 4.3Å; I109-V231 HydrophobicContact CD1-CG2 4.12Å; L112-V231 HydrophobicContact CB-CG1 4.24Å; L112-V231 HydrophobicContact CD1-CG1 3.7Å; D229-V231 VanDerWaalsContact C-N 3.33Å; D229-V231 PolarHBondContact O-N 2.86Å; V231-A234 PolarHBondContact O-N 2.89Å; V231-G235 PolarHBondContact O-N 3.38Å
232L86.9Confident83.6Confident16 Ų1640.2 Ų40.28%0.08420%0.195CC..Hα-helixtrans-59.7-52.117617558.8000110.3P99 S102 Y225 D229 A234 G235 V236P99-L232 HydrophobicContact CB-CD2 4.14Å; S102-L232 WeakPolarHBondContact OG-CA 3.45Å; S102-L232 WeakPolarHBondContact OG-CB 3.21Å; S102-L232 PolarHBondContact OG-N 3.38Å; S102-L232 VanDerWaalsContact OG-N 3.13Å; Y225-L232 HydrophobicContact CE1-CD2 4.29Å; Y225-L232 HydrophobicContact CE1-CG 4.21Å; D229-L232 HydrophobicContact CB-CB 4.01Å; D229-L232 HydrophobicContact CB-CD2 3.98Å; D229-L232 HydrophobicContact CB-CG 4.45Å; D229-L232 WeakPolarHBondContact O-CB 3.05Å; D229-L232 PolarHBondContact O-N 3.39Å; D229-L232 VanDerWaalsContact O-N 3.12Å; L232-A234 PolarHBondContact O-N 3.4Å; L232-G235 PolarHBondContact O-N 3.39Å; L232-V236 HydrophobicContact CD1-CG2 4.14Å; L232-V236 VanDerWaalsContact O-CG2 3.29Å; L232-V236 WeakPolarHBondContact O-CG2 3.37Å; L232-V236 PolarHBondContact O-N 3.34Å
233A88.5Confident84.9Confident0 Ų032.6 Ų32.60%016%0.162CC..Hα-helixtrans-60.6-43.7-179.900000111.7F42 V46 V217 Y225 D229 V236 L237F42-A233 HydrophobicContact CZ-CB 4.25Å; V46-A233 HydrophobicContact CG1-CB 3.98Å; V46-A233 HydrophobicContact CG2-CB 3.94Å; V217-A233 HydrophobicContact CG2-CB 4.22Å; Y225-A233 HydrophobicContact CD1-CB 4.19Å; Y225-A233 HydrophobicContact CD2-CB 3.84Å; Y225-A233 HydrophobicContact CE2-CB 4.23Å; Y225-A233 HydrophobicContact CG-CB 3.82Å; D229-A233 VanDerWaalsContact O-CB 3.31Å; D229-A233 WeakPolarHBondContact O-CB 3.36Å; D229-A233 PolarHBondContact O-N 2.88Å; A233-V236 PolarHBondContact O-N 3Å; A233-L237 VanDerWaalsContact O-CB 3.27Å; A233-L237 WeakPolarHBondContact O-CB 3.1Å; A233-L237 PolarHBondContact O-N 3.47Å
234A89.9Confident86.1Confident0 Ų027.8 Ų27.80%014%0.141CC..Hα-helixtrans-63.3-46176.700000111.9V46 I49 L230 V231 L232 V236 L237 Y238V46-A234 HydrophobicContact CG1-CB 4.28Å; I49-A234 HydrophobicContact CB-CB 3.81Å; I49-A234 HydrophobicContact CD1-CB 4.42Å; I49-A234 HydrophobicContact CG2-CB 3.62Å; L230-A234 PolarHBondContact O-N 2.8Å; L230-A234 VanDerWaalsContact O-N 3.13Å; V231-A234 PolarHBondContact O-N 2.89Å; L232-A234 PolarHBondContact O-N 3.4Å; A234-V236 PolarHBondContact O-N 3.27Å; A234-L237 PolarHBondContact O-N 2.96Å; A234-Y238 WeakPolarHBondContact O-CB 3.42Å; A234-Y238 PolarHBondContact O-N 2.9Å
235G89.3Confident87Confident6 Ų623.8 Ų23.86%0.06213%0.126CC..Hα-helixtrans-62.5-41177.400000113.3V231 L232 N239V231-G235 PolarHBondContact O-N 3.38Å; L232-G235 PolarHBondContact O-N 3.39Å; G235-N239 WeakPolarHBondContact O-CB 3.4Å; G235-N239 PolarHBondContact O-N 3.17Å
236V88.5Confident87.4Confident24 Ų2422.4 Ų22.415%0.14512%0.121CC..Hα-helixtrans-66.7-42.4176.9172.40000111.2E213 L232 A233 A234 N239 C240E213-V236 HydrophobicContact CB-CG1 4.38Å; E213-V236 HydrophobicContact CG-CG1 3.77Å; E213-V236 VanDerWaalsContact OE2-CG1 3.23Å; E213-V236 WeakPolarHBondContact OE2-CG1 3.43Å; L232-V236 HydrophobicContact CD1-CG2 4.14Å; L232-V236 VanDerWaalsContact O-CG2 3.29Å; L232-V236 WeakPolarHBondContact O-CG2 3.37Å; L232-V236 PolarHBondContact O-N 3.34Å; A233-V236 PolarHBondContact O-N 3Å; A234-V236 PolarHBondContact O-N 3.27Å; V236-N239 WeakPolarHBondContact O-CB 3.34Å; V236-N239 PolarHBondContact O-N 3.24Å; V236-C240 PolarHBondContact O-N 3.46Å; V236-C240 PolarHBondContact O-SG 3.01Å
