A0A087Y7X7_POEFO Loading...

High mobility group protein 20A

AlphaFold DB , UniProt , Accession A0A087Y7X7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 291 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
1M38.5Very low32.9Very low223 Ų223134.2 Ų134.2100%1.09983%0.828SS**  076.40-66-169.9172.800105.6
2D36.8Very low32.6Very low140 Ų140131.8 Ų131.875%0.74981%0.812SS**  82.7126.997.7-62.4-41.2000107.8
3E31.7Very low32.4Very low160 Ų160132.8 Ų132.875%0.74881%0.81SS**  cis-159.4140-3-99.4174.9102.600102.2
4Q30.8Very low32.2Very low166 Ų166133.9 Ų133.978%0.77681%0.809SS**  44.5115.498.5-119.5104.632.300112.3
5T32.7Very low31.9Very low137 Ų137134.3 Ų134.384%0.8481%0.805SS**  -179.6150.350.637.40000110.6
6G31.1Very low31.9Very low80 Ų80131.2 Ų131.283%0.82579%0.791SS**  trans130.977.2142.400000118.4
7S29.8Very low31.8Very low115 Ų115134.2 Ų134.280%0.80480%0.795SS**  trans-83.2-166.5155.2-39.30000110.5
8P43.4Very low32Very low122 Ų122139.5 Ų139.579%0.79280%0.799SS**  cis-138.6-168.6-18.728.1-3.7000113
9A29.9Very low32Very low106 Ų106140.4 Ų140.488%0.87680%0.801SS**  trans115.5129154.600000112.6
10G29.3Very low32.1Very low77 Ų77137.1 Ų137.179%0.79480%0.798SS**  cis166.7133.49.500000105.5
11N27.6Very low32.4Very low150 Ų150138.6 Ų138.680%0.80280%0.803SS**  trans-78.6167.6-169.9-153.313000112.3
12T29.8Very low32.4Very low105 Ų105136.2 Ų136.264%0.64479%0.79SS**  trans82.1115.5153.446.20000122.3
13D29.9Very low32.8Very low146 Ų146138.9 Ų138.978%0.78180%0.795SS**  93.799.4124.4-76.3-11.5000122.7
14N29.2Very low33.1Very low148 Ų148137.1 Ų137.179%0.79180%0.797SS**  100.4121.2107.6-146.69.1000119.2
15N27.9Very low33.7Very low140 Ų140140.3 Ų140.375%0.74980%0.802SS**  trans112.4132.3137.4-156.724.3000118.9
16S31.5Very low34.1Very low84 Ų84145.4 Ų145.459%0.58781%0.806SS**  trans77.990.5167.4-620000118
17Q31.7Very low34.3Very low183 Ų183144.6 Ų144.686%0.85580%0.798SS**  -169.6125.496.7-135.2105.3-69.300110.2
18R34.4Very low34.9Very low229 Ų229144.5 Ų144.586%0.86480%0.797SS**  trans-55.4138.7163.3-73.6170.5161.4-163.7-4.8109.7
19N32.1Very low34.6Very low157 Ų157149.3 Ų149.384%0.8480%0.8SS**  -177.6121.4120.5-86.5-28.1000110.1
20G33.6Very low35.3Very low73 Ų73150.1 Ų150.175%0.75379%0.794SS**  trans-82.8130.2170.300000110.1E22G20-E22 VanDerWaalsContact C-N 3.33Å; G20-E22 PolarHBondContact O-N 3.24Å
21D38.2Very low36.2Very low169 Ų169156.4 Ų156.490%0.90480%0.799SS**  trans-73.984.6170.9-72.8-49.1000110.3K23D21-K23 PolarHBondContact O-N 3.14Å
22E39.5Very low36.9Very low174 Ų174152.2 Ų152.281%0.81379%0.792SS**  trans-68.3114.3157.4-77.7-168.7151.900109.1G20G20-E22 VanDerWaalsContact C-N 3.33Å; G20-E22 PolarHBondContact O-N 3.24Å
23K45.6Very low37.9Very low195 Ų195158.6 Ų158.685%0.84880%0.804SS**PPolyproline II helixtrans-47.6130.7170.6-70178.6177.7178.10110.2D21 R25D21-K23 PolarHBondContact O-N 3.14Å; K23-R25 PolarHBondContact O-N 3.41Å; K23-R25 VanDerWaalsContact O-N 3.15Å
24P37.2Very low39Very low124 Ų124161.3 Ų161.381%0.80581%0.809SS**PPolyproline II helixtrans-67.8121.5-172.923.8-27.9000109.9R26P24-R26 PolarHBondContact O-N 2.68Å; P24-R26 VanDerWaalsContact O-N 3.16Å
25R43.6Very low40.2Very low232 Ų232164.5 Ų164.588%0.87581%0.81SS**PPolyproline II helixtrans-52.9118.8171.6-68.1-177.2176.9-171.4-0.3108.4K23 G27K23-R25 PolarHBondContact O-N 3.41Å; K23-R25 VanDerWaalsContact O-N 3.15Å; R25-G27 PolarHBondContact O-N 3.35Å; R25-G27 VanDerWaalsContact O-N 3.1Å
26R41Very low41.2Very low244 Ų244167.5 Ų167.592%0.92182%0.816SS**PPolyproline II helixtrans-48.7120.6173.7-70.8-173.4-167.4-149.42.6108.6P24P24-R26 PolarHBondContact O-N 2.68Å; P24-R26 VanDerWaalsContact O-N 3.16Å
27G35.5Very low42.2Very low63 Ų63172.8 Ų172.865%0.64983%0.828SS**PPolyproline II helixtrans-47.7137.6-177.100000112.3R25 W29R25-G27 PolarHBondContact O-N 3.35Å; R25-G27 VanDerWaalsContact O-N 3.1Å; G27-W29 PolarHBondContact O-N 3.43Å
28S41.7Very low43.3Very low114 Ų114169.6 Ų169.680%0.79782%0.824SS**  trans-42.3106.4172.7169.70000111.4T30S28-T30 PolarHBondContact O-N 3.42Å
29W37.3Very low44.3Very low223 Ų223164.1 Ų164.185%0.84581%0.809SS**  trans-55.8110.6167.7-96.376.9000109G27 K31G27-W29 PolarHBondContact O-N 3.43Å; W29-K31 PolarHBondContact O-N 3.37Å; W29-K31 VanDerWaalsContact O-N 3.12Å
30T44.9Very low45.6Very low123 Ų123165.2 Ų165.276%0.75581%0.807SS**  trans-62118.4163.252.20000106.4S28 G32S28-T30 PolarHBondContact O-N 3.42Å; T30-G32 VanDerWaalsContact C-N 3.3Å; T30-G32 PolarHBondContact O-N 3.12Å
31K49.3Very low47.1Very low209 Ų209163 Ų16391%0.90978%0.777SS**  trans-55.196178.6-83.8178179.8168.10108.7W29 R33W29-K31 PolarHBondContact O-N 3.37Å; W29-K31 VanDerWaalsContact O-N 3.12Å; K31-R33 PolarHBondContact O-N 3.03Å; K31-R33 VanDerWaalsContact O-N 3.1Å
32G40.9Very low48.7Very low62 Ų62160.5 Ų160.564%0.63977%0.773SS**  trans-50.5119.8173.600000108.6T30 K34T30-G32 VanDerWaalsContact C-N 3.3Å; T30-G32 PolarHBondContact O-N 3.12Å; G32-K34 PolarHBondContact O-N 3.32Å
33R52Low50.1Low239 Ų239157.4 Ų157.490%0.90276%0.762SS**  trans-45.7114.2-177.5-153.1176.5-174.4-142.75108.7K31 R35K31-R33 PolarHBondContact O-N 3.03Å; K31-R33 VanDerWaalsContact O-N 3.1Å; R33-R35 PolarHBondContact O-N 3.21Å
34K51.3Low51.5Low203 Ų203150 Ų15088%0.88374%0.737SS**  trans-45.3109.7179.9-80.6-177.5177.1176.50108.6G32 K36G32-K34 PolarHBondContact O-N 3.32Å; K34-K36 PolarHBondContact O-N 2.68Å
35R54.4Low53.6Low214 Ų214145.2 Ų145.281%0.80871%0.706SS**  trans-53.9119.7174.2-78.1-179.4164.2163.5-1.3106.7R33 K37R33-R35 PolarHBondContact O-N 3.21Å; R35-K37 PolarHBondContact O-N 3.23Å
36K48.7Very low55.3Low203 Ų203143 Ų14388%0.88370%0.703SS**  trans-57.7115.8176.8-70.5-167.4176.9-172.70106.9K34K34-K36 PolarHBondContact O-N 2.68Å
37K53.8Low57.3Low195 Ų195134.4 Ų134.485%0.84868%0.684SS**  trans-51.7133.6175.2-78.5174.2177177.40107.6R35 M39R35-K37 PolarHBondContact O-N 3.23Å; K37-M39 PolarHBondContact O-N 3.47Å
38P54.4Low59.7Low117 Ų117133.3 Ų133.376%0.7667%0.666SS**  trans-53.1142.5174.623-31.5000108.4K40P38-K40 VanDerWaalsContact C-N 3.34Å; P38-K40 PolarHBondContact O-N 2.96Å
39M56.3Low61.9Low113 Ų113131.4 Ų131.456%0.55765%0.646SS**  trans-61.6100.3-177-151.5176.2116.400107K37 K124K37-M39 PolarHBondContact O-N 3.47Å; M39-K124 HydrophobicContact CE-CD 4.19Å
40K59.3Low64.4Low181 Ų181124.7 Ų124.779%0.78763%0.63SS**  trans-80.2123.7178.6-166.3143.7-175.5176.40106.1P38 S42P38-K40 VanDerWaalsContact C-N 3.34Å; P38-K40 PolarHBondContact O-N 2.96Å; K40-S42 PolarHBondContact O-N 2.89Å
41D64.7Low66.5Low25 Ų25119 Ų11913%0.13460%0.595CS.*  trans-62.7119.5175.6-164.3-25.6000108.8N43 A44 Y112 F121D41-N43 PolarHBondContact O-N 3.26Å; D41-N43 PolarHBondContact OD1-N 2.99Å; D41-A44 HydrophobicContact CB-CB 3.86Å; D41-A44 PolarHBondContact O-N 3.42Å; D41-Y112 PolarHBondContact OD1-OH 3.45Å; D41-Y112 PolarHBondContact OD2-OH 2.88Å; D41-F121 HydrophobicContact CB-CD1 4.39Å; D41-F121 HydrophobicContact CB-CD2 3.8Å; D41-F121 HydrophobicContact CB-CE1 4.28Å; D41-F121 HydrophobicContact CB-CE2 3.67Å; D41-F121 HydrophobicContact CB-CG 4.17Å; D41-F121 HydrophobicContact CB-CZ 3.92Å; D41-F121 VanDerWaalsContact OD2-CB 3.25Å; D41-F121 WeakPolarHBondContact OD2-CB 3.33Å; D41-F121 WeakPolarHBondContact OD2-CD2 3.43Å; D41-F121 WeakPolarHBondContact OD2-CG 3.26Å
42S71.1Confident68.3Low118 Ų118112.8 Ų112.883%0.82557%0.567SS**THydrogen-bonded Turntrans-69.2-19.6-179.9-166.60000111.9K40K40-S42 PolarHBondContact O-N 2.89Å
43N69.8Low70.6Confident109 Ų109112.5 Ų112.558%0.58355%0.552SS**THydrogen-bonded Turntrans-95.4-6.8-179.1-62.1-28.4000112.6D41 Y112D41-N43 PolarHBondContact O-N 3.26Å; D41-N43 PolarHBondContact OD1-N 2.99Å; N43-Y112 HydrophobicContact CB-CE2 3.78Å; N43-Y112 WeakPolarHBondContact O-CD2 3.4Å; N43-Y112 WeakPolarHBondContact O-CE2 3.39Å
44A74.6Confident72.4Confident38 Ų38102.7 Ų102.731%0.31452%0.516SS..SBendtrans-72.3139.1176.200000110.9D41 Y112D41-A44 HydrophobicContact CB-CB 3.86Å; D41-A44 PolarHBondContact O-N 3.42Å; A44-Y112 HydrophobicContact CB-CD1 4.3Å; A44-Y112 HydrophobicContact CB-CE1 3.85Å
45P80.3Confident74.3Confident24 Ų2493.1 Ų93.116%0.15647%0.474CS..PPolyproline II helixtrans-52.3143.5171.4-26.434.9000111.3Y105 E108 Y112P45-Y105 HydrophobicContact CB-CD2 3.77Å; P45-Y105 HydrophobicContact CB-CE2 3.81Å; P45-Y105 WeakPolarHBondContact O-CE2 3.44Å; P45-E108 HydrophobicContact CB-CB 3.95Å; P45-E108 HydrophobicContact CG-CB 3.75Å; P45-Y112 HydrophobicContact CG-CG 4.41Å
46K80.6Confident76Confident186 Ų18683.8 Ų83.881%0.80944%0.44SS*.PPolyproline II helixtrans-73.6132178.1-71177.5-176.4171.10109.2Y105K46-Y105 WeakPolarHBondContact O-CD2 3.1Å
47A81.8Confident77.9Confident63 Ų6376.4 Ų76.452%0.52141%0.41SS..PPolyproline II helixtrans-56.2140.6179.100000111.5
48P86.1Confident79.5Confident41 Ų4170.9 Ų70.927%0.26639%0.389SS..PPolyproline II helixtrans-69.3143-176.630.2-34000109.8D101 K102 Y105P48-D101 WeakPolarHBondContact CA-OD1 3.33Å; P48-D101 HydrophobicContact CB-CB 4.44Å; P48-D101 WeakPolarHBondContact CB-OD1 3.48Å; P48-K102 HydrophobicContact CB-CB 4.29Å; P48-K102 HydrophobicContact CG-CB 4.28Å; P48-Y105 HydrophobicContact CG-CD1 4.06Å; P48-Y105 HydrophobicContact CG-CG 4.13Å
49L88Confident81.1Confident73 Ų7369.1 Ų69.138%0.38237%0.368SS..PPolyproline II helixtrans-84.2135.1174.6-65.2142.3000109.5V53 R54 A98L49-V53 HydrophobicContact CD2-CB 4.33Å; L49-V53 HydrophobicContact CD2-CG1 3.49Å; L49-V53 VanDerWaalsContact CD2-CG1 3.49Å; L49-R54 HydrophobicContact CB-CG 3.83Å; L49-R54 PolarHBondContact O-NE 3.09Å; L49-R54 PolarHBondContact O-NH2 3.21Å; L49-A98 WeakPolarHBondContact O-CB 3.4Å
50T90.8Very high82.6Confident83 Ų8367.1 Ų67.151%0.50935%0.354SS..PPolyproline II helixtrans-67.3157.5172.167.60000110.6Y52 V53 R54T50-Y52 PolarHBondContact O-N 2.91Å; T50-V53 PolarHBondContact O-N 3.33Å; T50-V53 VanDerWaalsContact OG1-CG2 3.31Å; T50-V53 WeakPolarHBondContact OG1-CG2 3.28Å; T50-V53 PolarHBondContact OG1-N 3.04Å; T50-R54 WeakPolarHBondContact O-CG 3.25Å; T50-R54 PolarHBondContact O-N 3.31Å
51G88.6Confident83.8Confident3 Ų365.7 Ų65.73%0.03135%0.35CS..Hα-helixtrans-56.4-39.8-178.700000112.8R54 F55 Y94G51-R54 WeakPolarHBondContact O-CB 3.38Å; G51-R54 PolarHBondContact O-N 3.4Å; G51-F55 PolarHBondContact O-N 3.27Å; G51-F55 VanDerWaalsContact O-N 3.07Å; G51-Y94 VanDerWaalsContact CA-O 3.25Å; G51-Y94 WeakPolarHBondContact CA-O 3.47Å