237L91.4Very high88Confident2 Ų216.5 Ų16.51%0.019%0.093CC..Hα-helixtrans-66.4-41.2178.7-170.462.9000111.4V46 L47 T50 F146 L210 V214 A233 A234 N239 C240 W241V46-L237 HydrophobicContact CG1-CD2 4.34Å; L47-L237 HydrophobicContact CD2-CD2 3.78Å; T50-L237 HydrophobicContact CG2-CB 4.29Å; T50-L237 HydrophobicContact CG2-CD2 4.1Å; T50-L237 HydrophobicContact CG2-CG 4.02Å; F146-L237 HydrophobicContact CE2-CD1 3.71Å; F146-L237 HydrophobicContact CE2-CD2 4.47Å; F146-L237 HydrophobicContact CE2-CG 3.85Å; F146-L237 HydrophobicContact CZ-CD1 3.84Å; F146-L237 HydrophobicContact CZ-CD2 3.79Å; F146-L237 HydrophobicContact CZ-CG 3.64Å; L210-L237 HydrophobicContact CD1-CD1 3.87Å; V214-L237 HydrophobicContact CG2-CD1 3.48Å; V214-L237 VanDerWaalsContact CG2-CD1 3.48Å; A233-L237 VanDerWaalsContact O-CB 3.27Å; A233-L237 WeakPolarHBondContact O-CB 3.1Å; A233-L237 PolarHBondContact O-N 3.47Å; A234-L237 PolarHBondContact O-N 2.96Å; L237-N239 VanDerWaalsContact C-N 3.34Å; L237-N239 PolarHBondContact O-N 2.8Å; L237-C240 WeakPolarHBondContact O-CB 3.25Å; L237-C240 PolarHBondContact O-N 3.18Å; L237-W241 PolarHBondContact O-N 3.31Å; L237-W241 VanDerWaalsContact O-N 3.12Å
238Y91.8Very high88.7Confident1 Ų111 Ų110%0.0047%0.068CC..Hα-helixtrans-58.1-46.2171.7173.5-100.4000111.9Q53 F54 T57 S119 A234 C240 W241 W242Q53-Y238 HydrophobicContact CB-CD2 3.32Å; Q53-Y238 HydrophobicContact CB-CE2 3.59Å; Q53-Y238 HydrophobicContact CB-CG 3.98Å; Q53-Y238 HydrophobicContact CG-CD2 4.31Å; Q53-Y238 VanDerWaalsContact OE1-CB 3.29Å; F54-Y238 AromaticContact CD1-CD2 3.66Å; F54-Y238 HydrophobicContact CD1-CD2 3.66Å; F54-Y238 AromaticContact CD1-CE2 3.97Å; F54-Y238 HydrophobicContact CD1-CE2 3.97Å; F54-Y238 AromaticContact CE1-CD2 3.7Å; F54-Y238 HydrophobicContact CE1-CD2 3.7Å; F54-Y238 HydrophobicContact CE1-CE2 4.36Å; T57-Y238 WeakPolarHBondContact OG1-CE2 3.4Å; T57-Y238 PolarHBondContact OG1-OH 3.36Å; S119-Y238 WeakPolarHBondContact CB-OH 3.27Å; S119-Y238 WeakPolarHBondContact OG-CE1 3.46Å; S119-Y238 PolarHBondContact OG-OH 3.4Å; A234-Y238 WeakPolarHBondContact O-CB 3.42Å; A234-Y238 PolarHBondContact O-N 2.9Å; Y238-C240 VanDerWaalsContact C-N 3.3Å; Y238-C240 PolarHBondContact O-N 3.33Å; Y238-W241 HydrophobicContact CD2-CE3 4.15Å; Y238-W241 HydrophobicContact CD2-CZ3 4.48Å; Y238-W241 AromaticContact CE2-CE3 3.87Å; Y238-W241 HydrophobicContact CE2-CE3 3.87Å; Y238-W241 AromaticContact CE2-CZ3 3.77Å; Y238-W241 HydrophobicContact CE2-CZ3 3.77Å; Y238-W241 PolarHBondContact O-N 3.47Å; Y238-W242 WeakPolarHBondContact O-CB 3.2Å; Y238-W242 PolarHBondContact O-N 3.39Å
239N89.4Confident89.3Confident12 Ų128 Ų86%0.0644%0.043CC..Hα-helixtrans-61.7-36.8176.8179.740.2000112.6Y88 Q92 G235 V236 L237 W242 N243Y88-N239 PolarHBondContact OH-OD1 3.31Å; Y88-N239 VanDerWaalsContact OH-OD1 3.06Å; Q92-N239 VanDerWaalsContact CD-ND2 3.3Å; Q92-N239 PolarHBondContact NE2-ND2 3.27Å; Q92-N239 PolarHBondContact NE2-OD1 3.21Å; Q92-N239 PolarHBondContact OE1-OD1 3.17Å; G235-N239 WeakPolarHBondContact O-CB 3.4Å; G235-N239 PolarHBondContact O-N 3.17Å; V236-N239 WeakPolarHBondContact O-CB 3.34Å; V236-N239 PolarHBondContact O-N 3.24Å; L237-N239 VanDerWaalsContact C-N 3.34Å; L237-N239 PolarHBondContact O-N 2.8Å; N239-W242 PolarHBondContact O-N 3.36Å; N239-N243 WeakPolarHBondContact O-CB 3.44Å; N239-N243 PolarHBondContact O-N 2.82Å; N239-N243 PolarHBondContact O-ND2 3.24Å; N239-N243 PolarHBondContact OD1-ND2 3.31Å
240C91.2Very high89.6Confident1 Ų17.8 Ų7.81%0.0074%0.042CC..Hα-helixtrans-63-43.9174.9-66.80000111.7L210 V236 L237 Y238 L244L210-C240 HydrophobicContact CB-CB 4.3Å; L210-C240 HydrophobicContact CD1-CB 3.72Å; V236-C240 PolarHBondContact O-N 3.46Å; V236-C240 PolarHBondContact O-SG 3.01Å; L237-C240 WeakPolarHBondContact O-CB 3.25Å; L237-C240 PolarHBondContact O-N 3.18Å; Y238-C240 VanDerWaalsContact C-N 3.3Å; Y238-C240 PolarHBondContact O-N 3.33Å; C240-L244 WeakPolarHBondContact O-CB 3.43Å; C240-L244 PolarHBondContact O-N 3.42Å
241W91.6Very high89.8Confident1 Ų18.6 Ų8.60%0.0045%0.046CC..Hα-helixtrans-66.9-40.5174.8169.884.3000112.4F54 T57 F139 S142 F146 L237 Y238 N243 L244 F245F54-W241 HydrophobicContact CD1-CB 4.48Å; F54-W241 AromaticContact CD1-CD2 3.44Å; F54-W241 HydrophobicContact CD1-CD2 3.44Å; F54-W241 VanDerWaalsContact CD1-CD2 3.44Å; F54-W241 AromaticContact CD1-CE3 3.32Å; F54-W241 HydrophobicContact CD1-CE3 3.32Å; F54-W241 AromaticContact CD1-CG 3.96Å; F54-W241 HydrophobicContact CD1-CG 3.96Å; F54-W241 HydrophobicContact CD1-CH2 4.35Å; F54-W241 HydrophobicContact CD1-CZ2 4.44Å; F54-W241 AromaticContact CD1-CZ3 3.8Å; F54-W241 HydrophobicContact CD1-CZ3 3.8Å; F54-W241 HydrophobicContact CD2-CD2 4.44Å; F54-W241 HydrophobicContact CD2-CG 4.49Å; F54-W241 HydrophobicContact