52Y87.5Confident84.8Confident78 Ų7868.3 Ų68.331%0.30636%0.362SS..Hα-helixtrans-60.8-47.2173.6176.8-120.1000112.8T50 R54 F55 M56 W83T50-Y52 PolarHBondContact O-N 2.91Å; Y52-R54 VanDerWaalsContact C-N 3.3Å; Y52-R54 PolarHBondContact O-N 3.06Å; Y52-F55 PolarHBondContact O-N 3.42Å; Y52-M56 HydrophobicContact CD1-CG 4.37Å; Y52-M56 HydrophobicContact CD2-CG 3.98Å; Y52-M56 HydrophobicContact CE1-CG 4.05Å; Y52-M56 HydrophobicContact CE2-CG 3.64Å; Y52-M56 HydrophobicContact CE2-SD 3.76Å; Y52-M56 HydrophobicContact CG-CG 4.36Å; Y52-M56 WeakPolarHBondContact O-CB 3.37Å; Y52-M56 WeakPolarHBondContact O-CG 3.48Å; Y52-M56 PolarHBondContact O-N 2.71Å; Y52-W83 HydrophobicContact CD2-CB 3.99Å; Y52-W83 AromaticContact CD2-CD1 3.3Å; Y52-W83 AromaticContact CD2-CD2 3.64Å; Y52-W83 HydrophobicContact CD2-CD2 3.64Å; Y52-W83 AromaticContact CD2-CE2 3.68Å; Y52-W83 HydrophobicContact CD2-CE3 4.46Å; Y52-W83 AromaticContact CD2-CG 3.37Å; Y52-W83 HydrophobicContact CD2-CG 3.37Å; Y52-W83 HydrophobicContact CD2-CZ2 4.49Å; Y52-W83 AromaticContact CD2-NE1 3.46Å; Y52-W83 HydrophobicContact CE2-CB 3.75Å; Y52-W83 AromaticContact CE2-CD1 3.57Å; Y52-W83 HydrophobicContact CE2-CD2 4.33Å; Y52-W83 AromaticContact CE2-CG 3.61Å; Y52-W83 HydrophobicContact CE2-CG 3.61Å
53V88.9Confident85.5Confident56 Ų5663.8 Ų63.834%0.33933%0.328SS..Hα-helixtrans-69.1-30.9-178.2179.60000111.4L49 T50 N57L49-V53 HydrophobicContact CD2-CB 4.33Å; L49-V53 HydrophobicContact CD2-CG1 3.49Å; L49-V53 VanDerWaalsContact CD2-CG1 3.49Å; T50-V53 PolarHBondContact O-N 3.33Å; T50-V53 VanDerWaalsContact OG1-CG2 3.31Å; T50-V53 WeakPolarHBondContact OG1-CG2 3.28Å; T50-V53 PolarHBondContact OG1-N 3.04Å; V53-N57 WeakPolarHBondContact O-CB 3.2Å; V53-N57 VanDerWaalsContact O-CG 3.26Å; V53-N57 PolarHBondContact O-N 3.2Å; V53-N57 PolarHBondContact O-ND2 3.36Å
54R88.9Confident86.2Confident34 Ų3464.4 Ų64.413%0.12832%0.322CS..Hα-helixtrans-60.6-57.3171-71177.7-177.3-79.6-25.8111.2L49 T50 G51 Y52 M56 N57 D58 Y94 D101L49-R54 HydrophobicContact CB-CG 3.83Å; L49-R54 PolarHBondContact O-NE 3.09Å; L49-R54 PolarHBondContact O-NH2 3.21Å; T50-R54 WeakPolarHBondContact O-CG 3.25Å; T50-R54 PolarHBondContact O-N 3.31Å; G51-R54 WeakPolarHBondContact O-CB 3.38Å; G51-R54 PolarHBondContact O-N 3.4Å; Y52-R54 VanDerWaalsContact C-N 3.3Å; Y52-R54 PolarHBondContact O-N 3.06Å; R54-M56 VanDerWaalsContact C-N 3.27Å; R54-M56 PolarHBondContact O-N 2.92Å; R54-N57 PolarHBondContact O-N 2.84Å; R54-D58 PolarHBondContact O-N 3.37Å; R54-Y94 HydrophobicContact CB-CD1 4.27Å; R54-D101 IonicContact CZ-OD2 3.06Å; R54-D101 IonicContact NH1-OD2 3.68Å; R54-D101 IonicContact NH2-OD1 3.72Å; R54-D101 IonicContact NH2-OD2 2.91Å; R54-D101 PolarHBondContact NH2-OD2 2.98Å
55F91Very high86.8Confident1 Ų166.5 Ų66.50%0.00434%0.34CS..Hα-helixtrans-52.1-47.8176.9169.3-95.3000111.9G51 Y52 N57 D58 R59 E82 W83 L86 Y94G51-F55 PolarHBondContact O-N 3.27Å; G51-F55 VanDerWaalsContact O-N 3.07Å; Y52-F55 PolarHBondContact O-N 3.42Å; F55-N57 VanDerWaalsContact C-N 3.32Å; F55-N57 PolarHBondContact O-N 3.44Å; F55-D58 PolarHBondContact O-N 3.44Å; F55-R59 HydrophobicContact CD2-CG 4.09Å; F55-R59 HydrophobicContact CE1-CG 4.43Å; F55-R59 HydrophobicContact CE2-CG 3.64Å; F55-R59 HydrophobicContact CZ-CG 3.83Å; F55-R59 WeakPolarHBondContact O-CB 3.39Å; F55-R59 PolarHBondContact O-N 2.88Å; F55-E82 HydrophobicContact CE1-CB 4.43Å; F55-E82 HydrophobicContact CZ-CB 4.07Å; F55-E82 HydrophobicContact CZ-CG 3.86Å; F55-W83 HydrophobicContact CB-CE3 3.64Å; F55-W83 HydrophobicContact CB-CZ3 3.56Å; F55-W83 HydrophobicContact CD1-CB 3.89Å; F55-W83 HydrophobicContact CD1-CD2 4.17Å; F55-W83 AromaticContact CD1-CE3 3.52Å; F55-W83 HydrophobicContact CD1-CE3 3.52Å; F55-W83 HydrophobicContact CD1-CG 4.36Å; F55-W83 HydrophobicContact CD1-CZ3 4.34Å; F55-W83 AromaticContact CD2-CE3 3.95Å; F55-W83 HydrophobicContact CD2-CE3 3.95Å; F55-W83 HydrophobicContact CD2-CZ3 4.25Å; F55-W83 HydrophobicContact CE1-CB 3.68Å; F55-W83 HydrophobicContact CE1-CE3 4.16Å; F55-W83 HydrophobicContact CG-CD2 4.44Å; F55-W83 AromaticContact CG-CE3 3.4Å; F55-W83 HydrophobicContact CG-CE3 3.4Å; F55-W83 AromaticContact CG-CZ3 3.79Å; F55-W83 HydrophobicContact CG-CZ3 3.79Å; F55-W83 HydrophobicContact CZ-CB 4.48Å; F55-L86 HydrophobicContact CD2-CD2 4.13Å; F55-L86 HydrophobicContact CE2-CD1 4.17Å; F55-L86 HydrophobicContact CE2-CD2 4.04Å; F55-Y94 HydrophobicContact CB-CD1 4.18Å; F55-Y94 HydrophobicContact CB-CD2 4.23Å; F55-Y94 HydrophobicContact CB-CE1 4.25Å; F55-Y94 HydrophobicContact CB-CE2 4.32Å; F55-Y94 HydrophobicContact CB-CG 4.17Å; F55-Y94 HydrophobicContact CD2-CD2 4.2Å; F55-Y94 AromaticContact CD2-CE2 3.64Å; F55-Y94 HydrophobicContact CD2-CE2 3.64Å; F55-Y94 AromaticContact CD2-CZ 3.84Å; F55-Y94 HydrophobicContact CG-CE2 4.45Å
56M90.4Very high87.1Confident19 Ų1971.4 Ų71.49%0.09436%0.361CS..Hα-helixtrans-60.6-39.4178-71.1-72.1-66.500112.3Y52 R54 R60 T76 L79Y52-M56 HydrophobicContact CD1-CG 4.37Å; Y52-M56 HydrophobicContact CD2-CG 3.98Å; Y52-M56 HydrophobicContact CE1-CG 4.05Å; Y52-M56 HydrophobicContact CE2-CG 3.64Å; Y52-M56 HydrophobicContact CE2-SD 3.76Å; Y52-M56 HydrophobicContact CG-CG 4.36Å; Y52-M56 WeakPolarHBondContact O-CB 3.37Å; Y52-M56 WeakPolarHBondContact O-CG 3.48Å; Y52-M56 PolarHBondContact O-N 2.71Å; R54-M56 VanDerWaalsContact C-N 3.27Å; R54-M56 PolarHBondContact O-N 2.92Å; M56-R60 WeakPolarHBondContact O-CB 3.44Å; M56-R60 PolarHBondContact O-N 3.42Å; M56-T76 HydrophobicContact CE-CG2 3.54Å; M56-L79 HydrophobicContact CE-CB 3.74Å; M56-L79 HydrophobicContact CE-CD1 4.2Å; M56-L79 HydrophobicContact SD-CB 3.31Å; M56-L79 WeakPolarHBondContact SD-CB 3.45Å; M56-L79 HydrophobicContact SD-CD1 4.32Å; M56-L79 HydrophobicContact SD-CG 4.45Å
57N88.8Confident87.2Confident47 Ų4770.1 Ų70.125%0.25135%0.35SS..Hα-helixtrans-69.3-46178.7-76.8-26.8000111.6V53 R54 F55 R60 E61V53-N57 WeakPolarHBondContact O-CB 3.2Å; V53-N57 VanDerWaalsContact O-CG 3.26Å; V53-N57 PolarHBondContact O-N 3.2Å; V53-N57 PolarHBondContact O-ND2 3.36Å; R54-N57 PolarHBondContact O-N 2.84Å; F55-N57 VanDerWaalsContact C-N 3.32Å; F55-N57 PolarHBondContact O-N 3.44Å; N57-R60 PolarHBondContact O-N 2.74Å; N57-R60 PolarHBondContact OD1-NH2 3.29Å; N57-E61 PolarHBondContact O-N 3.38Å
58D87.8Confident87.3Confident79 Ų7971.4 Ų71.442%0.42235%0.353SS..Hα-helixtrans-63.7-46.6-177.4-63.7-9.6000110.9R54 F55R54-D58 PolarHBondContact O-N 3.37Å; F55-D58 PolarHBondContact O-N 3.44Å
59R87.8Confident87.3Confident81 Ų8176.2 Ų76.231%0.30638%0.377SS..Hα-helixtrans-75.8-31.2179.5-72.5-59.8-138-171.8-0.9113.7F55 E61 Q62 L63 L79 E82F55-R59 HydrophobicContact CD2-CG 4.09Å; F55-R59 HydrophobicContact CE1-CG 4.43Å; F55-R59 HydrophobicContact CE2-CG 3.64Å; F55-R59 HydrophobicContact CZ-CG 3.83Å; F55-R59 WeakPolarHBondContact O-CB 3.39Å; F55-R59 PolarHBondContact O-N 2.88Å; R59-E61 VanDerWaalsContact C-N 3.28Å; R59-E61 PolarHBondContact O-N 2.96Å; R59-Q62 WeakPolarHBondContact O-CB 3.44Å; R59-Q62 PolarHBondContact O-N 2.94Å; R59-L63 WeakPolarHBondContact O-CD1 3.3Å; R59-L63 PolarHBondContact O-N 3.5Å; R59-L79 HydrophobicContact CB-CD2 3.34Å; R59-L79 HydrophobicContact CG-CD2 4.34Å; R59-E82 IonicContact CZ-OE1 2.72Å; R59-E82 IonicContact NE-OE1 3.2Å; R59-E82 PolarHBondContact NE-OE1 3.49Å; R59-E82 IonicContact NH2-OE1 3.69Å; R59-E82 PolarHBondContact NH2-OE1 3.09Å
60R87.1Confident87.1Confident70 Ų7074.7 Ų74.726%0.26437%0.371SS..Hα-helixtrans-63.6-34.2179-178.3-177.969.7-154-12.3112.8M56 N57 R64 I75 L79M56-R60 WeakPolarHBondContact O-CB 3.44Å; M56-R60 PolarHBondContact O-N 3.42Å; N57-R60 PolarHBondContact O-N 2.74Å; N57-R60 PolarHBondContact OD1-NH2 3.29Å; R60-R64 VanDerWaalsContact O-CB 3.25Å; R60-R64 WeakPolarHBondContact O-CB 3.25Å; R60-R64 PolarHBondContact O-N 3.39Å; R60-R64 VanDerWaalsContact O-N 3.08Å; R60-I75 HydrophobicContact CG-CG2 4.18Å; R60-L79 HydrophobicContact CB-CD1 3.59Å; R60-L79 HydrophobicContact CG-CD1 4.29Å
61E85.8Confident86.9Confident151 Ų15174.7 Ų74.771%0.70637%0.372SS*.Hα-helixtrans-67-42.8175.8-172.5160.1-147.600111.1N57 R59 R64 A65N57-E61 PolarHBondContact O-N 3.38Å; R59-E61 VanDerWaalsContact C-N 3.28Å; R59-E61 PolarHBondContact O-N 2.96Å; E61-R64 PolarHBondContact O-N 3.3Å; E61-A65 PolarHBondContact O-N 2.89Å; E61-A65 VanDerWaalsContact O-N 3.08Å
62Q85.7Confident86.5Confident81 Ų8179.3 Ų79.338%0.37939%0.392SS..Hα-helixtrans-61.9-51.9176-62.8169.710.300111.7R59 R64 A65 E66R59-Q62 WeakPolarHBondContact O-CB 3.44Å; R59-Q62 PolarHBondContact O-N 2.94Å; Q62-R64 VanDerWaalsContact C-N 3.27Å; Q62-R64 PolarHBondContact O-N 3.46Å; Q62-A65 WeakPolarHBondContact O-CB 3.44Å; Q62-A65 PolarHBondContact O-N 3.32Å; Q62-A65 VanDerWaalsContact O-N 3.07Å; Q62-E66 WeakPolarHBondContact O-CG 3.43Å; Q62-E66 PolarHBondContact O-N 2.97Å
63L85.1Confident86.3Confident22 Ų2279.5 Ų79.512%0.11540%0.403CS..Hα-helixtrans-64.4-31.2-179.9-91.471.2000112.8R59 R67 I75 M78 L79R59-L63 WeakPolarHBondContact O-CD1 3.3Å; R59-L63 PolarHBondContact O-N 3.5Å; L63-R67 WeakPolarHBondContact O-CA 3.37Å; L63-R67 WeakPolarHBondContact O-CB 3.28Å; L63-R67 PolarHBondContact O-N 3.49Å; L63-I75 HydrophobicContact CB-CG2 3.92Å; L63-I75 HydrophobicContact CD2-CG2 4.17Å; L63-M78 HydrophobicContact CD2-CB 4.39Å; L63-L79 HydrophobicContact CD1-CD2 3.93Å; L63-L79 HydrophobicContact CD2-CD2 3.69Å; L63-L79 HydrophobicContact CD2-CG 4.07Å; L63-L79 HydrophobicContact CG-CD2 4.36Å
64R85.4Confident86.1Confident122 Ų12280.3 Ų80.346%0.4640%0.402SS..Hα-helixtrans-71-34.3175.2-170.8-175.4-57.8165.43.6111.9R60 E61 Q62 P68 I75R60-R64 VanDerWaalsContact O-CB 3.25Å; R60-R64 WeakPolarHBondContact O-CB 3.25Å; R60-R64 PolarHBondContact O-N 3.39Å; R60-R64 VanDerWaalsContact O-N 3.08Å; E61-R64 PolarHBondContact O-N 3.3Å; Q62-R64 VanDerWaalsContact C-N 3.27Å; Q62-R64 PolarHBondContact O-N 3.46Å; R64-P68 WeakPolarHBondContact O-CA 3.47Å; R64-I75 HydrophobicContact CB-CD1 4.44Å
65A86.3Confident85.9Confident83 Ų8379 Ų7969%0.68640%0.398SS*.Hα-helixtrans-71.6-40.2175.500000111.6E61 Q62E61-A65 PolarHBondContact O-N 2.89Å; E61-A65 VanDerWaalsContact O-N 3.08Å; Q62-A65 WeakPolarHBondContact O-CB 3.44Å; Q62-A65 PolarHBondContact O-N 3.32Å; Q62-A65 VanDerWaalsContact O-N 3.07Å
66E86.6Confident85.7Confident127 Ų12779.5 Ų79.559%0.59340%0.401SS*.Hα-helixtrans-74.7-34.7178.7-69.5172.8-164.100113.1Q62Q62-E66 WeakPolarHBondContact O-CG 3.43Å; Q62-E66 PolarHBondContact O-N 2.97Å
67R82.9Confident85.5Confident158 Ų15884.6 Ų84.660%0.59642%0.42SS*.  trans-133.669.8-174.2-57.9-64.6176.2178-0.8110.6L63 D69 V70L63-R67 WeakPolarHBondContact O-CA 3.37Å; L63-R67 WeakPolarHBondContact O-CB 3.28Å; L63-R67 PolarHBondContact O-N 3.49Å; R67-D69 PolarHBondContact O-N 2.9Å; R67-V70 HydrophobicContact CB-CB 4.25Å; R67-V70 HydrophobicContact CB-CG2 3.78Å; R67-V70 PolarHBondContact O-N 3.25Å
68P84.7Confident85.3Confident90 Ų9086.9 Ų86.958%0.58443%0.43SS*.THydrogen-bonded Turntrans-64.4-21.8179.926.5-34000113R64 V70R64-P68 WeakPolarHBondContact O-CA 3.47Å; P68-V70 VanDerWaalsContact C-N 3.3Å; P68-V70 PolarHBondContact O-N 3.36Å
69D85.1Confident85.4Confident143 Ų14383.1 Ų83.177%0.76541%0.41SS*.THydrogen-bonded Turntrans-78-16.3-176.9-37-43.6000112.9R67R67-D69 PolarHBondContact O-N 2.9Å
70V84.6Confident85.4Confident40 Ų4079.8 Ų79.824%0.24240%0.4CS..SBendtrans-86.2127.5-174.2178.80000109.9R67 P68 E74 I75R67-V70 HydrophobicContact CB-CB 4.25Å; R67-V70 HydrophobicContact CB-CG2 3.78Å; R67-V70 PolarHBondContact O-N 3.25Å; P68-V70 VanDerWaalsContact C-N 3.3Å; P68-V70 PolarHBondContact O-N 3.36Å; V70-E74 HydrophobicContact CG1-CB 3.57Å; V70-E74 HydrophobicContact CG1-CG 3.49Å; V70-E74 VanDerWaalsContact CG1-CG 3.49Å; V70-I75 HydrophobicContact CB-CD1 4.44Å; V70-I75 HydrophobicContact CB-CG1 4.06Å; V70-I75 HydrophobicContact CG1-CG1 3.67Å; V70-I75 WeakPolarHBondContact O-CD1 3.28Å