CE1-CB 3.37Å; F54-W241 AromaticContact CE1-CD2 3.19Å; F54-W241 HydrophobicContact CE1-CD2 3.19Å; F54-W241 AromaticContact CE1-CE3 3.29Å; F54-W241 HydrophobicContact CE1-CE3 3.29Å; F54-W241 AromaticContact CE1-CG 3.23Å; F54-W241 HydrophobicContact CE1-CG 3.23Å; F54-W241 HydrophobicContact CE1-CZ3 4.23Å; F54-W241 HydrophobicContact CE2-CB 4.28Å; F54-W241 AromaticContact CE2-CD1 3.88Å; F54-W241 HydrophobicContact CE2-CD2 4.22Å; F54-W241 AromaticContact CE2-CG 3.84Å; F54-W241 HydrophobicContact CE2-CG 3.84Å; F54-W241 HydrophobicContact CG-CD2 4.1Å; F54-W241 HydrophobicContact CG-CE3 4.27Å; F54-W241 HydrophobicContact CZ-CB 3.23Å; F54-W241 AromaticContact CZ-CD1 3.65Å; F54-W241 AromaticContact CZ-CD2 3.63Å; F54-W241 HydrophobicContact CZ-CD2 3.63Å; F54-W241 HydrophobicContact CZ-CE3 4.19Å; F54-W241 AromaticContact CZ-CG 3.15Å; F54-W241 HydrophobicContact CZ-CG 3.15Å; T57-W241 HydrophobicContact CG2-CH2 4.03Å; T57-W241 HydrophobicContact CG2-CZ3 4.04Å; F139-W241 HydrophobicContact CD2-CH2 4.26Å; F139-W241 AromaticContact CD2-CZ2 3.85Å; F139-W241 HydrophobicContact CD2-CZ2 3.85Å; F139-W241 AromaticContact CE2-CH2 3.51Å; F139-W241 HydrophobicContact CE2-CH2 3.51Å; F139-W241 AromaticContact CE2-CZ2 3.26Å; F139-W241 HydrophobicContact CE2-CZ2 3.26Å; F139-W241 HydrophobicContact CZ-CH2 4.19Å; F139-W241 AromaticContact CZ-CZ2 3.75Å; F139-W241 HydrophobicContact CZ-CZ2 3.75Å; S142-W241 PolarHBondContact OG-NE1 2.98Å; F146-W241 HydrophobicContact CD2-CB 4Å; F146-W241 HydrophobicContact CE2-CB 4.14Å; L237-W241 PolarHBondContact O-N 3.31Å; L237-W241 VanDerWaalsContact O-N 3.12Å; Y238-W241 HydrophobicContact CD2-CE3 4.15Å; Y238-W241 HydrophobicContact CD2-CZ3 4.48Å; Y238-W241 AromaticContact CE2-CE3 3.87Å; Y238-W241 HydrophobicContact CE2-CE3 3.87Å; Y238-W241 AromaticContact CE2-CZ3 3.77Å; Y238-W241 HydrophobicContact CE2-CZ3 3.77Å; Y238-W241 PolarHBondContact O-N 3.47Å; W241-N243 VanDerWaalsContact C-N 3.33Å; W241-N243 PolarHBondContact O-N 3.48Å; W241-L244 WeakPolarHBondContact O-CB 3.22Å; W241-L244 PolarHBondContact O-N 3.47Å; W241-L244 VanDerWaalsContact O-N 3.15Å; W241-F245 HydrophobicContact CZ2-CB 4.24Å; W241-F245 HydrophobicContact CZ2-CG 4.37Å; W241-F245 WeakPolarHBondContact O-CB 3.09Å; W241-F245 PolarHBondContact O-N 3.46Å
242W90.7Very high89.8Confident19 Ų198.8 Ų8.87%0.0725%0.047CC..Hα-helixtrans-56.5-49.3176.4-177.498.3000110.6Y88 S119 A122 I123 L178 Y238 N239 L244 F245 L246Y88-W242 AromaticContact CD1-CH2 3.72Å; Y88-W242 HydrophobicContact CD1-CH2 3.72Å; Y88-W242 AromaticContact CD1-CZ2 3.62Å; Y88-W242 HydrophobicContact CD1-CZ2 3.62Å; Y88-W242 HydrophobicContact CD1-CZ3 4.22Å; Y88-W242 AromaticContact CE1-CD2 3.61Å; Y88-W242 HydrophobicContact CE1-CD2 3.61Å; Y88-W242 AromaticContact CE1-CE2 3.54Å; Y88-W242 AromaticContact CE1-CE3 3.62Å; Y88-W242 HydrophobicContact CE1-CE3 3.62Å; Y88-W242 HydrophobicContact CE1-CG 4.35Å; Y88-W242 AromaticContact CE1-CH2 3.56Å; Y88-W242 HydrophobicContact CE1-CH2 3.56Å; Y88-W242 AromaticContact CE1-CZ2 3.54Å; Y88-W242 HydrophobicContact CE1-CZ2 3.54Å; Y88-W242 AromaticContact CE1-CZ3 3.62Å; Y88-W242 HydrophobicContact CE1-CZ3 3.62Å; Y88-W242 AromaticContact CZ-CD2 3.85Å; Y88-W242 AromaticContact CZ-CE2 3.94Å; S119-W242 PolarHBondContact O-NE1 2.89Å; A122-W242 HydrophobicContact CB-CZ2 4.26Å; I123-W242 HydrophobicContact CD1-CG 3.97Å; I123-W242 VanDerWaalsContact CG1-NE1 3.33Å; L178-W242 HydrophobicContact CD1-CZ3 4.35Å; Y238-W242 WeakPolarHBondContact O-CB 3.2Å; Y238-W242 PolarHBondContact O-N 3.39Å; N239-W242 PolarHBondContact O-N 3.36Å; W242-L244 PolarHBondContact O-N 2.99Å; W242-F245 PolarHBondContact O-N 2.92Å; W242-L246 HydrophobicContact CD2-CD1 4.13Å; W242-L246 HydrophobicContact CE3-CD1 4.05Å; W242-L246 HydrophobicContact CH2-CD1 3.12Å; W242-L246 HydrophobicContact CZ2-CD1 3.19Å; W242-L246 HydrophobicContact CZ3-CD1 3.57Å; W242-L246 WeakPolarHBondContact O-CB 3.45Å; W242-L246 PolarHBondContact O-N 2.92Å
243N90.1Very high89.7Confident1 Ų18 Ų81%0.0054%0.043CC..Hα-helixtrans-61.5-42.8175.7-75.1-54.7000111.8L178 T206 N239 W241 L246 T247L178-N243 WeakPolarHBondContact CD1-OD1 3.28Å; T206-N243 HydrophobicContact CG2-CB 3.92Å; N239-N243 WeakPolarHBondContact O-CB 3.44Å; N239-N243 PolarHBondContact O-N 2.82Å; N239-N243 PolarHBondContact O-ND2 3.24Å; N239-N243 PolarHBondContact OD1-ND2 3.31Å; W241-N243 VanDerWaalsContact C-N 3.33Å; W241-N243 PolarHBondContact O-N 3.48Å; N243-L246 PolarHBondContact O-N 3.46Å; N243-T247 VanDerWaalsContact O-CG2 3.31Å; N243-T247 WeakPolarHBondContact O-CG2 3.35Å; N243-T247 PolarHBondContact O-N 2.9Å; N243-T247 PolarHBondContact O-OG1 2.92Å; N243-T247 VanDerWaalsContact O-OG1 3.08Å
244L91.6Very high89.2Confident0 Ų016.3 Ų16.30%08%0.076CC..Hα-helixtrans-58.7-50.6175.8-179.467.3000111.2L145 V207 L210 C240 W241 W242 L246 T247 L248L145-L244 HydrophobicContact CB-CD2 4.07Å; V207-L244 HydrophobicContact CG2-CD1 3.97Å; L210-L244 HydrophobicContact CD2-CD2 4.14Å; C240-L244 WeakPolarHBondContact O-CB 3.43Å; C240-L244 PolarHBondContact O-N 3.42Å; W241-L244 WeakPolarHBondContact O-CB 3.22Å; W241-L244 PolarHBondContact O-N 3.47Å; W241-L244 VanDerWaalsContact O-N 3.15Å; W242-L244 PolarHBondContact O-N 2.99Å; L244-L246 VanDerWaalsContact C-N 3.33Å; L244-L246 PolarHBondContact O-N 3.19Å; L244-T247 PolarHBondContact O-N 3.43Å; L244-T247 PolarHBondContact O-OG1 3.39Å; L244-L248 HydrophobicContact CD1-CD1 4.47Å; L244-L248 HydrophobicContact CG-CD1 4.17Å; L244-L248 VanDerWaalsContact O-CG 3.3Å; L244-L248 WeakPolarHBondContact O-CG 3.27Å; L244-L248 PolarHBondContact O-N 3.39Å
245F92.4Very high88.4Confident3 Ų318.7 Ų18.71%0.0139%0.093CC..Hα-helixtrans-58.7-45179175.3-99.4000111.7I123 V135 M138 F139 W241 W242 L248 M249I123-F245 HydrophobicContact CD1-CD1 3.78Å; I123-F245 HydrophobicContact CD1-CE1 4.22Å; I123-F245 HydrophobicContact CG1-CD1 4.15Å; I123-F245 HydrophobicContact CG1-CE1 4.28Å; I123-F245 HydrophobicContact CG2-CD1 4.19Å; I123-F245 HydrophobicContact CG2-CE1 3.53Å; I123-F245 HydrophobicContact CG2-CZ 4.4Å; V135-F245 HydrophobicContact CG1-CZ 4.27Å; M138-F245 HydrophobicContact CB-CE2 4.24Å; F139-F245 HydrophobicContact CB-CD2 4.44Å; F139-F245 HydrophobicContact CB-CE2 3.83Å; F139-F245 HydrophobicContact CD2-CD2 4.21Å; F139-F245 AromaticContact CD2-CE2 3.94Å; F139-F245 HydrophobicContact CD2-CE2 3.94Å; F139-F245 HydrophobicContact CG-CE2 4.36Å; W241-F245 HydrophobicContact CZ2-CB 4.24Å; W241-F245 HydrophobicContact CZ2-CG 4.37Å; W241-F245 WeakPolarHBondContact O-CB 3.09Å; W241-F245 PolarHBondContact O-N 3.46Å; W242-F245 PolarHBondContact O-N 2.92Å; F245-L248 PolarHBondContact O-N 3.43Å; F245-M249 HydrophobicContact CD1-CG 4.23Å; F245-M249 HydrophobicContact CE1-CG 3.69Å; F245-M249 HydrophobicContact CE1-SD 4.47Å; F245-M249 HydrophobicContact CE2-CG 4.11Å; F245-M249 HydrophobicContact CE2-SD 4.41Å; F245-M249 HydrophobicContact CZ-CG 3.64Å; F245-M249 HydrophobicContact CZ-SD 3.92Å; F245-M249 WeakPolarHBondContact O-CG 3.28Å; F245-M249 PolarHBondContact O-N 3.27Å
246L89Confident87.4Confident10 Ų1018.4 Ų18.45%0.0529%0.09CC..Hα-helixtrans-66.9-41.4-179.1-137.9155.9000112I123 W242 N243 L244 L248 M249 W250I123-L246 HydrophobicContact CG1-CD1 4.48Å; W242-L246 HydrophobicContact CD2-CD1 4.13Å; W242-L246 HydrophobicContact CE3-CD1 4.05Å; W242-L246 HydrophobicContact CH2-CD1 3.12Å; W242-L246 HydrophobicContact CZ2-CD1 3.19Å; W242-L246 HydrophobicContact CZ3-CD1 3.57Å; W242-L246 WeakPolarHBondContact O-CB 3.45Å; W242-L246 PolarHBondContact O-N 2.92Å; N243-L246 PolarHBondContact O-N 3.46Å; L244-L246 VanDerWaalsContact C-N 3.33Å; L244-L246 PolarHBondContact O-N 3.19Å; L246-L248 VanDerWaalsContact C-N 3.33Å; L246-L248 PolarHBondContact O-N 2.85Å; L246-M249 WeakPolarHBondContact O-CB 3.26Å; L246-M249 PolarHBondContact O-N 3.27Å; L246-W250 HydrophobicContact CD2-CD2 3.96Å; L246-W250 HydrophobicContact CD2-CG 4.25Å; L246-W250 HydrophobicContact CD2-CH2 4.28Å; L246-W250 HydrophobicContact CD2-CZ2 3.35Å; L246-W250 PolarHBondContact O-N 2.87Å