71P86.1Confident85.5Confident84 Ų8481 Ų8155%0.54541%0.412SS..  trans-69147-176.927.3-33.5000111.6P73 E74 I75P71-P73 VanDerWaalsContact C-N 3.34Å; P71-P73 VanDerWaalsContact O-N 3.12Å; P71-E74 HydrophobicContact CG-CB 3.99Å; P71-E74 WeakPolarHBondContact O-CA 3.47Å; P71-E74 VanDerWaalsContact O-CB 3.26Å; P71-E74 WeakPolarHBondContact O-CB 3.42Å; P71-E74 PolarHBondContact O-N 2.81Å; P71-I75 PolarHBondContact O-N 3.3Å
72F79.4Confident85.7Confident99 Ų9976.4 Ų76.443%0.43439%0.391SS..Hα-helixtrans-47.8-41.6-175.7175.3-90000115.9E74 I75 T76F72-E74 VanDerWaalsContact C-N 3.31Å; F72-E74 PolarHBondContact O-N 2.61Å; F72-I75 PolarHBondContact O-N 3.45Å; F72-T76 WeakPolarHBondContact O-CB 3.48Å; F72-T76 PolarHBondContact O-N 3.42Å; F72-T76 PolarHBondContact O-OG1 3.19Å
73P84.8Confident85.9Confident83 Ų8373.7 Ų73.754%0.53938%0.377SS..Hα-helixtrans-64-34.1177-22.335.3000113.4P71 T76 R77P71-P73 VanDerWaalsContact C-N 3.34Å; P71-P73 VanDerWaalsContact O-N 3.12Å; P73-T76 PolarHBondContact O-N 3.41Å; P73-R77 PolarHBondContact O-N 3.36Å; P73-R77 VanDerWaalsContact O-N 3.11Å
74E84.6Confident86.1Confident72 Ų7277 Ų7734%0.33640%0.402SS..Hα-helixtrans-68.8-47.9178.3-171.567.1-145.700110.3V70 P71 F72 T76 R77 M78V70-E74 HydrophobicContact CG1-CB 3.57Å; V70-E74 HydrophobicContact CG1-CG 3.49Å; V70-E74 VanDerWaalsContact CG1-CG 3.49Å; P71-E74 HydrophobicContact CG-CB 3.99Å; P71-E74 WeakPolarHBondContact O-CA 3.47Å; P71-E74 VanDerWaalsContact O-CB 3.26Å; P71-E74 WeakPolarHBondContact O-CB 3.42Å; P71-E74 PolarHBondContact O-N 2.81Å; F72-E74 VanDerWaalsContact C-N 3.31Å; F72-E74 PolarHBondContact O-N 2.61Å; E74-T76 VanDerWaalsContact C-N 3.28Å; E74-T76 PolarHBondContact O-N 3.48Å; E74-R77 PolarHBondContact O-N 2.96Å; E74-R77 VanDerWaalsContact O-N 3.12Å; E74-R77 IonicContact OE1-CZ 3.14Å; E74-R77 IonicContact OE1-NH1 3.47Å; E74-R77 PolarHBondContact OE1-NH1 2.89Å; E74-R77 IonicContact OE2-CZ 2.73Å; E74-R77 IonicContact OE2-NH1 2.75Å; E74-R77 PolarHBondContact OE2-NH1 2.97Å; E74-R77 IonicContact OE2-NH2 2.65Å; E74-R77 PolarHBondContact OE2-NH2 3.03Å; E74-M78 WeakPolarHBondContact O-CG 3.48Å; E74-M78 PolarHBondContact O-N 3.11Å
75I84.9Confident86.4Confident6 Ų679.9 Ų79.93%0.03142%0.418CS..Hα-helixtrans-55.2-46.6173.9-59.4-179.5000110.3R60 L63 R64 V70 P71 F72 R77 M78 L79R60-I75 HydrophobicContact CG-CG2 4.18Å; L63-I75 HydrophobicContact CB-CG2 3.92Å; L63-I75 HydrophobicContact CD2-CG2 4.17Å; R64-I75 HydrophobicContact CB-CD1 4.44Å; V70-I75 HydrophobicContact CB-CD1 4.44Å; V70-I75 HydrophobicContact CB-CG1 4.06Å; V70-I75 HydrophobicContact CG1-CG1 3.67Å; V70-I75 WeakPolarHBondContact O-CD1 3.28Å; P71-I75 PolarHBondContact O-N 3.3Å; F72-I75 PolarHBondContact O-N 3.45Å; I75-R77 VanDerWaalsContact C-N 3.29Å; I75-R77 PolarHBondContact O-N 3.45Å; I75-M78 PolarHBondContact O-N 3Å; I75-L79 HydrophobicContact CG2-CD1 3.98Å; I75-L79 HydrophobicContact CG2-CG 4.39Å; I75-L79 VanDerWaalsContact O-CG 3.27Å; I75-L79 WeakPolarHBondContact O-CG 3.3Å; I75-L79 PolarHBondContact O-N 3.31Å
76T85.6Confident86.5Confident13 Ų1377 Ų778%0.0839%0.391CS..Hα-helixtrans-63.4-35.7-178.3-55.10000112.1M56 F72 P73 E74 G80 F165M56-T76 HydrophobicContact CE-CG2 3.54Å; F72-T76 WeakPolarHBondContact O-CB 3.48Å; F72-T76 PolarHBondContact O-N 3.42Å; F72-T76 PolarHBondContact O-OG1 3.19Å; P73-T76 PolarHBondContact O-N 3.41Å; E74-T76 VanDerWaalsContact C-N 3.28Å; E74-T76 PolarHBondContact O-N 3.48Å; T76-G80 PolarHBondContact O-N 3.28Å; T76-G80 VanDerWaalsContact O-N 3.1Å; T76-F165 HydrophobicContact CG2-CE2 3.6Å; T76-F165 HydrophobicContact CG2-CZ 3.79Å
77R86.9Confident86.8Confident126 Ų12673.6 Ų73.648%0.47538%0.38SS..Hα-helixtrans-69.8-42.9176.2-162.8-174.4-31.295.14.7112.1P73 E74 I75 L79 G80 N81P73-R77 PolarHBondContact O-N 3.36Å; P73-R77 VanDerWaalsContact O-N 3.11Å; E74-R77 PolarHBondContact O-N 2.96Å; E74-R77 VanDerWaalsContact O-N 3.12Å; E74-R77 IonicContact OE1-CZ 3.14Å; E74-R77 IonicContact OE1-NH1 3.47Å; E74-R77 PolarHBondContact OE1-NH1 2.89Å; E74-R77 IonicContact OE2-CZ 2.73Å; E74-R77 IonicContact OE2-NH1 2.75Å; E74-R77 PolarHBondContact OE2-NH1 2.97Å; E74-R77 IonicContact OE2-NH2 2.65Å; E74-R77 PolarHBondContact OE2-NH2 3.03Å; I75-R77 VanDerWaalsContact C-N 3.29Å; I75-R77 PolarHBondContact O-N 3.45Å; R77-L79 VanDerWaalsContact C-N 3.29Å; R77-L79 PolarHBondContact O-N 3.33Å; R77-G80 PolarHBondContact O-N 2.79Å; R77-N81 PolarHBondContact O-N 3.45Å; R77-N81 VanDerWaalsContact O-N 3.11Å
78M85.2Confident87.1Confident94 Ų9470.8 Ų70.846%0.46338%0.382SS..Hα-helixtrans-57.6-44.8176.3-67.7176.370.400111.1L63 E74 I75 N81 E82L63-M78 HydrophobicContact CD2-CB 4.39Å; E74-M78 WeakPolarHBondContact O-CG 3.48Å; E74-M78 PolarHBondContact O-N 3.11Å; I75-M78 PolarHBondContact O-N 3Å; M78-N81 WeakPolarHBondContact O-CB 3.49Å; M78-N81 PolarHBondContact O-N 3.45Å; M78-E82 PolarHBondContact O-N 3.26Å
79L89.1Confident87.4Confident0 Ų073.5 Ų73.50%039%0.387CS..Hα-helixtrans-67.3-37.2178.4-64.9174000113.5M56 R59 R60 L63 I75 R77 N81 E82 W83M56-L79 HydrophobicContact CE-CB 3.74Å; M56-L79 HydrophobicContact CE-CD1 4.2Å; M56-L79 HydrophobicContact SD-CB 3.31Å; M56-L79 WeakPolarHBondContact SD-CB 3.45Å; M56-L79 HydrophobicContact SD-CD1 4.32Å; M56-L79 HydrophobicContact SD-CG 4.45Å; R59-L79 HydrophobicContact CB-CD2 3.34Å; R59-L79 HydrophobicContact CG-CD2 4.34Å; R60-L79 HydrophobicContact CB-CD1 3.59Å; R60-L79 HydrophobicContact CG-CD1 4.29Å; L63-L79 HydrophobicContact CD1-CD2 3.93Å; L63-L79 HydrophobicContact CD2-CD2 3.69Å; L63-L79 HydrophobicContact CD2-CG 4.07Å; L63-L79 HydrophobicContact CG-CD2 4.36Å; I75-L79 HydrophobicContact CG2-CD1 3.98Å; I75-L79 HydrophobicContact CG2-CG 4.39Å; I75-L79 VanDerWaalsContact O-CG 3.27Å; I75-L79 WeakPolarHBondContact O-CG 3.3Å; I75-L79 PolarHBondContact O-N 3.31Å; R77-L79 VanDerWaalsContact C-N 3.29Å; R77-L79 PolarHBondContact O-N 3.33Å; L79-N81 VanDerWaalsContact C-N 3.27Å; L79-N81 PolarHBondContact O-N 3.34Å; L79-E82 PolarHBondContact O-N 3.46Å; L79-W83 PolarHBondContact O-N 2.91Å
80G88.8Confident87.5Confident11 Ų1170.4 Ų70.411%0.11337%0.368CS..Hα-helixtrans-61.2-38.6173.700000112.3T76 R77 S84T76-G80 PolarHBondContact O-N 3.28Å; T76-G80 VanDerWaalsContact O-N 3.1Å; R77-G80 PolarHBondContact O-N 2.79Å; G80-S84 PolarHBondContact O-N 3.4Å; G80-S84 PolarHBondContact O-OG 2.95Å
81N89.1Confident87.7Confident96 Ų9672.1 Ų72.151%0.51337%0.372SS..Hα-helixtrans-69.1-39.6173.8-69.5-17000111.9R77 M78 L79 S84 K85R77-N81 PolarHBondContact O-N 3.45Å; R77-N81 VanDerWaalsContact O-N 3.11Å; M78-N81 WeakPolarHBondContact O-CB 3.49Å; M78-N81 PolarHBondContact O-N 3.45Å; L79-N81 VanDerWaalsContact C-N 3.27Å; L79-N81 PolarHBondContact O-N 3.34Å; N81-S84 PolarHBondContact O-N 2.87Å; N81-K85 WeakPolarHBondContact O-CG 3.36Å; N81-K85 PolarHBondContact O-N 2.99Å
82E89.4Confident87.9Confident54 Ų5472.6 Ų72.625%0.25237%0.367SS..Hα-helixtrans-61.8-46.1176.3-166.3-175.8157.700111.3F55 R59 M78 L79 S84 K85 L86F55-E82 HydrophobicContact CE1-CB 4.43Å; F55-E82 HydrophobicContact CZ-CB 4.07Å; F55-E82 HydrophobicContact CZ-CG 3.86Å; R59-E82 IonicContact CZ-OE1 2.72Å; R59-E82 IonicContact NE-OE1 3.2Å; R59-E82 PolarHBondContact NE-OE1 3.49Å; R59-E82 IonicContact NH2-OE1 3.69Å; R59-E82 PolarHBondContact NH2-OE1 3.09Å; M78-E82 PolarHBondContact O-N 3.26Å; L79-E82 PolarHBondContact O-N 3.46Å; E82-S84 VanDerWaalsContact C-N 3.26Å; E82-S84 PolarHBondContact O-N 3.43Å; E82-K85 CarbonylContact O-C 3.53Å; E82-K85 PolarHBondContact O-N 2.92Å; E82-K85 VanDerWaalsContact O-N 3.1Å; E82-L86 PolarHBondContact O-N 3.44Å
83W90.1Very high88.6Confident25 Ų2574.3 Ų74.310%0.09537%0.371CS..Hα-helixtrans-59-37.2175.9177-107.5000113.2Y52 F55 L79 K85 L86 K91 Y94Y52-W83 HydrophobicContact CD2-CB 3.99Å; Y52-W83 AromaticContact CD2-CD1 3.3Å; Y52-W83 AromaticContact CD2-CD2 3.64Å; Y52-W83 HydrophobicContact CD2-CD2 3.64Å; Y52-W83 AromaticContact CD2-CE2 3.68Å; Y52-W83 HydrophobicContact CD2-CE3 4.46Å; Y52-W83 AromaticContact CD2-CG 3.37Å; Y52-W83 HydrophobicContact CD2-CG 3.37Å; Y52-W83 HydrophobicContact CD2-CZ2 4.49Å; Y52-W83 AromaticContact CD2-NE1 3.46Å; Y52-W83 HydrophobicContact CE2-CB 3.75Å; Y52-W83 AromaticContact CE2-CD1 3.57Å; Y52-W83 HydrophobicContact CE2-CD2 4.33Å; Y52-W83 AromaticContact CE2-CG 3.61Å; Y52-W83 HydrophobicContact CE2-CG 3.61Å; F55-W83 HydrophobicContact CB-CE3 3.64Å; F55-W83 HydrophobicContact CB-CZ3 3.56Å; F55-W83 HydrophobicContact CD1-CB 3.89Å; F55-W83 HydrophobicContact CD1-CD2 4.17Å; F55-W83 AromaticContact CD1-CE3 3.52Å; F55-W83 HydrophobicContact CD1-CE3 3.52Å; F55-W83 HydrophobicContact CD1-CG 4.36Å; F55-W83 HydrophobicContact CD1-CZ3 4.34Å; F55-W83 AromaticContact CD2-CE3 3.95Å; F55-W83 HydrophobicContact CD2-CE3 3.95Å; F55-W83 HydrophobicContact CD2-CZ3 4.25Å; F55-W83 HydrophobicContact CE1-CB 3.68Å; F55-W83 HydrophobicContact CE1-CE3 4.16Å; F55-W83 HydrophobicContact CG-CD2 4.44Å; F55-W83 AromaticContact CG-CE3 3.4Å; F55-W83 HydrophobicContact CG-CE3 3.4Å; F55-W83 AromaticContact CG-CZ3 3.79Å; F55-W83 HydrophobicContact CG-CZ3 3.79Å; F55-W83 HydrophobicContact CZ-CB 4.48Å; L79-W83 PolarHBondContact O-N 2.91Å; W83-K85 VanDerWaalsContact C-N 3.27Å; W83-K85 PolarHBondContact O-N 3.28Å; W83-L86 HydrophobicContact CE3-CD2 3.82Å; W83-L86 HydrophobicContact CZ3-CD2 3.92Å; W83-L86 WeakPolarHBondContact O-CB 3.38Å; W83-L86 PolarHBondContact O-N 3.14Å; W83-K91 HydrophobicContact CH2-CB 4.46Å; W83-K91 HydrophobicContact CH2-CG 3.52Å; W83-K91 HydrophobicContact CZ2-CD 4.15Å; W83-K91 HydrophobicContact CZ2-CG 3.57Å; W83-K91 HydrophobicContact CZ3-CG 4.03Å; W83-Y94 AromaticContact CZ3-CD2 3.9Å; W83-Y94 HydrophobicContact CZ3-CD2 3.9Å; W83-Y94 HydrophobicContact CZ3-CG 4.22Å
84S89.3Confident88.9Confident92 Ų9271.7 Ų71.764%0.64335%0.35SS*.Hα-helixtrans-71.4-25.9-179.9-57.90000112.3G80 N81 E82G80-S84 PolarHBondContact O-N 3.4Å; G80-S84 PolarHBondContact O-OG 2.95Å; N81-S84 PolarHBondContact O-N 2.87Å; E82-S84 VanDerWaalsContact C-N 3.26Å; E82-S84 PolarHBondContact O-N 3.43Å
85K90.3Very high89.1Confident181 Ų18171.8 Ų71.879%0.78735%0.353SS*.Hα-helixtrans-97.5-1.5178-65.6178-178.8-177.30113.3N81 E82 W83N81-K85 WeakPolarHBondContact O-CG 3.36Å; N81-K85 PolarHBondContact O-N 2.99Å; E82-K85 CarbonylContact O-C 3.53Å; E82-K85 PolarHBondContact O-N 2.92Å; E82-K85 VanDerWaalsContact O-N 3.1Å; W83-K85 VanDerWaalsContact C-N 3.27Å; W83-K85 PolarHBondContact O-N 3.28Å
86L90Very high89.4Confident23 Ų2375 Ų7512%0.1237%0.37CS..SBendtrans-68.1139.1-175.6-161.770.7000110.7F55 E82 W83 E90 K91 Y94F55-L86 HydrophobicContact CD2-CD2 4.13Å; F55-L86 HydrophobicContact CE2-CD1 4.17Å; F55-L86 HydrophobicContact CE2-CD2 4.04Å; E82-L86 PolarHBondContact O-N 3.44Å; W83-L86 HydrophobicContact CE3-CD2 3.82Å; W83-L86 HydrophobicContact CZ3-CD2 3.92Å; W83-L86 WeakPolarHBondContact O-CB 3.38Å; W83-L86 PolarHBondContact O-N 3.14Å; L86-E90 HydrophobicContact CD1-CB 4.28Å; L86-E90 WeakPolarHBondContact CD1-OE2 3.4Å; L86-E90 HydrophobicContact CD2-CB 3.96Å; L86-E90 HydrophobicContact CG-CB 3.89Å; L86-K91 HydrophobicContact CD2-CB 4.3Å; L86-Y94 HydrophobicContact CD2-CD2 4.27Å; L86-Y94 HydrophobicContact CD2-CE2 4.22Å
87P92.8Very high89.6Confident55 Ų5577.8 Ų77.836%0.35738%0.382SS..  trans-55.6145.2174.8-25.934.5000112.1E89 E90 K91P87-E89 PolarHBondContact O-N 3.5Å; P87-E90 PolarHBondContact O-N 3.02Å; P87-K91 WeakPolarHBondContact O-CB 3.24Å; P87-K91 PolarHBondContact O-N 3.38Å
88P89.1Confident89.8Confident100 Ų10072.3 Ų72.365%0.64936%0.364SS*.Hα-helixtrans-55.3-37178.2-25.634.7000113.2K91 Q92P88-K91 PolarHBondContact O-N 2.96Å; P88-Q92 VanDerWaalsContact O-CB 3.25Å; P88-Q92 WeakPolarHBondContact O-CB 3.26Å; P88-Q92 PolarHBondContact O-N 2.88Å
89E89.6Confident89.9Confident147 Ų14771.9 Ų71.969%0.68736%0.361SS*.Hα-helixtrans-65.2-43.7-179.8-57.393.8175.700112P87 Q92 R93P87-E89 PolarHBondContact O-N 3.5Å; E89-Q92 PolarHBondContact O-N 3.36Å; E89-R93 PolarHBondContact O-N 3.05Å; E89-R93 VanDerWaalsContact O-N 3.08Å
90E87.2Confident89.9Confident77 Ų7778.1 Ų78.136%0.3638%0.384SS..Hα-helixtrans-69.3-39.7178.1-70.4-164.5-165.100111.7L86 P87 Q92 R93 Y94L86-E90 HydrophobicContact CD1-CB 4.28Å; L86-E90 WeakPolarHBondContact CD1-OE2 3.4Å; L86-E90 HydrophobicContact CD2-CB 3.96Å; L86-E90 HydrophobicContact CG-CB 3.89Å; P87-E90 PolarHBondContact O-N 3.02Å; E90-Q92 VanDerWaalsContact C-N 3.31Å; E90-Q92 PolarHBondContact O-N 3.32Å; E90-R93 WeakPolarHBondContact O-CB 3.46Å; E90-R93 PolarHBondContact O-N 3.03Å; E90-Y94 WeakPolarHBondContact O-CD2 3.48Å; E90-Y94 PolarHBondContact O-N 3.33Å
91K90.6Very high90Very high76 Ų7678.1 Ų78.133%0.3338%0.382SS..Hα-helixtrans-60.8-43.5174.7-166176.6-175.5171.40111W83 L86 P87 P88 R93 Y94 L95W83-K91 HydrophobicContact CH2-CB 4.46Å; W83-K91 HydrophobicContact CH2-CG 3.52Å; W83-K91 HydrophobicContact CZ2-CD 4.15Å; W83-K91 HydrophobicContact CZ2-CG 3.57Å; W83-K91 HydrophobicContact CZ3-CG 4.03Å; L86-K91 HydrophobicContact CD2-CB 4.3Å; P87-K91 WeakPolarHBondContact O-CB 3.24Å; P87-K91 PolarHBondContact O-N 3.38Å; P88-K91 PolarHBondContact O-N 2.96Å; K91-R93 VanDerWaalsContact C-N 3.35Å; K91-R93 PolarHBondContact O-N 2.89Å; K91-Y94 PolarHBondContact O-N 3.38Å; K91-L95 WeakPolarHBondContact O-CG 3.36Å; K91-L95 PolarHBondContact O-N 2.91Å; K91-L95 VanDerWaalsContact O-N 3.13Å
92Q90.3Very high89.9Confident95 Ų9577.7 Ų77.744%0.44438%0.375SS..Hα-helixtrans-61.8-42.1178.5-168.861.433.300111.4P88 E89 E90 Y94 L95 D96P88-Q92 VanDerWaalsContact O-CB 3.25Å; P88-Q92 WeakPolarHBondContact O-CB 3.26Å; P88-Q92 PolarHBondContact O-N 2.88Å; E89-Q92 PolarHBondContact O-N 3.36Å; E90-Q92 VanDerWaalsContact C-N 3.31Å; E90-Q92 PolarHBondContact O-N 3.32Å; Q92-Y94 VanDerWaalsContact C-N 3.27Å; Q92-Y94 PolarHBondContact O-N 3.38Å; Q92-L95 CarbonylContact O-C 3.59Å; Q92-L95 WeakPolarHBondContact O-CA 3.34Å; Q92-L95 WeakPolarHBondContact O-CB 3.41Å; Q92-L95 PolarHBondContact O-N 3.21Å; Q92-D96 PolarHBondContact NE2-OD1 3.28Å; Q92-D96 VanDerWaalsContact O-CG 3.27Å; Q92-D96 PolarHBondContact O-N 2.87Å
93R92.8Very high89.7Confident134 Ų13479.6 Ų79.651%0.50638%0.384SS..Hα-helixtrans-53.2-43.2175.2-170.4-176.471.6-152.50.3112.7E89 E90 K91 E97E89-R93 PolarHBondContact O-N 3.05Å; E89-R93 VanDerWaalsContact O-N 3.08Å; E90-R93 WeakPolarHBondContact O-CB 3.46Å; E90-R93 PolarHBondContact O-N 3.03Å; K91-R93 VanDerWaalsContact C-N 3.35Å; K91-R93 PolarHBondContact O-N 2.89Å; R93-E97 WeakPolarHBondContact O-CB 3.39Å; R93-E97 PolarHBondContact O-N 3.24Å; R93-E97 VanDerWaalsContact O-N 3.1Å
94Y91.3Very high89.7Confident29 Ų2982.9 Ų82.911%0.11440%0.397CS..Hα-helixtrans-71.7-32.6177.5-70.4-73000113.1G51 R54 F55 W83 L86 E90 K91 Q92 A98G51-Y94 VanDerWaalsContact CA-O 3.25Å; G51-Y94 WeakPolarHBondContact CA-O 3.47Å; R54-Y94 HydrophobicContact CB-CD1 4.27Å; F55-Y94 HydrophobicContact CB-CD1 4.18Å; F55-Y94 HydrophobicContact CB-CD2 4.23Å; F55-Y94 HydrophobicContact CB-CE1 4.25Å; F55-Y94 HydrophobicContact CB-CE2 4.32Å; F55-Y94 HydrophobicContact CB-CG 4.17Å; F55-Y94 HydrophobicContact CD2-CD2 4.2Å; F55-Y94 AromaticContact CD2-CE2 3.64Å; F55-Y94 HydrophobicContact CD2-CE2 3.64Å; F55-Y94 AromaticContact CD2-CZ 3.84Å; F55-Y94 HydrophobicContact CG-CE2 4.45Å; W83-Y94 AromaticContact CZ3-CD2 3.9Å; W83-Y94 HydrophobicContact CZ3-CD2 3.9Å; W83-Y94 HydrophobicContact CZ3-CG 4.22Å; L86-Y94 HydrophobicContact CD2-CD2 4.27Å; L86-Y94 HydrophobicContact CD2-CE2 4.22Å; E90-Y94 WeakPolarHBondContact O-CD2 3.48Å; E90-Y94 PolarHBondContact O-N 3.33Å; K91-Y94 PolarHBondContact O-N 3.38Å; Q92-Y94 VanDerWaalsContact C-N 3.27Å; Q92-Y94 PolarHBondContact O-N 3.38Å; Y94-A98 WeakPolarHBondContact O-CB 3.39Å; Y94-A98 PolarHBondContact O-N 3.19Å
95L89.9Confident89.6Confident73 Ų7381.1 Ų81.138%0.38238%0.376SS..Hα-helixtrans-68.8-43.6174.8-65.9174.1000111.1K91 Q92 E97 A98 E99K91-L95 WeakPolarHBondContact O-CG 3.36Å; K91-L95 PolarHBondContact O-N 2.91Å; K91-L95 VanDerWaalsContact O-N 3.13Å; Q92-L95 CarbonylContact O-C 3.59Å; Q92-L95 WeakPolarHBondContact O-CA 3.34Å; Q92-L95 WeakPolarHBondContact O-CB 3.41Å; Q92-L95 PolarHBondContact O-N 3.21Å; L95-E97 PolarHBondContact O-N 3Å; L95-A98 WeakPolarHBondContact O-CB 3.37Å; L95-A98 PolarHBondContact O-N 3.48Å; L95-A98 VanDerWaalsContact O-N 3.13Å; L95-E99 PolarHBondContact O-N 3.43Å
96D90.8Very high89.1Confident74 Ų7476.6 Ų76.640%0.39636%0.359SS..Hα-helixtrans-64.5-41178.2-64.3-17.4000111.6Q92 A98 E99 R100Q92-D96 PolarHBondContact NE2-OD1 3.28Å; Q92-D96 VanDerWaalsContact O-CG 3.27Å; Q92-D96 PolarHBondContact O-N 2.87Å; D96-A98 VanDerWaalsContact C-N 3.31Å; D96-E99 PolarHBondContact O-N 3.32Å; D96-R100 WeakPolarHBondContact O-CG 3.46Å; D96-R100 PolarHBondContact O-N 2.9Å
97E89.1Confident88.8Confident72 Ų7282.1 Ų82.134%0.33638%0.378SS..Hα-helixtrans-65.8-35.3173.6-169.266.1-120.100111.8R93 L95 R100 D101R93-E97 WeakPolarHBondContact O-CB 3.39Å; R93-E97 PolarHBondContact O-N 3.24Å; R93-E97 VanDerWaalsContact O-N 3.1Å; L95-E97 PolarHBondContact O-N 3Å; E97-R100 IonicContact OE1-CZ 2.66Å; E97-R100 IonicContact OE1-NH1 2.81Å; E97-R100 PolarHBondContact OE1-NH1 3.37Å; E97-R100 IonicContact OE1-NH2 3.59Å; E97-R100 IonicContact OE2-CZ 3Å; E97-R100 IonicContact OE2-NH1 3.38Å; E97-R100 PolarHBondContact OE2-NH1 3.39Å; E97-R100 IonicContact OE2-NH2 2.87Å; E97-R100 PolarHBondContact OE2-NH2 3.03Å; E97-D101 WeakPolarHBondContact O-CB 3.48Å; E97-D101 PolarHBondContact O-N 2.94Å
98A90.3Very high88.4Confident11 Ų1183.3 Ų83.39%0.09138%0.379CS..Hα-helixtrans-68.9-37.1174.900000112.6L49 Y94 L95 D96 D101 K102L49-A98 WeakPolarHBondContact O-CB 3.4Å; Y94-A98 WeakPolarHBondContact O-CB 3.39Å; Y94-A98 PolarHBondContact O-N 3.19Å; L95-A98 WeakPolarHBondContact O-CB 3.37Å; L95-A98 PolarHBondContact O-N 3.48Å; L95-A98 VanDerWaalsContact O-N 3.13Å; D96-A98 VanDerWaalsContact C-N 3.31Å; A98-D101 PolarHBondContact O-N 3.49Å; A98-K102 WeakPolarHBondContact O-CB 3.35Å; A98-K102 PolarHBondContact O-N 3.44Å
99E89.3Confident88Confident85 Ų8580.8 Ų80.840%0.39736%0.36SS..Hα-helixtrans-68.7-43.9175.8-163.761.5-149.500110.9L95 D96 D101 K102 E103L95-E99 PolarHBondContact O-N 3.43Å; D96-E99 PolarHBondContact O-N 3.32Å; E99-D101 VanDerWaalsContact C-N 3.28Å; E99-D101 PolarHBondContact O-N 2.87Å; E99-K102 WeakPolarHBondContact O-CB 2.79Å; E99-K102 PolarHBondContact O-N 2.8Å; E99-K102 VanDerWaalsContact O-N 3.11Å; E99-K102 IonicContact OE1-NZ 3.05Å; E99-K102 PolarHBondContact OE1-NZ 3.18Å; E99-K102 IonicContact OE2-NZ 3.36Å; E99-K102 PolarHBondContact OE2-NZ 3.28Å; E99-E103 WeakPolarHBondContact O-CG 3.21Å; E99-E103 PolarHBondContact O-N 2.93Å
100R89.1Confident87.6Confident130 Ų13079.3 Ų79.349%0.49135%0.353SS..Hα-helixtrans-57.3-40.8172.3-77.8-173-79.6135.3-4.6112.6D96 E97 E103 R104D96-R100 WeakPolarHBondContact O-CG 3.46Å; D96-R100 PolarHBondContact O-N 2.9Å; E97-R100 IonicContact OE1-CZ 2.66Å; E97-R100 IonicContact OE1-NH1 2.81Å; E97-R100 PolarHBondContact OE1-NH1 3.37Å; E97-R100 IonicContact OE1-NH2 3.59Å; E97-R100 IonicContact OE2-CZ 3Å; E97-R100 IonicContact OE2-NH1 3.38Å; E97-R100 PolarHBondContact OE2-NH1 3.39Å; E97-R100 IonicContact OE2-NH2 2.87Å; E97-R100 PolarHBondContact OE2-NH2 3.03Å; R100-E103 PolarHBondContact O-N 2.73Å; R100-R104 PolarHBondContact O-N 2.66Å
101D89Confident87.4Confident12 Ų1282.4 Ų82.46%0.06437%0.365CS..Hα-helixtrans-67.1-40.9176-165.6-63.7000112.4P48 R54 E97 A98 E99 E103 R104 Y105P48-D101 WeakPolarHBondContact CA-OD1 3.33Å; P48-D101 HydrophobicContact CB-CB 4.44Å; P48-D101 WeakPolarHBondContact CB-OD1 3.48Å; R54-D101 IonicContact CZ-OD2 3.06Å; R54-D101 IonicContact NH1-OD2 3.68Å; R54-D101 IonicContact NH2-OD1 3.72Å; R54-D101 IonicContact NH2-OD2 2.91Å; R54-D101 PolarHBondContact NH2-OD2 2.98Å; E97-D101 WeakPolarHBondContact O-CB 3.48Å; E97-D101 PolarHBondContact O-N 2.94Å; A98-D101 PolarHBondContact O-N 3.49Å; E99-D101 VanDerWaalsContact C-N 3.28Å; E99-D101 PolarHBondContact O-N 2.87Å; D101-E103 VanDerWaalsContact C-N 3.34Å; D101-E103 PolarHBondContact O-N 3.15Å; D101-R104 WeakPolarHBondContact O-CB 3.46Å; D101-R104 PolarHBondContact O-N 3.18Å; D101-R104 IonicContact OD1-CZ 2.86Å; D101-R104 IonicContact OD1-NH1 3.28Å; D101-R104 IonicContact OD1-NH2 3.76Å; D101-R104 PolarHBondContact OD1-NH2 3.37Å; D101-R104 IonicContact OD2-CZ 3.26Å; D101-R104 IonicContact OD2-NH1 2.99Å; D101-R104 PolarHBondContact OD2-NH1 2.84Å; D101-R104 IonicContact OD2-NH2 3.81Å; D101-R104 PolarHBondContact OD2-NH2 3.45Å; D101-Y105 WeakPolarHBondContact O-CB 3.37Å; D101-Y105 PolarHBondContact O-N 2.84Å
102K87Confident86.8Confident86 Ų8679.8 Ų79.837%0.37435%0.353SS..Hα-helixtrans-59.9-44174.4175.9-178.1158.6-143.10111.2P48 A98 E99 Y105 M106P48-K102 HydrophobicContact CB-CB 4.29Å; P48-K102 HydrophobicContact CG-CB 4.28Å; A98-K102 WeakPolarHBondContact O-CB 3.35Å; A98-K102 PolarHBondContact O-N 3.44Å; E99-K102 WeakPolarHBondContact O-CB 2.79Å; E99-K102 PolarHBondContact O-N 2.8Å; E99-K102 VanDerWaalsContact O-N 3.11Å; E99-K102 IonicContact OE1-NZ 3.05Å; E99-K102 PolarHBondContact OE1-NZ 3.18Å; E99-K102 IonicContact OE2-NZ 3.36Å; E99-K102 PolarHBondContact OE2-NZ 3.28Å; K102-Y105 PolarHBondContact O-N 3.04Å; K102-M106 HydrophobicContact CG-CE 4.39Å; K102-M106 WeakPolarHBondContact O-CG 3.38Å; K102-M106 PolarHBondContact O-N 3.4Å
103E86.8Confident86.3Confident94 Ų9479.4 Ų79.444%0.43935%0.351SS..Hα-helixtrans-60.6-45.7173.8-71.2177.5-174.700112.4E99 R100 D101 Y105 M106 R107E99-E103 WeakPolarHBondContact O-CG 3.21Å; E99-E103 PolarHBondContact O-N 2.93Å; R100-E103 PolarHBondContact O-N 2.73Å; D101-E103 VanDerWaalsContact C-N 3.34Å; D101-E103 PolarHBondContact O-N 3.15Å; E103-Y105 VanDerWaalsContact C-N 3.34Å; E103-Y105 PolarHBondContact O-N 2.99Å; E103-M106 HydrophobicContact CG-CE 4.25Å; E103-M106 PolarHBondContact O-N 2.86Å; E103-R107 PolarHBondContact O-N 2.76Å