247T89.9Confident86.6Confident0 Ų018.3 Ų18.30%09%0.088CC..Hα-helixtrans-62.1-38.3173.655.10000113L178 A202 T206 N243 L244 W250 I251L178-T247 HydrophobicContact CD2-CG2 3.99Å; A202-T247 HydrophobicContact CB-CG2 3.47Å; A202-T247 VanDerWaalsContact CB-CG2 3.47Å; T206-T247 HydrophobicContact CG2-CG2 3.75Å; N243-T247 VanDerWaalsContact O-CG2 3.31Å; N243-T247 WeakPolarHBondContact O-CG2 3.35Å; N243-T247 PolarHBondContact O-N 2.9Å; N243-T247 PolarHBondContact O-OG1 2.92Å; N243-T247 VanDerWaalsContact O-OG1 3.08Å; L244-T247 PolarHBondContact O-N 3.43Å; L244-T247 PolarHBondContact O-OG1 3.39Å; T247-W250 PolarHBondContact O-N 3.29Å; T247-I251 VanDerWaalsContact O-CG1 3.31Å; T247-I251 WeakPolarHBondContact O-CG1 3.4Å; T247-I251 PolarHBondContact O-N 3.41Å
248L90.8Very high85.4Confident14 Ų1421.2 Ų21.27%0.07310%0.101CC..Hα-helixtrans-66.3-41.8175.2-70.1167.8000112.1M138 V141 L145 L203 L244 F245 L246 W250 I251 S252M138-L248 HydrophobicContact SD-CB 4.08Å; V141-L248 HydrophobicContact CG1-CD1 4.07Å; V141-L248 HydrophobicContact CG1-CD2 4.27Å; L145-L248 HydrophobicContact CD1-CD1 4.12Å; L145-L248 HydrophobicContact CD1-CD2 4.26Å; L203-L248 HydrophobicContact CD1-CD2 3.94Å; L244-L248 HydrophobicContact CD1-CD1 4.47Å; L244-L248 HydrophobicContact CG-CD1 4.17Å; L244-L248 VanDerWaalsContact O-CG 3.3Å; L244-L248 WeakPolarHBondContact O-CG 3.27Å; L244-L248 PolarHBondContact O-N 3.39Å; F245-L248 PolarHBondContact O-N 3.43Å; L246-L248 VanDerWaalsContact C-N 3.33Å; L246-L248 PolarHBondContact O-N 2.85Å; L248-W250 VanDerWaalsContact C-N 3.33Å; L248-W250 PolarHBondContact O-N 3.45Å; L248-I251 PolarHBondContact O-N 2.83Å; L248-S252 WeakPolarHBondContact O-CB 3.34Å; L248-S252 PolarHBondContact O-N 3.32Å; L248-S252 PolarHBondContact O-OG 3.44Å
249M89.7Confident83.8Confident1 Ų126.2 Ų26.21%0.00513%0.128CC..Hα-helixtrans-57.7-47.1173.2-78.3-68.2-66.100111A127 Y130 V135 M138 F245 L246 S252 S253A127-M249 HydrophobicContact CB-CE 4.34Å; Y130-M249 HydrophobicContact CD1-CE 3.9Å; Y130-M249 HydrophobicContact CD2-CE 3.2Å; Y130-M249 HydrophobicContact CE1-CE 4.17Å; Y130-M249 WeakPolarHBondContact CE1-O 3.41Å; Y130-M249 HydrophobicContact CE2-CE 3.56Å; Y130-M249 HydrophobicContact CG-CE 3.39Å; Y130-M249 PolarHBondContact OH-O 2.78Å; V135-M249 HydrophobicContact CG2-CE 3.82Å; V135-M249 HydrophobicContact CG2-SD 4.26Å; M138-M249 HydrophobicContact CB-CG 4.41Å; M138-M249 HydrophobicContact CB-SD 3.91Å; M138-M249 HydrophobicContact CG-SD 4.14Å; F245-M249 HydrophobicContact CD1-CG 4.23Å; F245-M249 HydrophobicContact CE1-CG 3.69Å; F245-M249 HydrophobicContact CE1-SD 4.47Å; F245-M249 HydrophobicContact CE2-CG 4.11Å; F245-M249 HydrophobicContact CE2-SD 4.41Å; F245-M249 HydrophobicContact CZ-CG 3.64Å; F245-M249 HydrophobicContact CZ-SD 3.92Å; F245-M249 WeakPolarHBondContact O-CG 3.28Å; F245-M249 PolarHBondContact O-N 3.27Å; L246-M249 WeakPolarHBondContact O-CB 3.26Å; L246-M249 PolarHBondContact O-N 3.27Å; M249-S252 CarbonylContact O-C 3.54Å; M249-S252 WeakPolarHBondContact O-CA 3.37Å; M249-S252 WeakPolarHBondContact O-CB 3.42Å; M249-S252 PolarHBondContact O-N 2.93Å; M249-S253 PolarHBondContact O-N 3.49Å
250W87.7Confident82Confident4 Ų430.7 Ų30.72%0.01517%0.167CC..Hα-helixtrans-66.6-39.9-179.5-75.411.2000113.9D126 L178 Q182 L195 C196 A198 L246 T247 L248 S252 S253D126-W250 PolarHBondContact OD2-NE1 2.84Å; L178-W250 HydrophobicContact CB-CH2 3.86Å; L178-W250 HydrophobicContact CB-CZ3 4.22Å; L178-W250 HydrophobicContact CD2-CE3 3.83Å; L178-W250 HydrophobicContact CD2-CH2 3.56Å; L178-W250 HydrophobicContact CD2-CZ2 4.35Å; L178-W250 HydrophobicContact CD2-CZ3 3.31Å; L178-W250 HydrophobicContact CG-CH2 4.31Å; L178-W250 HydrophobicContact CG-CZ3 4.33Å; L178-W250 WeakPolarHBondContact O-CH2 3.13Å; Q182-W250 HydrophobicContact CB-CH2 4.25Å; Q182-W250 HydrophobicContact CB-CZ2 4.27Å; L195-W250 HydrophobicContact CB-CB 4.37Å; L195-W250 HydrophobicContact CB-CG 4.37Å; L195-W250 HydrophobicContact CD2-CD2 3.84Å; L195-W250 HydrophobicContact CD2-CE3 4.22Å; L195-W250 HydrophobicContact CD2-CG 4.19Å; L195-W250 HydrophobicContact CD2-CZ2 4.3Å; C196-W250 WeakPolarHBondContact CA-O 3.33Å; C196-W250 PolarHBondContact N-O 3.04Å; A198-W250 HydrophobicContact CB-CE3 4.03Å; A198-W250 HydrophobicContact CB-CZ3 4.08Å; L246-W250 HydrophobicContact CD2-CD2 3.96Å; L246-W250 HydrophobicContact CD2-CG 4.25Å; L246-W250 HydrophobicContact CD2-CH2 4.28Å; L246-W250 HydrophobicContact CD2-CZ2 3.35Å; L246-W250 PolarHBondContact O-N 2.87Å; T247-W250 PolarHBondContact O-N 3.29Å; L248-W250 VanDerWaalsContact C-N 3.33Å; L248-W250 PolarHBondContact O-N 3.45Å; W250-S252 PolarHBondContact O-N 2.83Å; W250-S253 WeakPolarHBondContact O-CB 3.37Å; W250-S253 PolarHBondContact O-N 3.29Å; W250-S253 PolarHBondContact O-OG 3.35Å