104R90.2Very high85.6Confident95 Ų9580.9 Ų80.936%0.35836%0.362SS..Hα-helixtrans-57.9-48.1174.6-173.6-166.569.7-115.3-5.6110.9R100 D101 M106 R107 E108R100-R104 PolarHBondContact O-N 2.66Å; D101-R104 WeakPolarHBondContact O-CB 3.46Å; D101-R104 PolarHBondContact O-N 3.18Å; D101-R104 IonicContact OD1-CZ 2.86Å; D101-R104 IonicContact OD1-NH1 3.28Å; D101-R104 IonicContact OD1-NH2 3.76Å; D101-R104 PolarHBondContact OD1-NH2 3.37Å; D101-R104 IonicContact OD2-CZ 3.26Å; D101-R104 IonicContact OD2-NH1 2.99Å; D101-R104 PolarHBondContact OD2-NH1 2.84Å; D101-R104 IonicContact OD2-NH2 3.81Å; D101-R104 PolarHBondContact OD2-NH2 3.45Å; R104-M106 PolarHBondContact O-N 3.44Å; R104-R107 PolarHBondContact O-N 3.19Å; R104-E108 HydrophobicContact CG-CG 4.5Å; R104-E108 WeakPolarHBondContact CG-OE1 3.38Å; R104-E108 IonicContact NE-OE1 3.62Å; R104-E108 WeakPolarHBondContact O-CG 3.28Å; R104-E108 PolarHBondContact O-N 2.81Å
105Y85.5Confident85Confident54 Ų5482.6 Ų82.621%0.21238%0.375CS..Hα-helixtrans-60.9-43.4178.5172.5-100.4000112.2P45 K46 P48 D101 K102 E103 R107 E108 L109P45-Y105 HydrophobicContact CB-CD2 3.77Å; P45-Y105 HydrophobicContact CB-CE2 3.81Å; P45-Y105 WeakPolarHBondContact O-CE2 3.44Å; K46-Y105 WeakPolarHBondContact O-CD2 3.1Å; P48-Y105 HydrophobicContact CG-CD1 4.06Å; P48-Y105 HydrophobicContact CG-CG 4.13Å; D101-Y105 WeakPolarHBondContact O-CB 3.37Å; D101-Y105 PolarHBondContact O-N 2.84Å; K102-Y105 PolarHBondContact O-N 3.04Å; E103-Y105 VanDerWaalsContact C-N 3.34Å; E103-Y105 PolarHBondContact O-N 2.99Å; Y105-R107 VanDerWaalsContact C-N 3.34Å; Y105-R107 PolarHBondContact O-N 3.03Å; Y105-E108 PolarHBondContact O-N 3Å; Y105-L109 HydrophobicContact CE1-CB 4.48Å; Y105-L109 HydrophobicContact CE1-CD2 3.88Å; Y105-L109 WeakPolarHBondContact O-CB 3.41Å; Y105-L109 PolarHBondContact O-N 3.28Å
106M80.1Confident84.2Confident86 Ų8684.8 Ų84.842%0.42438%0.383SS..Hα-helixtrans-59.4-46.8176.8-72.6-172.8-58.500110.8K102 E103 R104 E108 L109 E110K102-M106 HydrophobicContact CG-CE 4.39Å; K102-M106 WeakPolarHBondContact O-CG 3.38Å; K102-M106 PolarHBondContact O-N 3.4Å; E103-M106 HydrophobicContact CG-CE 4.25Å; E103-M106 PolarHBondContact O-N 2.86Å; R104-M106 PolarHBondContact O-N 3.44Å; M106-E108 PolarHBondContact O-N 3.26Å; M106-L109 PolarHBondContact O-N 2.97Å; M106-E110 WeakPolarHBondContact O-CG 3.42Å; M106-E110 PolarHBondContact O-N 3.45Å
107R84Confident83.4Confident139 Ų13982.9 Ų82.953%0.52538%0.378SS..Hα-helixtrans-62.6-43177.6-168.3-175.3-61.8124.82.4112.6E103 R104 Y105 K111E103-R107 PolarHBondContact O-N 2.76Å; R104-R107 PolarHBondContact O-N 3.19Å; Y105-R107 VanDerWaalsContact C-N 3.34Å; Y105-R107 PolarHBondContact O-N 3.03Å; R107-K111 WeakPolarHBondContact O-CG 3.47Å; R107-K111 PolarHBondContact O-N 2.9Å
108E84.8Confident82.6Confident81 Ų8183.2 Ų83.238%0.37938%0.376SS..Hα-helixtrans-66.6-38.4176.1-74176.3-172.700111.7P45 R104 Y105 M106 K111 Y112P45-E108 HydrophobicContact CB-CB 3.95Å; P45-E108 HydrophobicContact CG-CB 3.75Å; R104-E108 HydrophobicContact CG-CG 4.5Å; R104-E108 WeakPolarHBondContact CG-OE1 3.38Å; R104-E108 IonicContact NE-OE1 3.62Å; R104-E108 WeakPolarHBondContact O-CG 3.28Å; R104-E108 PolarHBondContact O-N 2.81Å; Y105-E108 PolarHBondContact O-N 3Å; M106-E108 PolarHBondContact O-N 3.26Å; E108-K111 PolarHBondContact O-N 3.24Å; E108-Y112 VanDerWaalsContact O-CB 3.28Å; E108-Y112 WeakPolarHBondContact O-CB 3.46Å; E108-Y112 PolarHBondContact O-N 3.09Å
109L81.3Confident81.9Confident47 Ų4787.5 Ų87.525%0.24639%0.393CS..Hα-helixtrans-67.5-41.3178.9-174.768.2000111.4Y105 M106 K111 Y112 Q113Y105-L109 HydrophobicContact CE1-CB 4.48Å; Y105-L109 HydrophobicContact CE1-CD2 3.88Å; Y105-L109 WeakPolarHBondContact O-CB 3.41Å; Y105-L109 PolarHBondContact O-N 3.28Å; M106-L109 PolarHBondContact O-N 2.97Å; L109-K111 VanDerWaalsContact C-N 3.35Å; L109-Y112 WeakPolarHBondContact O-CB 3.32Å; L109-Y112 PolarHBondContact O-N 3.12Å; L109-Q113 WeakPolarHBondContact O-CB 3.36Å; L109-Q113 VanDerWaalsContact O-CG 3.27Å; L109-Q113 WeakPolarHBondContact O-CG 3.37Å; L109-Q113 PolarHBondContact O-N 2.86Å
110E80.6Confident81.1Confident115 Ų11589 Ų8954%0.53740%0.4SS..Hα-helixtrans-60.7-43.3173.8-76.1175.6-174.500112M106 K114M106-E110 WeakPolarHBondContact O-CG 3.42Å; M106-E110 PolarHBondContact O-N 3.45Å; E110-K114 WeakPolarHBondContact O-CG 3.47Å; E110-K114 PolarHBondContact O-N 3.38Å
111K82.6Confident80.4Confident142 Ų14285.1 Ų85.162%0.61739%0.387SS*.Hα-helixtrans-63.8-43.8174-71177.8-179.4-175.30111R107 E108 L109 Q113 K114 T115R107-K111 WeakPolarHBondContact O-CG 3.47Å; R107-K111 PolarHBondContact O-N 2.9Å; E108-K111 PolarHBondContact O-N 3.24Å; L109-K111 VanDerWaalsContact C-N 3.35Å; K111-Q113 PolarHBondContact O-N 3.42Å; K111-K114 PolarHBondContact O-N 2.9Å; K111-T115 PolarHBondContact O-OG1 3.46Å
112Y78.6Confident79.6Confident21 Ų2186.5 Ų86.58%0.08240%0.396CS..Hα-helixtrans-60.4-44.6179.3-175.4-116.9000112D41 N43 A44 P45 E108 L109 K114 T115 A117 Y118D41-Y112 PolarHBondContact OD1-OH 3.45Å; D41-Y112 PolarHBondContact OD2-OH 2.88Å; N43-Y112 HydrophobicContact CB-CE2 3.78Å; N43-Y112 WeakPolarHBondContact O-CD2 3.4Å; N43-Y112 WeakPolarHBondContact O-CE2 3.39Å; A44-Y112 HydrophobicContact CB-CD1 4.3Å; A44-Y112 HydrophobicContact CB-CE1 3.85Å; P45-Y112 HydrophobicContact CG-CG 4.41Å; E108-Y112 VanDerWaalsContact O-CB 3.28Å; E108-Y112 WeakPolarHBondContact O-CB 3.46Å; E108-Y112 PolarHBondContact O-N 3.09Å; L109-Y112 WeakPolarHBondContact O-CB 3.32Å; L109-Y112 PolarHBondContact O-N 3.12Å; Y112-K114 PolarHBondContact O-N 3.44Å; Y112-T115 VanDerWaalsContact O-CB 3.28Å; Y112-T115 WeakPolarHBondContact O-CB 3.47Å; Y112-T115 PolarHBondContact O-N 2.95Å; Y112-T115 PolarHBondContact O-OG1 2.94Å; Y112-A117 HydrophobicContact CE2-CB 4.19Å; Y112-Y118 AromaticContact CD1-CD2 3.85Å; Y112-Y118 HydrophobicContact CD1-CD2 3.85Å; Y112-Y118 HydrophobicContact CD1-CG 4.44Å; Y112-Y118 AromaticContact CE1-CD2 3.58Å; Y112-Y118 HydrophobicContact CE1-CD2 3.58Å; Y112-Y118 HydrophobicContact CE1-CG 4.26Å; Y112-Y118 WeakPolarHBondContact O-CB 3.44Å
113Q78.6Confident79.1Confident87 Ų8790.2 Ų90.241%0.40741%0.407SS..Hα-helixtrans-58.7-30.2178.4-76.2178.760.900113.4L109 K111 T115 Y118L109-Q113 WeakPolarHBondContact O-CB 3.36Å; L109-Q113 VanDerWaalsContact O-CG 3.27Å; L109-Q113 WeakPolarHBondContact O-CG 3.37Å; L109-Q113 PolarHBondContact O-N 2.86Å; K111-Q113 PolarHBondContact O-N 3.42Å; Q113-T115 VanDerWaalsContact C-N 3.29Å; Q113-T115 PolarHBondContact O-N 3.22Å; Q113-Y118 HydrophobicContact CB-CD1 4.17Å; Q113-Y118 HydrophobicContact CB-CE1 4.15Å; Q113-Y118 HydrophobicContact CG-CD1 4.3Å; Q113-Y118 HydrophobicContact CG-CD2 4.47Å; Q113-Y118 HydrophobicContact CG-CE1 3.94Å; Q113-Y118 HydrophobicContact CG-CE2 4.13Å; Q113-Y118 VanDerWaalsContact O-CD1 3.23Å; Q113-Y118 WeakPolarHBondContact O-CD1 3.27Å
114K78.2Confident78.6Confident166 Ų16690.6 Ų90.672%0.72241%0.407SS*.THydrogen-bonded Turntrans-79.4-10177.4-66.1174.7-177.3178.20113.5E110 K111 Y112E110-K114 WeakPolarHBondContact O-CG 3.47Å; E110-K114 PolarHBondContact O-N 3.38Å; K111-K114 PolarHBondContact O-N 2.9Å; Y112-K114 PolarHBondContact O-N 3.44Å
115T79.1Confident77.8Confident65 Ų6589.1 Ų89.140%0.39941%0.409SS..SBendtrans-85147.6-173.9-420000111.4K111 Y112 Q113 A117 Y118 K119K111-T115 PolarHBondContact O-OG1 3.46Å; Y112-T115 VanDerWaalsContact O-CB 3.28Å; Y112-T115 WeakPolarHBondContact O-CB 3.47Å; Y112-T115 PolarHBondContact O-N 2.95Å; Y112-T115 PolarHBondContact O-OG1 2.94Å; Q113-T115 VanDerWaalsContact C-N 3.29Å; Q113-T115 PolarHBondContact O-N 3.22Å; T115-A117 HydrophobicContact CG2-CB 4.21Å; T115-A117 PolarHBondContact O-N 3.5Å; T115-Y118 PolarHBondContact O-N 3.38Å; T115-K119 PolarHBondContact O-N 2.92Å
116E72.4Confident77.1Confident119 Ų11992 Ų9256%0.55642%0.424SS*.Hα-helixtrans-58.9-29.1175-68.2-54.8121.400113Y118 K119 H120E116-Y118 VanDerWaalsContact C-N 3.33Å; E116-Y118 PolarHBondContact O-N 2.98Å; E116-K119 PolarHBondContact O-N 3.42Å; E116-K119 WeakPolarHBondContact OE1-CD 3.46Å; E116-K119 WeakPolarHBondContact OE1-CE 3.49Å; E116-K119 IonicContact OE1-NZ 2.62Å; E116-K119 PolarHBondContact OE1-NZ 3.34Å; E116-H120 WeakPolarHBondContact O-CB 3.49Å; E116-H120 PolarHBondContact O-N 3.26Å
117A73.8Confident76.6Confident33 Ų3394.5 Ų94.527%0.27344%0.435SS..Hα-helixtrans-57-43.817300000112.5Y112 T115 H120 F121Y112-A117 HydrophobicContact CE2-CB 4.19Å; T115-A117 HydrophobicContact CG2-CB 4.21Å; T115-A117 PolarHBondContact O-N 3.5Å; A117-H120 PolarHBondContact O-N 3.09Å; A117-F121 WeakPolarHBondContact O-CB 3.43Å; A117-F121 PolarHBondContact O-N 3.07Å
118Y73.5Confident75.8Confident80 Ų8095.4 Ų95.431%0.31444%0.442SS..Hα-helixtrans-69.5-40.8178.2178.6-103000112.1Y112 Q113 T115 E116 H120 F121 T122Y112-Y118 AromaticContact CD1-CD2 3.85Å; Y112-Y118 HydrophobicContact CD1-CD2 3.85Å; Y112-Y118 HydrophobicContact CD1-CG 4.44Å; Y112-Y118 AromaticContact CE1-CD2 3.58Å; Y112-Y118 HydrophobicContact CE1-CD2 3.58Å; Y112-Y118 HydrophobicContact CE1-CG 4.26Å; Y112-Y118 WeakPolarHBondContact O-CB 3.44Å; Q113-Y118 HydrophobicContact CB-CD1 4.17Å; Q113-Y118 HydrophobicContact CB-CE1 4.15Å; Q113-Y118 HydrophobicContact CG-CD1 4.3Å; Q113-Y118 HydrophobicContact CG-CD2 4.47Å; Q113-Y118 HydrophobicContact CG-CE1 3.94Å; Q113-Y118 HydrophobicContact CG-CE2 4.13Å; Q113-Y118 VanDerWaalsContact O-CD1 3.23Å; Q113-Y118 WeakPolarHBondContact O-CD1 3.27Å; T115-Y118 PolarHBondContact O-N 3.38Å; E116-Y118 VanDerWaalsContact C-N 3.33Å; E116-Y118 PolarHBondContact O-N 2.98Å; Y118-H120 PolarHBondContact O-N 2.82Å; Y118-F121 PolarHBondContact O-N 3.12Å; Y118-T122 VanDerWaalsContact O-CB 3.29Å; Y118-T122 WeakPolarHBondContact O-CB 3.46Å; Y118-T122 PolarHBondContact O-N 2.87Å; Y118-T122 PolarHBondContact O-OG1 3.15Å
119K75.1Confident74.7Confident100 Ų10097.7 Ų97.744%0.43545%0.453SS..Hα-helixtrans-62-43.7175.4-63.9-179.5-170.8165.50111.4T115 E116 T122 R123T115-K119 PolarHBondContact O-N 2.92Å; E116-K119 PolarHBondContact O-N 3.42Å; E116-K119 WeakPolarHBondContact OE1-CD 3.46Å; E116-K119 WeakPolarHBondContact OE1-CE 3.49Å; E116-K119 IonicContact OE1-NZ 2.62Å; E116-K119 PolarHBondContact OE1-NZ 3.34Å; K119-T122 PolarHBondContact O-N 2.95Å; K119-R123 WeakPolarHBondContact O-CB 3.47Å; K119-R123 PolarHBondContact O-N 2.99Å
120H72Confident73.7Confident118 Ų118102.8 Ų102.855%0.54647%0.473SS..Hα-helixtrans-66.1-44.1177.1179.2-97.3000112.2E116 A117 Y118 R123 K124E116-H120 WeakPolarHBondContact O-CB 3.49Å; E116-H120 PolarHBondContact O-N 3.26Å; A117-H120 PolarHBondContact O-N 3.09Å; Y118-H120 PolarHBondContact O-N 2.82Å; H120-R123 PolarHBondContact O-N 3.09Å; H120-K124 WeakPolarHBondContact O-CB 3.5Å; H120-K124 PolarHBondContact O-N 2.92Å