251I88.6Confident79.9Confident55 Ų5538.3 Ų38.328%0.28221%0.207SC..Hα-helixtrans-60-37.3171.5-69.6165.3000110.4G199 A200 L203 T247 L248 S253G199-I251 VanDerWaalsContact C-CG1 3.47Å; A200-I251 HydrophobicContact CB-CG1 4.41Å; L203-I251 HydrophobicContact CB-CD1 3.95Å; L203-I251 HydrophobicContact CD1-CD1 3.33Å; L203-I251 HydrophobicContact CG-CD1 4.28Å; T247-I251 VanDerWaalsContact O-CG1 3.31Å; T247-I251 WeakPolarHBondContact O-CG1 3.4Å; T247-I251 PolarHBondContact O-N 3.41Å; L248-I251 PolarHBondContact O-N 2.83Å; I251-S253 PolarHBondContact O-N 3.4Å
252S87.2Confident77.6Confident14 Ų1440.8 Ų40.810%0.09822%0.223CC..THydrogen-bonded Turntrans-73.8-3.4178-55.40000113.9M138 L248 M249 W250 Y254 S255 G256M138-S252 WeakPolarHBondContact CE-OG 3.37Å; M138-S252 PolarHBondContact SD-OG 2.99Å; L248-S252 WeakPolarHBondContact O-CB 3.34Å; L248-S252 PolarHBondContact O-N 3.32Å; L248-S252 PolarHBondContact O-OG 3.44Å; M249-S252 CarbonylContact O-C 3.54Å; M249-S252 WeakPolarHBondContact O-CA 3.37Å; M249-S252 WeakPolarHBondContact O-CB 3.42Å; M249-S252 PolarHBondContact O-N 2.93Å; W250-S252 PolarHBondContact O-N 2.83Å; S252-Y254 PolarHBondContact O-N 3.39Å; S252-S255 PolarHBondContact O-N 2.84Å; S252-G256 WeakPolarHBondContact O-CA 3.29Å; S252-G256 PolarHBondContact O-N 3.23Å
253S84.2Confident75.3Confident0 Ų051 Ų510%026%0.261CS..Hα-helixtrans-57.5-35178.1-740000113.1Y130 L195 M249 W250 I251 S255 G256 L257Y130-S253 PolarHBondContact OH-OG 3.1Å; L195-S253 WeakPolarHBondContact CB-OG 3.39Å; M249-S253 PolarHBondContact O-N 3.49Å; W250-S253 WeakPolarHBondContact O-CB 3.37Å; W250-S253 PolarHBondContact O-N 3.29Å; W250-S253 PolarHBondContact O-OG 3.35Å; I251-S253 PolarHBondContact O-N 3.4Å; S253-S255 VanDerWaalsContact C-N 3.25Å; S253-S255 PolarHBondContact O-N 3.41Å; S253-G256 PolarHBondContact O-N 3.18Å; S253-L257 VanDerWaalsContact CB-CD1 3.42Å; S253-L257 WeakPolarHBondContact O-CD1 3.33Å; S253-L257 WeakPolarHBondContact OG-CD1 3.38Å
254Y77.8Confident72.9Confident175 Ų17558 Ų5869%0.68630%0.298SS*.Hα-helixtrans-61.2-35.7-178.9-174.5-101.8000112.7S252S252-Y254 PolarHBondContact O-N 3.39Å
255S74.3Confident70.5Confident50 Ų5062.6 Ų62.635%0.3533%0.327SS..Hα-helixtrans-101.6-13.4-177.7-56.90000113.5S252 S253S252-S255 PolarHBondContact O-N 2.84Å; S253-S255 VanDerWaalsContact C-N 3.25Å; S253-S255 PolarHBondContact O-N 3.41Å
256G68Low68.1Low0 Ų066.6 Ų66.60%035%0.352CS..Hα-helixtrans-127.2-6.1-155.200000119.5Y130 F131 S252 S253Y130-G256 VanDerWaalsContact CA-O 3.32Å; Y130-G256 WeakPolarHBondContact CA-O 3.3Å; F131-G256 VanDerWaalsContact CD2-O 3.28Å; F131-G256 WeakPolarHBondContact CD2-O 3.32Å; F131-G256 PolarHBondContact N-O 2.95Å; F131-G256 VanDerWaalsContact N-O 3.1Å; S252-G256 WeakPolarHBondContact O-CA 3.29Å; S252-G256 PolarHBondContact O-N 3.23Å; S253-G256 PolarHBondContact O-N 3.18Å
257L71Confident66.2Low21 Ų2172 Ų7211%0.1138%0.38CS..BIsolated β-bridgetrans-69.7134.4176-94.679000111.3Y130 Y185 N192 S253 N259Y130-L257 HydrophobicContact CD1-CD1 4.06Å; Y130-L257 HydrophobicContact CE1-CD1 3.6Å; Y185-L257 HydrophobicContact CE2-CD2 4.19Å; Y185-L257 VanDerWaalsContact OH-CD2 3.25Å; Y185-L257 WeakPolarHBondContact OH-CD2 3.46Å; N192-L257 WeakPolarHBondContact OD1-CD2 3.27Å; S253-L257 VanDerWaalsContact CB-CD1 3.42Å; S253-L257 WeakPolarHBondContact O-CD1 3.33Å; S253-L257 WeakPolarHBondContact OG-CD1 3.38Å; L257-N259 PolarHBondContact O-N 2.94Å
258K66.3Low64.2Low63 Ų6375.8 Ų75.827%0.27441%0.405SS..  trans-70.6108.6168.6-73.9170.3167.4150.40107.9L129 Y130 F131 A260L129-K258 PolarHBondContact O-N 2.94Å; Y130-K258 VanDerWaalsContact O-CD 3.3Å; Y130-K258 WeakPolarHBondContact O-CD 3.46Å; Y130-K258 WeakPolarHBondContact O-CE 3.37Å; Y130-K258 PolarHBondContact O-NZ 3.19Å; F131-K258 HydrophobicContact CD1-CG 3.76Å; F131-K258 HydrophobicContact CD2-CG 4.25Å; F131-K258 HydrophobicContact CE1-CG 3.72Å; F131-K258 HydrophobicContact CE2-CG 4.2Å; F131-K258 HydrophobicContact CG-CG 4.03Å; F131-K258 HydrophobicContact CZ-CB 4.47Å; F131-K258 HydrophobicContact CZ-CG 3.95Å; K258-A260 PolarHBondContact O-N 3.23Å