121F75.4Confident72.4Confident48 Ų4899.8 Ų99.821%0.21147%0.474CS..Hα-helixtrans-59.9-47.4174.5179.1-99.9000111.6D41 A117 Y118 R123 K124 V125D41-F121 HydrophobicContact CB-CD1 4.39Å; D41-F121 HydrophobicContact CB-CD2 3.8Å; D41-F121 HydrophobicContact CB-CE1 4.28Å; D41-F121 HydrophobicContact CB-CE2 3.67Å; D41-F121 HydrophobicContact CB-CG 4.17Å; D41-F121 HydrophobicContact CB-CZ 3.92Å; D41-F121 VanDerWaalsContact OD2-CB 3.25Å; D41-F121 WeakPolarHBondContact OD2-CB 3.33Å; D41-F121 WeakPolarHBondContact OD2-CD2 3.43Å; D41-F121 WeakPolarHBondContact OD2-CG 3.26Å; A117-F121 WeakPolarHBondContact O-CB 3.43Å; A117-F121 PolarHBondContact O-N 3.07Å; Y118-F121 PolarHBondContact O-N 3.12Å; F121-R123 PolarHBondContact O-N 3.03Å; F121-K124 PolarHBondContact O-N 3.29Å; F121-V125 HydrophobicContact CD1-CG2 4.24Å; F121-V125 HydrophobicContact CE1-CG2 3.86Å; F121-V125 HydrophobicContact CE2-CG2 4.26Å; F121-V125 HydrophobicContact CZ-CG2 3.87Å; F121-V125 WeakPolarHBondContact O-CG2 3.35Å; F121-V125 PolarHBondContact O-N 3.3Å
122T73Confident71.1Confident41 Ų41101.4 Ų101.425%0.25248%0.48SS..Hα-helixtrans-61.9-43.2179.2-57.40000111.6Y118 K119 V125 Q126Y118-T122 VanDerWaalsContact O-CB 3.29Å; Y118-T122 WeakPolarHBondContact O-CB 3.46Å; Y118-T122 PolarHBondContact O-N 2.87Å; Y118-T122 PolarHBondContact O-OG1 3.15Å; K119-T122 PolarHBondContact O-N 2.95Å; T122-V125 PolarHBondContact O-N 2.98Å; T122-Q126 WeakPolarHBondContact O-CG 3.42Å; T122-Q126 PolarHBondContact O-N 3.04Å
123R76.5Confident69.7Low163 Ų163110.3 Ų110.362%0.61551%0.514SS*.Hα-helixtrans-59.6-47174.5-170.8-176.1-60.3170.82.1111.8K119 H120 F121 V125 Q126 E127K119-R123 WeakPolarHBondContact O-CB 3.47Å; K119-R123 PolarHBondContact O-N 2.99Å; H120-R123 PolarHBondContact O-N 3.09Å; F121-R123 PolarHBondContact O-N 3.03Å; R123-V125 VanDerWaalsContact C-N 3.33Å; R123-V125 PolarHBondContact O-N 2.94Å; R123-Q126 PolarHBondContact O-N 3.41Å; R123-E127 WeakPolarHBondContact O-CB 3.44Å; R123-E127 PolarHBondContact O-N 3.4Å
124K74.4Confident68.1Low103 Ų103114.9 Ų114.945%0.44854%0.535SS..Hα-helixtrans-64.6-34.7179.3-170.6173-177.7169.90112.7M39 H120 F121 K128M39-K124 HydrophobicContact CE-CD 4.19Å; H120-K124 WeakPolarHBondContact O-CB 3.5Å; H120-K124 PolarHBondContact O-N 2.92Å; F121-K124 PolarHBondContact O-N 3.29Å; K124-K128 WeakPolarHBondContact O-CB 3.4Å; K124-K128 PolarHBondContact O-N 3.24Å
125V75.1Confident66.4Low64 Ų64118.5 Ų118.539%0.38854%0.544SS..Hα-helixtrans-67.8-45.6173.2171.80000110.8F121 T122 R123 K128 Q129F121-V125 HydrophobicContact CD1-CG2 4.24Å; F121-V125 HydrophobicContact CE1-CG2 3.86Å; F121-V125 HydrophobicContact CE2-CG2 4.26Å; F121-V125 HydrophobicContact CZ-CG2 3.87Å; F121-V125 WeakPolarHBondContact O-CG2 3.35Å; F121-V125 PolarHBondContact O-N 3.3Å; T122-V125 PolarHBondContact O-N 2.98Å; R123-V125 VanDerWaalsContact C-N 3.33Å; R123-V125 PolarHBondContact O-N 2.94Å; V125-K128 PolarHBondContact O-N 2.99Å; V125-Q129 WeakPolarHBondContact O-CB 3.24Å; V125-Q129 PolarHBondContact O-N 2.88Å; V125-Q129 VanDerWaalsContact O-N 3.1Å
126Q69.2Low64.6Low113 Ų113118.5 Ų118.553%0.52856%0.557SS.*Hα-helixtrans-63.6-42.4178.6-73.6-179.220.200112.9T122 R123 K128 Q129 K130T122-Q126 WeakPolarHBondContact O-CG 3.42Å; T122-Q126 PolarHBondContact O-N 3.04Å; R123-Q126 PolarHBondContact O-N 3.41Å; Q126-K128 PolarHBondContact O-N 3.47Å; Q126-Q129 PolarHBondContact O-N 3.27Å; Q126-Q129 VanDerWaalsContact O-N 3.16Å; Q126-K130 PolarHBondContact O-N 3.5Å
127E69.6Low63Low139 Ų139120.1 Ų120.165%0.6557%0.57SS**Hα-helixtrans-62.2-43.7178.6-171.4177.9-167.700111.7R123 Q129 K130 G131R123-E127 WeakPolarHBondContact O-CB 3.44Å; R123-E127 PolarHBondContact O-N 3.4Å; E127-Q129 VanDerWaalsContact C-N 3.26Å; E127-Q129 PolarHBondContact O-N 3.15Å; E127-K130 PolarHBondContact O-N 2.92Å; E127-G131 PolarHBondContact O-N 3.43Å
128K67.2Low61.3Low158 Ų158125.6 Ų125.669%0.68760%0.599SS**Hα-helixtrans-65.7-29.2175.4-168.6172.8-176.6173.50112.9K124 V125 Q126 K132K124-K128 WeakPolarHBondContact O-CB 3.4Å; K124-K128 PolarHBondContact O-N 3.24Å; V125-K128 PolarHBondContact O-N 2.99Å; Q126-K128 PolarHBondContact O-N 3.47Å; K128-K132 PolarHBondContact O-N 3.48Å
129Q62Low59.6Low129 Ų129125 Ų12560%0.60362%0.618SS**Hα-helixtrans-80.2-35.7178.1-157.7148.919.200111.8V125 Q126 E127 K132 R133V125-Q129 WeakPolarHBondContact O-CB 3.24Å; V125-Q129 PolarHBondContact O-N 2.88Å; V125-Q129 VanDerWaalsContact O-N 3.1Å; Q126-Q129 PolarHBondContact O-N 3.27Å; Q126-Q129 VanDerWaalsContact O-N 3.16Å; E127-Q129 VanDerWaalsContact C-N 3.26Å; E127-Q129 PolarHBondContact O-N 3.15Å; Q129-K132 PolarHBondContact O-N 3.25Å; Q129-R133 PolarHBondContact O-N 2.85Å
130K60.3Low57.7Low154 Ų154129 Ų12967%0.6764%0.638SS**Hα-helixtrans-63.7-43.4169.6-77.7-175.2176-177.70112.1Q126 E127 K132 R133Q126-K130 PolarHBondContact O-N 3.5Å; E127-K130 PolarHBondContact O-N 2.92Å; K130-K132 PolarHBondContact O-N 2.95Å; K130-R133 PolarHBondContact O-N 3.01Å; K130-R133 VanDerWaalsContact O-N 3.1Å
131G54.3Low56Low53 Ų53131.9 Ų131.955%0.54665%0.652SS.*Hα-helixtrans-62.8-21.6176.100000114.6E127E127-G131 PolarHBondContact O-N 3.43Å
132K55Low54.3Low175 Ų175136.1 Ų136.176%0.76168%0.681SS**Hα-helixtrans-83-24.7175.7-122.8177.9178.3-170.90113.6K128 Q129 K130K128-K132 PolarHBondContact O-N 3.48Å; Q129-K132 PolarHBondContact O-N 3.25Å; K130-K132 PolarHBondContact O-N 2.95Å
133R49.1Very low52.7Low208 Ų208138.9 Ų138.979%0.78571%0.708SS**Hα-helixtrans-78.4-24.8179-67.1-177.774.7-178.82.2112.7Q129 K130 R135Q129-R133 PolarHBondContact O-N 2.85Å; K130-R133 PolarHBondContact O-N 3.01Å; K130-R133 VanDerWaalsContact O-N 3.1Å; R133-R135 VanDerWaalsContact C-N 3.26Å; R133-R135 PolarHBondContact O-N 3.2Å
134H44.5Very low50.9Low184 Ų184136.3 Ų136.385%0.85272%0.715SS**THydrogen-bonded Turntrans-81.52.9-178.9-136.751.8000114.6
135R42.8Very low49.2Very low241 Ų241140.4 Ų140.491%0.90974%0.736SS**THydrogen-bonded Turntrans-118.67.3-178.6-112.9-171.7-166.4-167.44.4114.6R133R133-R135 VanDerWaalsContact C-N 3.26Å; R133-R135 PolarHBondContact O-N 3.2Å
136G41.8Very low47.4Very low66 Ų66141.7 Ų141.768%0.6875%0.754SS**  trans-135.728.2-171.200000114.3
137D39.3Very low45.8Very low152 Ų152144.9 Ų144.981%0.81377%0.773SS**  trans-10569.8174.4-167.346.4000110.3
138V37.8Very low44.4Very low148 Ų148147.3 Ų147.390%0.89778%0.784SS**SBendtrans-153110148.5-175.80000107.1
139G36.7Very low42.9Very low69 Ų69146.5 Ų146.571%0.71178%0.783SS**  trans119.9129.5152.900000117.4
140H35.5Very low41.8Very low182 Ų182148 Ų14884%0.84379%0.787SS**  trans89.180.5163.1-86.454.2000118.8
141Q37.3Very low40.5Very low180 Ų180148.6 Ų148.684%0.84180%0.798SS**  -62.6163.1127.8-72.8170.8-1.300109.8
142V38.8Very low40.2Very low137 Ų137150.2 Ų150.283%0.8381%0.806SS**  trans84.395.8178-1440000116.1
143A39.1Very low39.6Very low98 Ų98151.2 Ų151.281%0.8181%0.813SS**  trans174.365.5141.100000109.5
144S39.9Very low39.1Very low110 Ų110145 Ų14577%0.76981%0.814SS**  trans-80.5142.1146.7173.90000105.7
145E38Very low39Very low188 Ų188145.2 Ų145.288%0.87981%0.812SS**  trans76.686.4-177.7-59.8176.6143.200116
146A37.9Very low39Very low92 Ų92140.7 Ų140.776%0.7681%0.806SS**  trans-172120.9132.300000107.5
147L34.9Very low39.4Very low179 Ų179145.6 Ų145.694%0.93780%0.804SS**  trans168.258.3136.3-82.8176.9000107.8
148H40.3Very low40.3Very low191 Ų191141.4 Ų141.488%0.88478%0.784SS**  trans-106110.9141.3-147.978.9000103.6
149E36Very low41.2Very low140 Ų140137.6 Ų137.665%0.65476%0.761SS**  176.6122.3123.6-162.1160.1-166.700111.8
150K39.2Very low42Very low160 Ų160143.1 Ų143.170%0.69677%0.766SS**  trans56.4106.3150.4-70.1169.9-174.7157.50119.6
151D33Very low43.2Very low167 Ų167138.5 Ų138.589%0.89375%0.747SS**  -114.8123.7113.1-78.6-46.5000108.9
152A46.4Very low44.6Very low87 Ų87131.1 Ų131.172%0.71971%0.713SS**  trans-66.4154.1169.300000109.6
153E44Very low46.1Very low196 Ų196128.2 Ų128.292%0.91670%0.697SS**  trans84.943.8-179.2-54.3179.7152.300116.1K155E153-K155 VanDerWaalsContact C-N 3.35Å; E153-K155 PolarHBondContact O-N 3.45Å
154G37.6Very low47Very low77 Ų77128.4 Ų128.479%0.79468%0.684SS**  trans-74.281.2167.900000112.4D156G154-D156 PolarHBondContact O-N 3.22Å
155K42.3Very low48.2Very low189 Ų189129.3 Ų129.382%0.82267%0.674SS**  trans-57122.1153.7-155.3168.8-169.1171.80105.8E153 R157E153-K155 VanDerWaalsContact C-N 3.35Å; E153-K155 PolarHBondContact O-N 3.45Å; K155-R157 PolarHBondContact O-N 3.38Å
156D44.3Very low50Low147 Ų147122.5 Ų122.579%0.78665%0.646SS**  trans-57.180.9177.8-166.816.6000109.5G154 T158G154-D156 PolarHBondContact O-N 3.22Å; D156-T158 VanDerWaalsContact C-N 3.35Å; D156-T158 PolarHBondContact O-N 3.46Å
157R49.8Very low51.7Low169 Ų169125 Ų12564%0.63864%0.641SS**  trans-77.495178.9-93.2-176.9162.1163.4-1.6105.7K155 D161K155-R157 PolarHBondContact O-N 3.38Å; R157-D161 HydrophobicContact CB-CB 4.15Å; R157-D161 HydrophobicContact CG-CB 3.92Å
158T57.5Low53.7Low63 Ų63121.8 Ų121.839%0.38762%0.621SS.*  trans-55.4157.1172.968.60000109.3D156 F160 D161D156-T158 VanDerWaalsContact C-N 3.35Å; D156-T158 PolarHBondContact O-N 3.46Å; T158-F160 PolarHBondContact O-N 3.05Å; T158-D161 PolarHBondContact N-OD2 3.41Å; T158-D161 PolarHBondContact O-N 3.33Å; T158-D161 PolarHBondContact OG1-OD2 3.09Å
159V56Low55.6Low69 Ų69115.7 Ų115.742%0.41859%0.593SS.*THydrogen-bonded Turntrans-46.7-21.3175165.20000113.5
160F54.8Low57.6Low184 Ų184114 Ų11481%0.80759%0.587SS**THydrogen-bonded Turntrans-83-12.8-179.4-60.8-81.5000114.6T158T158-F160 PolarHBondContact O-N 3.05Å
161D61Low59.5Low85 Ų85110.6 Ų110.646%0.45558%0.577SS.*SBendtrans-95.2-3.5-175.7-71.4-46.9000114.6R157 T158 P163R157-D161 HydrophobicContact CB-CB 4.15Å; R157-D161 HydrophobicContact CG-CB 3.92Å; T158-D161 PolarHBondContact N-OD2 3.41Å; T158-D161 PolarHBondContact O-N 3.33Å; T158-D161 PolarHBondContact OG1-OD2 3.09Å; D161-P163 VanDerWaalsContact O-CD 3.31Å; D161-P163 WeakPolarHBondContact O-CD 3.36Å
162I64.9Low61.8Low25 Ų25105.6 Ų105.613%0.12855%0.548CS..SBendtrans-83.6114.7177.2-48.9177.2000108.6I164 E168 F169 H172I162-I164 PolarHBondContact O-N 3.45Å; I162-E168 HydrophobicContact CG2-CB 4.09Å; I162-E168 HydrophobicContact CG2-CG 4.1Å; I162-F169 HydrophobicContact CG2-CB 3.72Å; I162-H172 HydrophobicContact CD1-CB 4.15Å
163P70.8Confident63.4Low76 Ų76104 Ų10449%0.49453%0.532SS..  trans-61.7131.1-176.3-18.830.6000111.1D161 F165 T166 F169D161-P163 VanDerWaalsContact O-CD 3.31Å; D161-P163 WeakPolarHBondContact O-CD 3.36Å; P163-F165 PolarHBondContact O-N 3.06Å; P163-T166 HydrophobicContact CB-CG2 3.78Å; P163-T166 HydrophobicContact CG-CG2 4.2Å; P163-T166 WeakPolarHBondContact O-CB 3.48Å; P163-T166 WeakPolarHBondContact O-CG2 3.43Å; P163-T166 PolarHBondContact O-N 3.39Å; P163-T166 PolarHBondContact O-OG1 3.08Å; P163-F169 WeakPolarHBondContact O-CB 3.37Å
164I59Low65.4Low102 Ų102100.3 Ų100.352%0.52351%0.512SS..THydrogen-bonded Turntrans-57.3135.4-178.2-30.9176.1000109I162 F169I162-I164 PolarHBondContact O-N 3.45Å; I164-F169 HydrophobicContact CG2-CD1 4.48Å; I164-F169 HydrophobicContact CG2-CE1 4.08Å; I164-F169 HydrophobicContact CG2-CZ 4.11Å
165F64.1Low67.6Low130 Ų13099.4 Ų99.457%0.5750%0.498SS*.THydrogen-bonded Turntrans72.913.5-177.9-45.4-75.5000117T76 P163T76-F165 HydrophobicContact CG2-CE2 3.6Å; T76-F165 HydrophobicContact CG2-CZ 3.79Å; P163-F165 PolarHBondContact O-N 3.06Å
166T75.3Confident69.8Low45 Ų4595.6 Ų95.628%0.27648%0.478SS..SBendtrans-77.1156.7164.556.50000111.5P163 E168 F169 L170P163-T166 HydrophobicContact CB-CG2 3.78Å; P163-T166 HydrophobicContact CG-CG2 4.2Å; P163-T166 WeakPolarHBondContact O-CB 3.48Å; P163-T166 WeakPolarHBondContact O-CG2 3.43Å; P163-T166 PolarHBondContact O-N 3.39Å; P163-T166 PolarHBondContact O-OG1 3.08Å; T166-E168 PolarHBondContact O-N 3.37Å; T166-F169 PolarHBondContact O-N 3.42Å; T166-F169 WeakPolarHBondContact OG1-CB 3.48Å; T166-F169 PolarHBondContact OG1-N 3.28Å; T166-F169 VanDerWaalsContact OG1-N 3.14Å; T166-L170 WeakPolarHBondContact O-CG 3.43Å; T166-L170 PolarHBondContact O-N 2.87Å
167E75Confident71.7Confident144 Ų14493.6 Ų93.667%0.67346%0.464SS*.Hα-helixtrans-58.4-34.2173-175.5164.4-164.200111.4L170 N171E167-L170 PolarHBondContact O-N 2.88Å; E167-N171 WeakPolarHBondContact O-CB 3.38Å; E167-N171 PolarHBondContact O-N 2.72Å; E167-N171 PolarHBondContact O-ND2 3.35Å
168E75.8Confident73.7Confident111 Ų11188.1 Ų88.152%0.51946%0.455SS..Hα-helixtrans-63.7-47.3174.2-164.8173.5-165.700112.2I162 T166 L170 N171 H172I162-E168 HydrophobicContact CG2-CB 4.09Å; I162-E168 HydrophobicContact CG2-CG 4.1Å; T166-E168 PolarHBondContact O-N 3.37Å; E168-L170 PolarHBondContact O-N 2.92Å; E168-N171 PolarHBondContact O-N 3.19Å; E168-H172 WeakPolarHBondContact O-CB 3.46Å; E168-H172 PolarHBondContact O-N 3.05Å
169F81.1Confident75.4Confident64 Ų6490.8 Ų90.828%0.28146%0.463SS..Hα-helixtrans-60.7-43.9175.1178.3-96.4000112.3I162 P163 I164 T166 S173I162-F169 HydrophobicContact CG2-CB 3.72Å; P163-F169 WeakPolarHBondContact O-CB 3.37Å; I164-F169 HydrophobicContact CG2-CD1 4.48Å; I164-F169 HydrophobicContact CG2-CE1 4.08Å; I164-F169 HydrophobicContact CG2-CZ 4.11Å; T166-F169 PolarHBondContact O-N 3.42Å; T166-F169 WeakPolarHBondContact OG1-CB 3.48Å; T166-F169 PolarHBondContact OG1-N 3.28Å; T166-F169 VanDerWaalsContact OG1-N 3.14Å; F169-S173 VanDerWaalsContact O-CB 3.25Å; F169-S173 WeakPolarHBondContact O-CB 3.49Å; F169-S173 PolarHBondContact O-N 3.15Å
170L78.1Confident77.1Confident103 Ų10391.5 Ų91.554%0.53946%0.463SS..Hα-helixtrans-65.2-41.1178.9-70.4173.9000111.8T166 E167 E168 K174T166-L170 WeakPolarHBondContact O-CG 3.43Å; T166-L170 PolarHBondContact O-N 2.87Å; E167-L170 PolarHBondContact O-N 2.88Å; E168-L170 PolarHBondContact O-N 2.92Å; L170-K174 VanDerWaalsContact O-CB 3.23Å; L170-K174 WeakPolarHBondContact O-CB 3.43Å; L170-K174 PolarHBondContact O-N 3.26Å
171N79.6Confident79Confident89 Ų8990.1 Ų90.148%0.47645%0.452SS..Hα-helixtrans-68.2-44.3177.9-74.6-22.4000111.7E167 E168 K174 A175E167-N171 WeakPolarHBondContact O-CB 3.38Å; E167-N171 PolarHBondContact O-N 2.72Å; E167-N171 PolarHBondContact O-ND2 3.35Å; E168-N171 PolarHBondContact O-N 3.19Å; N171-K174 PolarHBondContact O-N 2.82Å; N171-A175 WeakPolarHBondContact O-CB 3.4Å; N171-A175 PolarHBondContact O-N 2.94Å
172H79.4Confident80.6Confident63 Ų6391.7 Ų91.729%0.29246%0.457SS..Hα-helixtrans-64.4-44.4176.1173.6-107.6000112.2I162 E168 K174 A175 R176I162-H172 HydrophobicContact CD1-CB 4.15Å; E168-H172 WeakPolarHBondContact O-CB 3.46Å; E168-H172 PolarHBondContact O-N 3.05Å; H172-K174 VanDerWaalsContact C-N 3.27Å; H172-K174 PolarHBondContact O-N 3.49Å; H172-A175 PolarHBondContact O-N 3.18Å; H172-R176 PolarHBondContact CE1-NH2 2.79Å; H172-R176 WeakPolarHBondContact O-CB 3.45Å; H172-R176 PolarHBondContact O-N 3.47Å
173S81.9Confident82.1Confident54 Ų5494.8 Ų94.838%0.37847%0.473SS..Hα-helixtrans-59.4-39.9173.8-1780000111.6F169 E177F169-S173 VanDerWaalsContact O-CB 3.25Å; F169-S173 WeakPolarHBondContact O-CB 3.49Å; F169-S173 PolarHBondContact O-N 3.15Å; S173-E177 WeakPolarHBondContact O-CB 3.48Å; S173-E177 PolarHBondContact O-N 3.47Å
174K85.2Confident83.3Confident117 Ų11799.5 Ų99.551%0.50948%0.481SS..Hα-helixtrans-68.6-40.4177.6-176.9-174.2174-161.80112.1L170 N171 H172 E177 A178L170-K174 VanDerWaalsContact O-CB 3.23Å; L170-K174 WeakPolarHBondContact O-CB 3.43Å; L170-K174 PolarHBondContact O-N 3.26Å; N171-K174 PolarHBondContact O-N 2.82Å; H172-K174 VanDerWaalsContact C-N 3.27Å; H172-K174 PolarHBondContact O-N 3.49Å; K174-E177 PolarHBondContact O-N 3.35Å; K174-A178 WeakPolarHBondContact O-CB 3.4Å; K174-A178 PolarHBondContact O-N 2.81Å
175A84.3Confident85.1Confident59 Ų5999.7 Ų99.749%0.48848%0.478SS..Hα-helixtrans-62.4-48.5176.200000110.8N171 H172 E177 A178 E179N171-A175 WeakPolarHBondContact O-CB 3.4Å; N171-A175 PolarHBondContact O-N 2.94Å; H172-A175 PolarHBondContact O-N 3.18Å; A175-E177 PolarHBondContact O-N 2.91Å; A175-A178 WeakPolarHBondContact O-CB 3.35Å; A175-A178 PolarHBondContact O-N 2.83Å; A175-A178 VanDerWaalsContact O-N 3.12Å; A175-E179 PolarHBondContact O-N 3.3Å
176R87Confident86.6Confident108 Ų10895.9 Ų95.941%0.40847%0.466SS..Hα-helixtrans-60.5-42.1174.8-173.2-174.3-66.9177-8.9112.4H172 A178 E179 M180H172-R176 PolarHBondContact CE1-NH2 2.79Å; H172-R176 WeakPolarHBondContact O-CB 3.45Å; H172-R176 PolarHBondContact O-N 3.47Å; R176-A178 VanDerWaalsContact C-N 3.28Å; R176-A178 PolarHBondContact O-N 2.87Å; R176-E179 PolarHBondContact O-N 2.91Å; R176-M180 HydrophobicContact CG-CG 4.5Å; R176-M180 WeakPolarHBondContact O-CB 3.44Å; R176-M180 VanDerWaalsContact O-CG 3.29Å; R176-M180 WeakPolarHBondContact O-CG 3.43Å; R176-M180 PolarHBondContact O-N 3.24Å
177E85.6Confident87.5Confident105 Ų10597.9 Ų97.949%0.49148%0.475SS..Hα-helixtrans-65.3-33.2177-160.1-166.714900112S173 K174 A175 R181S173-E177 WeakPolarHBondContact O-CB 3.48Å; S173-E177 PolarHBondContact O-N 3.47Å; K174-E177 PolarHBondContact O-N 3.35Å; A175-E177 PolarHBondContact O-N 2.91Å; E177-R181 PolarHBondContact O-N 2.75Å; E177-R181 VanDerWaalsContact O-N 3.1Å; E177-R181 IonicContact OE1-CZ 2.68Å; E177-R181 IonicContact OE1-NH1 3.77Å; E177-R181 PolarHBondContact OE1-NH1 2.73Å; E177-R181 IonicContact OE1-NH2 2.78Å
178A90.8Very high88.6Confident54 Ų5495.8 Ų95.845%0.44647%0.466SS..Hα-helixtrans-69.7-42.9174.100000111.8K174 A175 R176 R181 Q182K174-A178 WeakPolarHBondContact O-CB 3.4Å; K174-A178 PolarHBondContact O-N 2.81Å; A175-A178 WeakPolarHBondContact O-CB 3.35Å; A175-A178 PolarHBondContact O-N 2.83Å; A175-A178 VanDerWaalsContact O-N 3.12Å; R176-A178 VanDerWaalsContact C-N 3.28Å; R176-A178 PolarHBondContact O-N 2.87Å; A178-R181 WeakPolarHBondContact O-CB 3.28Å; A178-R181 PolarHBondContact O-N 3.48Å; A178-Q182 PolarHBondContact O-N 3.47Å
179E93.8Very high89.6Confident119 Ų11993.4 Ų93.456%0.55646%0.455SS*.Hα-helixtrans-60.7-49174.4-174.8-178.4-169.100111.3A175 R176 R181 Q182 L183A175-E179 PolarHBondContact O-N 3.3Å; R176-E179 PolarHBondContact O-N 2.91Å; E179-R181 PolarHBondContact O-N 3.24Å; E179-Q182 WeakPolarHBondContact O-CA 3.43Å; E179-Q182 WeakPolarHBondContact O-CB 3.46Å; E179-Q182 PolarHBondContact O-N 3.47Å; E179-L183 HydrophobicContact CG-CD1 4.24Å; E179-L183 WeakPolarHBondContact O-CG 3.45Å; E179-L183 PolarHBondContact O-N 3.29Å
180M92.3Very high90.3Very high84 Ų8496.7 Ų96.741%0.41447%0.466SS..Hα-helixtrans-59.7-33.7175.8-69.7-57-63.700112.5R176 L183 R184R176-M180 HydrophobicContact CG-CG 4.5Å; R176-M180 WeakPolarHBondContact O-CB 3.44Å; R176-M180 VanDerWaalsContact O-CG 3.29Å; R176-M180 WeakPolarHBondContact O-CG 3.43Å; R176-M180 PolarHBondContact O-N 3.24Å; M180-L183 HydrophobicContact SD-CD1 4.25Å; M180-R184 WeakPolarHBondContact O-CB 3.35Å; M180-R184 WeakPolarHBondContact O-CD 3.28Å; M180-R184 WeakPolarHBondContact O-CG 3.5Å; M180-R184 PolarHBondContact O-N 2.88Å; M180-R184 VanDerWaalsContact O-N 3.08Å
181R94Very high91.3Very high156 Ų15697 Ų9759%0.58947%0.465SS*.Hα-helixtrans-67.2-43.2172-97.7-168.7-177.285.92.8112.2E177 A178 E179 R184 K185E177-R181 PolarHBondContact O-N 2.75Å; E177-R181 VanDerWaalsContact O-N 3.1Å; E177-R181 IonicContact OE1-CZ 2.68Å; E177-R181 IonicContact OE1-NH1 3.77Å; E177-R181 PolarHBondContact OE1-NH1 2.73Å; E177-R181 IonicContact OE1-NH2 2.78Å; A178-R181 WeakPolarHBondContact O-CB 3.28Å; A178-R181 PolarHBondContact O-N 3.48Å; E179-R181 PolarHBondContact O-N 3.24Å; R181-R184 PolarHBondContact O-N 3.01Å; R181-K185 PolarHBondContact O-N 2.98Å
182Q95.4Very high92.1Very high117 Ų11798.7 Ų98.755%0.54747%0.47SS..Hα-helixtrans-63-47.2177-74.2-66-15.200110.8A178 E179 R184 K185 T186A178-Q182 PolarHBondContact O-N 3.47Å; E179-Q182 WeakPolarHBondContact O-CA 3.43Å; E179-Q182 WeakPolarHBondContact O-CB 3.46Å; E179-Q182 PolarHBondContact O-N 3.47Å; Q182-R184 VanDerWaalsContact C-N 3.31Å; Q182-R184 PolarHBondContact O-N 3.07Å; Q182-K185 WeakPolarHBondContact O-CA 3.23Å; Q182-K185 WeakPolarHBondContact O-CB 3.18Å; Q182-K185 PolarHBondContact O-N 3.49Å; Q182-T186 PolarHBondContact O-N 3.04Å; Q182-T186 PolarHBondContact O-OG1 3.47Å
183L95.4Very high92.9Very high90 Ų90102.4 Ų102.447%0.47148%0.482SS..Hα-helixtrans-58.4-41.6176.8-71.5173.5000112.5E179 M180 K185 T186 N187E179-L183 HydrophobicContact CG-CD1 4.24Å; E179-L183 WeakPolarHBondContact O-CG 3.45Å; E179-L183 PolarHBondContact O-N 3.29Å; M180-L183 HydrophobicContact SD-CD1 4.25Å; L183-K185 VanDerWaalsContact C-N 3.33Å; L183-K185 PolarHBondContact O-N 2.96Å; L183-T186 WeakPolarHBondContact CA-OG1 3.39Å; L183-T186 PolarHBondContact O-N 3.28Å; L183-T186 PolarHBondContact O-OG1 3.38Å; L183-T186 VanDerWaalsContact O-OG1 3.05Å; L183-N187 WeakPolarHBondContact O-CB 3.27Å; L183-N187 PolarHBondContact O-N 2.99Å
184R96.3Very high93.7Very high175 Ų175104.6 Ų104.666%0.6649%0.489SS*.Hα-helixtrans-63.8-39.6174.6-74.2169.8-177.4169.71.9112.2M180 R181 Q182 M188M180-R184 WeakPolarHBondContact O-CB 3.35Å; M180-R184 WeakPolarHBondContact O-CD 3.28Å; M180-R184 WeakPolarHBondContact O-CG 3.5Å; M180-R184 PolarHBondContact O-N 2.88Å; M180-R184 VanDerWaalsContact O-N 3.08Å; R181-R184 PolarHBondContact O-N 3.01Å; Q182-R184 VanDerWaalsContact C-N 3.31Å; Q182-R184 PolarHBondContact O-N 3.07Å; R184-M188 WeakPolarHBondContact O-CB 3.48Å; R184-M188 PolarHBondContact O-N 3.31Å; R184-M188 VanDerWaalsContact O-N 3.07Å
185K96.4Very high94.3Very high107 Ų107102 Ų10247%0.46549%0.49SS..Hα-helixtrans-66.1-47.5177.7-175.3178.3179.6-75.40111.2R181 Q182 L183 M188 E189R181-K185 PolarHBondContact O-N 2.98Å; Q182-K185 WeakPolarHBondContact O-CA 3.23Å; Q182-K185 WeakPolarHBondContact O-CB 3.18Å; Q182-K185 PolarHBondContact O-N 3.49Å; L183-K185 VanDerWaalsContact C-N 3.33Å; L183-K185 PolarHBondContact O-N 2.96Å; K185-M188 PolarHBondContact O-N 3.35Å; K185-E189 IonicContact NZ-OE1 2.78Å; K185-E189 PolarHBondContact NZ-OE1 3.38Å; K185-E189 WeakPolarHBondContact O-CG 3.45Å; K185-E189 PolarHBondContact O-N 2.92Å