259N57.9Low62.1Low106 Ų10680.7 Ų80.757%0.56743%0.431SS*.  trans-60.7135.1166.5-79.2-12.8000109L257 D261 T262L257-N259 PolarHBondContact O-N 2.94Å; N259-D261 PolarHBondContact O-N 2.95Å; N259-D261 VanDerWaalsContact O-N 3.11Å; N259-T262 WeakPolarHBondContact CB-OG1 3.44Å; N259-T262 PolarHBondContact O-N 2.99Å; N259-T262 PolarHBondContact O-OG1 2.89Å
260A51.7Low60.3Low107 Ų10782.1 Ų82.188%0.88444%0.439SS*.THydrogen-bonded Turntrans-58-25.8179.900000112.7K258K258-A260 PolarHBondContact O-N 3.23Å
261D47Very low58.5Low160 Ų16087.2 Ų87.286%0.85646%0.462SS*.THydrogen-bonded Turntrans-86-19.1-179.1-84.4-26.5000115.2N259 R263N259-D261 PolarHBondContact O-N 2.95Å; N259-D261 VanDerWaalsContact O-N 3.11Å; D261-R263 VanDerWaalsContact C-N 3.3Å; D261-R263 PolarHBondContact O-N 3.33Å
262T43.2Very low56.8Low54 Ų5487.9 Ų87.933%0.33147%0.471SS..  trans-90.363.9-17441.10000112.2N259 T265N259-T262 WeakPolarHBondContact CB-OG1 3.44Å; N259-T262 PolarHBondContact O-N 2.99Å; N259-T262 PolarHBondContact O-OG1 2.89Å; T262-T265 WeakPolarHBondContact CB-OG1 3.36Å; T262-T265 HydrophobicContact CG2-CG2 4.24Å; T262-T265 WeakPolarHBondContact CG2-OG1 3.29Å
263R43.3Very low55.2Low233 Ų23389.7 Ų89.788%0.87948%0.484SS*.SBendtrans-70.4-13.6158-82.1-171.2-172.9176.23.7113D261D261-R263 VanDerWaalsContact C-N 3.3Å; D261-R263 PolarHBondContact O-N 3.33Å
264N39Very low53.9Low147 Ų14791.5 Ų91.579%0.78650%0.495SS*.SBendtrans-124-7.6-170.4-72.2-6.5000117.7T266N264-T266 PolarHBondContact O-N 2.97Å; N264-T266 VanDerWaalsContact O-N 3.14Å
265T40.6Very low52.7Low97 Ų9789.7 Ų89.760%0.59549%0.488SS*.SBendtrans-93.281.117857.30000111.3T262T262-T265 WeakPolarHBondContact CB-OG1 3.36Å; T262-T265 HydrophobicContact CG2-CG2 4.24Å; T262-T265 WeakPolarHBondContact CG2-OG1 3.29Å
266T42.9Very low51.5Low88 Ų8888.9 Ų88.954%0.5449%0.487SS..  trans36.5102.7136.5590000116.9N264 P268 N269N264-T266 PolarHBondContact O-N 2.97Å; N264-T266 VanDerWaalsContact O-N 3.14Å; T266-P268 WeakPolarHBondContact O-CD 3.4Å; T266-N269 PolarHBondContact O-N 3.45Å
267L49.6Very low50.7Low123 Ų12395.2 Ų95.264%0.64452%0.519SS*.THydrogen-bonded Turntrans-26.3-33.9158-155.476000117.9N269 K271L267-N269 PolarHBondContact O-N 3.44Å; L267-K271 PolarHBondContact O-N 3.36Å
268P47Very low49.8Very low80 Ų8099.2 Ų99.252%0.51954%0.539SS..Hα-helixtrans-54.8-38.4176.513.8-33.3000116.6T266 K271 S272T266-P268 WeakPolarHBondContact O-CD 3.4Å; P268-K271 PolarHBondContact O-N 2.97Å; P268-S272 WeakPolarHBondContact O-CB 3.36Å; P268-S272 PolarHBondContact O-N 3.03Å; P268-S272 PolarHBondContact O-OG 2.78Å
269N46.3Very low48.9Very low117 Ų117102.7 Ų102.763%0.62656%0.56SS**Hα-helixtrans-73.5-31.4-173.7-82.4-6.8000113.4T266 L267 S272 S273T266-N269 PolarHBondContact O-N 3.45Å; L267-N269 PolarHBondContact O-N 3.44Å; N269-S272 PolarHBondContact O-OG 3.01Å; N269-S272 VanDerWaalsContact O-OG 3.05Å; N269-S273 PolarHBondContact O-N 2.93Å; N269-S273 VanDerWaalsContact O-N 3.11Å
270V52.8Low48.2Very low30 Ų30103.4 Ų103.418%0.18257%0.568CS.*Hα-helixtrans-75.3-40.7174.1-179.10000110.2F131 I134 S272 S273 V274F131-V270 HydrophobicContact CD2-CG1 4.44Å; F131-V270 HydrophobicContact CD2-CG2 3.97Å; F131-V270 HydrophobicContact CE2-CG2 3.91Å; F131-V270 HydrophobicContact CG-CG2 4.37Å; F131-V270 HydrophobicContact CZ-CG2 4.26Å; I134-V270 HydrophobicContact CD1-CG1 3.99Å; I134-V270 HydrophobicContact CG1-CG1 4.25Å; V270-S272 VanDerWaalsContact C-N 3.35Å; V270-S272 PolarHBondContact O-N 3.45Å; V270-S273 PolarHBondContact O-N 3.17Å; V270-V274 HydrophobicContact CG1-CG2 4.42Å; V270-V274 WeakPolarHBondContact O-CG2 3.33Å; V270-V274 PolarHBondContact O-N 3.15Å
271K49.2Very low47.6Very low111 Ų111110.4 Ų110.448%0.48358%0.578SS.*Hα-helixtrans-58.2-48172.6-80.8-173.4177.1-175.20110.5L267 P268 S273 V274 Y275L267-K271 PolarHBondContact O-N 3.36Å; P268-K271 PolarHBondContact O-N 2.97Å; K271-S273 PolarHBondContact O-N 3.36Å; K271-V274 PolarHBondContact O-N 3.33Å; K271-Y275 HydrophobicContact CB-CD2 4.1Å; K271-Y275 HydrophobicContact CB-CE2 4.18Å; K271-Y275 HydrophobicContact CG-CE2 4.42Å; K271-Y275 WeakPolarHBondContact O-CB 3.35Å; K271-Y275 WeakPolarHBondContact O-CD2 3.44Å; K271-Y275 PolarHBondContact O-N 3.46Å
272S52.7Low47.6Very low69 Ų69107.9 Ų107.948%0.48357%0.565SS.*Hα-helixtrans-65-36.1-179.171.30000112.9P268 N269 V270 G276P268-S272 WeakPolarHBondContact O-CB 3.36Å; P268-S272 PolarHBondContact O-N 3.03Å; P268-S272 PolarHBondContact O-OG 2.78Å; N269-S272 PolarHBondContact O-OG 3.01Å; N269-S272 VanDerWaalsContact O-OG 3.05Å; V270-S272 VanDerWaalsContact C-N 3.35Å; V270-S272 PolarHBondContact O-N 3.45Å; S272-G276 WeakPolarHBondContact O-CA 3.45Å; S272-G276 PolarHBondContact O-N 3.14Å
273S54.6Low47.8Very low53 Ų53110.7 Ų110.737%0.37158%0.577SS.*Hα-helixtrans-68.3-40.5175.4-172.60000112.5N269 V270 K271 G276 M277N269-S273 PolarHBondContact O-N 2.93Å; N269-S273 VanDerWaalsContact O-N 3.11Å; V270-S273 PolarHBondContact O-N 3.17Å; K271-S273 PolarHBondContact O-N 3.36Å; S273-G276 PolarHBondContact O-N 3.46Å; S273-M277 PolarHBondContact O-N 3.27Å; S273-M277 VanDerWaalsContact O-N 3.08Å
274V57.2Low48.1Very low38 Ų38103.9 Ų103.923%0.2356%0.56CS.*Hα-helixtrans-70.2-44.2176.71750000110.5I134 V137 V270 K271 G276 M277 I278I134-V274 HydrophobicContact CG1-CG2 4.47Å; V137-V274 HydrophobicContact CG2-CG1 4.47Å; V270-V274 HydrophobicContact CG1-CG2 4.42Å; V270-V274 WeakPolarHBondContact O-CG2 3.33Å; V270-V274 PolarHBondContact O-N 3.15Å; K271-V274 PolarHBondContact O-N 3.33Å; V274-G276 VanDerWaalsContact C-N 3.29Å; V274-G276 PolarHBondContact O-N 3.1Å; V274-M277 PolarHBondContact O-N 3.45Å; V274-I278 HydrophobicContact CG1-CD1 4.01Å; V274-I278 WeakPolarHBondContact O-CG1 3.5Å; V274-I278 PolarHBondContact O-N 3.38Å; V274-I278 VanDerWaalsContact O-N 3.08Å
275Y51.7Low48.6Very low137 Ų137101.4 Ų101.454%0.53755%0.547SS..Hα-helixtrans-63.7-35.1173.3-79.2-66000111.9K271 I278 L279K271-Y275 HydrophobicContact CB-CD2 4.1Å; K271-Y275 HydrophobicContact CB-CE2 4.18Å; K271-Y275 HydrophobicContact CG-CE2 4.42Å; K271-Y275 WeakPolarHBondContact O-CB 3.35Å; K271-Y275 WeakPolarHBondContact O-CD2 3.44Å; K271-Y275 PolarHBondContact O-N 3.46Å; Y275-I278 CarbonylContact O-C 3.46Å; Y275-I278 PolarHBondContact O-N 3.31Å; Y275-I278 VanDerWaalsContact O-N 3.14Å; Y275-L279 WeakPolarHBondContact O-CB 3.3Å; Y275-L279 PolarHBondContact O-N 3.48Å
276G49.7Very low49.1Very low33 Ų33101.7 Ų101.734%0.3454%0.544SS..Hα-helixtrans-64-38.817500000112.6S272 S273 V274 I278 T280S272-G276 WeakPolarHBondContact O-CA 3.45Å; S272-G276 PolarHBondContact O-N 3.14Å; S273-G276 PolarHBondContact O-N 3.46Å; V274-G276 VanDerWaalsContact C-N 3.29Å; V274-G276 PolarHBondContact O-N 3.1Å; G276-I278 VanDerWaalsContact C-N 3.32Å; G276-T280 PolarHBondContact O-N 3.42Å; G276-T280 PolarHBondContact O-OG1 3.38Å
277M50.3Low49.5Very low133 Ų133102.6 Ų102.666%0.65554%0.544SS*.Hα-helixtrans-67.1-31.4170.8-88.2-176.6-177.400113S273 V274S273-M277 PolarHBondContact O-N 3.27Å; S273-M277 VanDerWaalsContact O-N 3.08Å; V274-M277 PolarHBondContact O-N 3.45Å
278I51.9Low49.5Very low105 Ų105101.1 Ų101.154%0.53854%0.537SS..Hα-helixtrans-80.2-33.3178.9-65167.1000111.5V274 Y275 G276V274-I278 HydrophobicContact CG1-CD1 4.01Å; V274-I278 WeakPolarHBondContact O-CG1 3.5Å; V274-I278 PolarHBondContact O-N 3.38Å; V274-I278 VanDerWaalsContact O-N 3.08Å; Y275-I278 CarbonylContact O-C 3.46Å; Y275-I278 PolarHBondContact O-N 3.31Å; Y275-I278 VanDerWaalsContact O-N 3.14Å; G276-I278 VanDerWaalsContact C-N 3.32Å
279L48.5Very low49.7Very low136 Ų136102.8 Ų102.871%0.71254%0.538SS*.Hα-helixtrans-89.7-5.9-176.5-82.9158000114.7Y275 K281Y275-L279 WeakPolarHBondContact O-CB 3.3Å; Y275-L279 PolarHBondContact O-N 3.48Å; L279-K281 VanDerWaalsContact C-N 3.33Å
280T42Very low50Low120 Ų120101.6 Ų101.674%0.73653%0.531SS*.THydrogen-bonded Turntrans-95.219.5174.144.90000113.7G276G276-T280 PolarHBondContact O-N 3.42Å; G276-T280 PolarHBondContact O-OG1 3.38Å
281K39.5Very low49.8Very low254 Ų254108.1 Ų108.1100%1.10456%0.563SS**  trans-125.40162-85.7-171.8174.5-178.40110.1L279L279-K281 VanDerWaalsContact C-N 3.33Å

Retrieved 281 of 281 residues in 664.9 ms (Link to these results)

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