186T95.3Very high94.9Very high50 Ų50102.3 Ų102.331%0.30749%0.492SS..Hα-helixtrans-66.6-39.2178.955.40000111.4Q182 L183 M188 E189 Y190Q182-T186 PolarHBondContact O-N 3.04Å; Q182-T186 PolarHBondContact O-OG1 3.47Å; L183-T186 WeakPolarHBondContact CA-OG1 3.39Å; L183-T186 PolarHBondContact O-N 3.28Å; L183-T186 PolarHBondContact O-OG1 3.38Å; L183-T186 VanDerWaalsContact O-OG1 3.05Å; T186-M188 PolarHBondContact O-N 3.45Å; T186-E189 PolarHBondContact O-N 3.04Å; T186-Y190 WeakPolarHBondContact O-CD2 3.44Å; T186-Y190 PolarHBondContact O-N 2.87Å
187N96Very high95.4Very high87 Ų87102.3 Ų102.347%0.46550%0.5SS..Hα-helixtrans-62.5-43176.4-164.839.4000111.8L183 E189 Y190 E191L183-N187 WeakPolarHBondContact O-CB 3.27Å; L183-N187 PolarHBondContact O-N 2.99Å; N187-E189 VanDerWaalsContact C-N 3.33Å; N187-E189 PolarHBondContact O-N 2.94Å; N187-Y190 PolarHBondContact O-N 3.42Å; N187-E191 PolarHBondContact ND2-OE1 3.1Å; N187-E191 WeakPolarHBondContact O-CB 3.47Å; N187-E191 WeakPolarHBondContact O-CG 3.42Å; N187-E191 PolarHBondContact O-N 3.31Å
188M96.6Very high96Very high99 Ų99102.6 Ų102.649%0.48850%0.501SS..Hα-helixtrans-60.4-41.7173.9-172.2-179.274.500112R184 K185 T186 Y190 E191 E192R184-M188 WeakPolarHBondContact O-CB 3.48Å; R184-M188 PolarHBondContact O-N 3.31Å; R184-M188 VanDerWaalsContact O-N 3.07Å; K185-M188 PolarHBondContact O-N 3.35Å; T186-M188 PolarHBondContact O-N 3.45Å; M188-Y190 PolarHBondContact O-N 2.89Å; M188-E191 PolarHBondContact O-N 3.11Å; M188-E192 WeakPolarHBondContact O-CG 3.37Å; M188-E192 PolarHBondContact O-N 3.49Å
189E96.3Very high96.3Very high61 Ų61107.4 Ų107.429%0.28551%0.512SS..Hα-helixtrans-64.3-37.8175.1-70.7171.6-163.900112.3K185 T186 N187 R193K185-E189 IonicContact NZ-OE1 2.78Å; K185-E189 PolarHBondContact NZ-OE1 3.38Å; K185-E189 WeakPolarHBondContact O-CG 3.45Å; K185-E189 PolarHBondContact O-N 2.92Å; T186-E189 PolarHBondContact O-N 3.04Å; N187-E189 VanDerWaalsContact C-N 3.33Å; N187-E189 PolarHBondContact O-N 2.94Å; E189-R193 WeakPolarHBondContact O-CG 3.14Å; E189-R193 PolarHBondContact O-N 3.13Å
190Y97.6Very high96.6Very high133 Ų133107.1 Ų107.152%0.52251%0.51SS..Hα-helixtrans-68.2-41174.4-78.3-62.8000112.4T186 N187 M188 E192 R193 N194T186-Y190 WeakPolarHBondContact O-CD2 3.44Å; T186-Y190 PolarHBondContact O-N 2.87Å; N187-Y190 PolarHBondContact O-N 3.42Å; M188-Y190 PolarHBondContact O-N 2.89Å; Y190-E192 VanDerWaalsContact C-N 3.34Å; Y190-E192 PolarHBondContact O-N 2.96Å; Y190-R193 PolarHBondContact O-N 2.87Å; Y190-N194 WeakPolarHBondContact O-CB 3.38Å; Y190-N194 VanDerWaalsContact O-CG 3.26Å; Y190-N194 PolarHBondContact O-N 3.32Å
191E97.3Very high96.8Very high111 Ų111107 Ų10752%0.51951%0.514SS..Hα-helixtrans-59.5-44.2174.1-74.4168.8-171.400111.1N187 M188 N194 A195N187-E191 PolarHBondContact ND2-OE1 3.1Å; N187-E191 WeakPolarHBondContact O-CB 3.47Å; N187-E191 WeakPolarHBondContact O-CG 3.42Å; N187-E191 PolarHBondContact O-N 3.31Å; M188-E191 PolarHBondContact O-N 3.11Å; E191-N194 PolarHBondContact O-N 2.62Å; E191-A195 WeakPolarHBondContact O-CB 3.38Å; E191-A195 PolarHBondContact O-N 2.73Å
192E97.2Very high97Very high123 Ų123105 Ų10558%0.57551%0.512SS*.Hα-helixtrans-62-44.7175.1-74.7177.4-179.300112.5M188 Y190 A195 A196M188-E192 WeakPolarHBondContact O-CG 3.37Å; M188-E192 PolarHBondContact O-N 3.49Å; Y190-E192 VanDerWaalsContact C-N 3.34Å; Y190-E192 PolarHBondContact O-N 2.96Å; E192-A195 PolarHBondContact O-N 3.36Å; E192-A196 PolarHBondContact O-N 3.08Å
193R97Very high97.2Very high142 Ų142103.2 Ų103.254%0.53651%0.512SS..Hα-helixtrans-63.6-42.6176.8-72.5175.7-168.3167.17.7111.8E189 Y190 A195 A196 L197E189-R193 WeakPolarHBondContact O-CG 3.14Å; E189-R193 PolarHBondContact O-N 3.13Å; Y190-R193 PolarHBondContact O-N 2.87Å; R193-A195 VanDerWaalsContact C-N 3.34Å; R193-A196 PolarHBondContact O-N 3.48Å; R193-L197 WeakPolarHBondContact O-CG 3.32Å; R193-L197 PolarHBondContact O-N 2.99Å
194N97.3Very high97.3Very high100 Ų100103.9 Ų103.954%0.53551%0.514SS..Hα-helixtrans-64-41177.8-75.3-8.1000111.2Y190 E191 A196 L197 Q198Y190-N194 WeakPolarHBondContact O-CB 3.38Å; Y190-N194 VanDerWaalsContact O-CG 3.26Å; Y190-N194 PolarHBondContact O-N 3.32Å; E191-N194 PolarHBondContact O-N 2.62Å; N194-A196 VanDerWaalsContact C-N 3.34Å; N194-A196 PolarHBondContact O-N 2.79Å; N194-L197 PolarHBondContact O-N 3.22Å; N194-Q198 WeakPolarHBondContact O-CB 3.33Å; N194-Q198 PolarHBondContact O-N 3.4Å
195A97.9Very high97.4Very high63 Ų63103.6 Ų103.652%0.52151%0.513SS..Hα-helixtrans-62.2-41174.900000112.3E191 E192 R193 Q198 K199E191-A195 WeakPolarHBondContact O-CB 3.38Å; E191-A195 PolarHBondContact O-N 2.73Å; E192-A195 PolarHBondContact O-N 3.36Å; R193-A195 VanDerWaalsContact C-N 3.34Å; A195-Q198 PolarHBondContact O-N 3.33Å; A195-K199 PolarHBondContact O-N 3.41Å; A195-K199 VanDerWaalsContact O-N 3.09Å
196A97.6Very high97.5Very high65 Ų6599.4 Ų99.454%0.53750%0.5SS..Hα-helixtrans-64.7-43.4176.200000112.4E192 R193 N194 K199 H200E192-A196 PolarHBondContact O-N 3.08Å; R193-A196 PolarHBondContact O-N 3.48Å; N194-A196 VanDerWaalsContact C-N 3.34Å; N194-A196 PolarHBondContact O-N 2.79Å; A196-K199 PolarHBondContact O-N 2.91Å; A196-H200 PolarHBondContact O-N 2.82Å; A196-H200 VanDerWaalsContact O-N 3.08Å
197L98Very high97.7Very high108 Ų10898.7 Ų98.757%0.56550%0.499SS*.Hα-helixtrans-62.6-44.3175.5-75.6170.9000111.6R193 N194 K199 H200 V201R193-L197 WeakPolarHBondContact O-CG 3.32Å; R193-L197 PolarHBondContact O-N 2.99Å; N194-L197 PolarHBondContact O-N 3.22Å; L197-K199 VanDerWaalsContact C-N 3.31Å; L197-K199 PolarHBondContact O-N 3.5Å; L197-H200 WeakPolarHBondContact O-CB 3.49Å; L197-H200 PolarHBondContact O-N 3.49Å; L197-V201 WeakPolarHBondContact O-CG2 3.45Å; L197-V201 PolarHBondContact O-N 3.42Å
198Q97.7Very high97.8Very high110 Ų11098 Ų9851%0.51450%0.498SS..Hα-helixtrans-57.7-45.6177.8-172.464.91500111.3N194 A195 H200 V201 E202N194-Q198 WeakPolarHBondContact O-CB 3.33Å; N194-Q198 PolarHBondContact O-N 3.4Å; A195-Q198 PolarHBondContact O-N 3.33Å; Q198-H200 VanDerWaalsContact C-N 3.3Å; Q198-H200 PolarHBondContact O-N 2.89Å; Q198-V201 PolarHBondContact O-N 3.34Å; Q198-E202 WeakPolarHBondContact O-CG 3.48Å; Q198-E202 PolarHBondContact O-N 2.98Å
199K98.1Very high97.9Very high155 Ų15598 Ų9867%0.67450%0.497SS*.Hα-helixtrans-61.3-37.7175.2-173.4179.5179.8-178.90112.5A195 A196 L197 S203A195-K199 PolarHBondContact O-N 3.41Å; A195-K199 VanDerWaalsContact O-N 3.09Å; A196-K199 PolarHBondContact O-N 2.91Å; L197-K199 VanDerWaalsContact C-N 3.31Å; L197-K199 PolarHBondContact O-N 3.5Å; K199-S203 WeakPolarHBondContact O-CB 3.43Å; K199-S203 PolarHBondContact O-N 2.48Å
200H98.4Very high98Very high113 Ų113102.6 Ų102.652%0.52351%0.511SS..Hα-helixtrans-66.7-43.9176.8-173.262.9000111.7A196 L197 Q198 E202 S203 M204A196-H200 PolarHBondContact O-N 2.82Å; A196-H200 VanDerWaalsContact O-N 3.08Å; L197-H200 WeakPolarHBondContact O-CB 3.49Å; L197-H200 PolarHBondContact O-N 3.49Å; Q198-H200 VanDerWaalsContact C-N 3.3Å; Q198-H200 PolarHBondContact O-N 2.89Å; H200-E202 VanDerWaalsContact C-N 3.35Å; H200-E202 PolarHBondContact O-N 3.31Å; H200-S203 WeakPolarHBondContact O-CB 3.42Å; H200-S203 PolarHBondContact O-N 2.62Å; H200-M204 PolarHBondContact NE2-SD 2.77Å; H200-M204 VanDerWaalsContact NE2-SD 3.42Å; H200-M204 WeakPolarHBondContact O-CG 3.36Å; H200-M204 PolarHBondContact O-N 2.88Å
201V98.3Very high98Very high83 Ų83101.5 Ų101.550%0.50351%0.514SS..Hα-helixtrans-59.4-45.8175.2171.40000110.9L197 Q198 S203 M204 R205L197-V201 WeakPolarHBondContact O-CG2 3.45Å; L197-V201 PolarHBondContact O-N 3.42Å; Q198-V201 PolarHBondContact O-N 3.34Å; V201-S203 VanDerWaalsContact C-N 3.35Å; V201-S203 PolarHBondContact O-N 3.21Å; V201-M204 PolarHBondContact O-N 3.06Å; V201-R205 WeakPolarHBondContact O-CB 3.46Å; V201-R205 PolarHBondContact O-N 2.94Å
202E98.1Very high98Very high114 Ų114101.6 Ų101.653%0.53351%0.514SS..Hα-helixtrans-61-43.2176.4-73.1168.3-171.400111.9Q198 H200 M204 R205 G206Q198-E202 WeakPolarHBondContact O-CG 3.48Å; Q198-E202 PolarHBondContact O-N 2.98Å; H200-E202 VanDerWaalsContact C-N 3.35Å; H200-E202 PolarHBondContact O-N 3.31Å; E202-M204 PolarHBondContact O-N 3.43Å; E202-R205 PolarHBondContact O-N 3.48Å; E202-G206 PolarHBondContact O-N 3.36Å
203S98.4Very high98.1Very high79 Ų7997.5 Ų97.555%0.55251%0.505SS*.Hα-helixtrans-62.5-42.7175.8-175.30000112.4K199 H200 V201 A207K199-S203 WeakPolarHBondContact O-CB 3.43Å; K199-S203 PolarHBondContact O-N 2.48Å; H200-S203 WeakPolarHBondContact O-CB 3.42Å; H200-S203 PolarHBondContact O-N 2.62Å; V201-S203 VanDerWaalsContact C-N 3.35Å; V201-S203 PolarHBondContact O-N 3.21Å; S203-A207 PolarHBondContact O-N 3.46Å; S203-A207 VanDerWaalsContact O-N 3.12Å
204M98.5Very high98.2Very high104 Ų10495 Ų9551%0.51250%0.503SS..Hα-helixtrans-65.6-44.7177.3-76.1-175.963.100111.2H200 V201 E202 G206 A207 V208H200-M204 PolarHBondContact NE2-SD 2.77Å; H200-M204 VanDerWaalsContact NE2-SD 3.42Å; H200-M204 WeakPolarHBondContact O-CG 3.36Å; H200-M204 PolarHBondContact O-N 2.88Å; V201-M204 PolarHBondContact O-N 3.06Å; E202-M204 PolarHBondContact O-N 3.43Å; M204-G206 VanDerWaalsContact C-N 3.33Å; M204-G206 PolarHBondContact O-N 3.36Å; M204-A207 WeakPolarHBondContact O-CA 3.48Å; M204-A207 WeakPolarHBondContact O-CB 3.25Å; M204-A207 PolarHBondContact O-N 3.18Å; M204-V208 WeakPolarHBondContact O-CG2 3.29Å; M204-V208 PolarHBondContact O-N 2.9Å
205R98.3Very high98.2Very high169 Ų16993.7 Ų93.764%0.63850%0.498SS*.Hα-helixtrans-57.6-47.4176.9-178-179.51721655111.3V201 E202 A207 V208 E209V201-R205 WeakPolarHBondContact O-CB 3.46Å; V201-R205 PolarHBondContact O-N 2.94Å; E202-R205 PolarHBondContact O-N 3.48Å; R205-A207 PolarHBondContact O-N 3.48Å; R205-V208 PolarHBondContact O-N 3.06Å; R205-V208 VanDerWaalsContact O-N 3.15Å; R205-E209 IonicContact CZ-OE1 3.32Å; R205-E209 IonicContact NE-OE1 3.48Å; R205-E209 PolarHBondContact NE-OE1 3.48Å; R205-E209 IonicContact NH2-OE1 2.73Å; R205-E209 WeakPolarHBondContact O-CG 3.37Å; R205-E209 PolarHBondContact O-N 3.41Å
206G98.4Very high98.2Very high19 Ų1997.1 Ų97.120%0.19650%0.504CS..Hα-helixtrans-63.5-28.717600000113.4E202 M204 R210E202-G206 PolarHBondContact O-N 3.36Å; M204-G206 VanDerWaalsContact C-N 3.33Å; M204-G206 PolarHBondContact O-N 3.36Å; G206-R210 WeakPolarHBondContact O-CG 3.2Å; G206-R210 PolarHBondContact O-N 3.49Å; G206-R210 PolarHBondContact O-NH1 3.24Å
207A98.4Very high98.2Very high34 Ų3499.9 Ų99.928%0.28151%0.506SS..Hα-helixtrans-72.4-39.9173.200000112.2S203 M204 R205 R210 L211S203-A207 PolarHBondContact O-N 3.46Å; S203-A207 VanDerWaalsContact O-N 3.12Å; M204-A207 WeakPolarHBondContact O-CA 3.48Å; M204-A207 WeakPolarHBondContact O-CB 3.25Å; M204-A207 PolarHBondContact O-N 3.18Å; R205-A207 PolarHBondContact O-N 3.48Å; A207-R210 PolarHBondContact O-N 2.85Å; A207-L211 WeakPolarHBondContact O-CG 3.45Å; A207-L211 PolarHBondContact O-N 3.18Å
208V98.3Very high98.2Very high73 Ų7398.6 Ų98.644%0.44250%0.498SS..Hα-helixtrans-61.8-48.6174.3172.70000110.5M204 R205 R210 L211 E212M204-V208 WeakPolarHBondContact O-CG2 3.29Å; M204-V208 PolarHBondContact O-N 2.9Å; R205-V208 PolarHBondContact O-N 3.06Å; R205-V208 VanDerWaalsContact O-N 3.15Å; V208-R210 VanDerWaalsContact C-N 3.26Å; V208-R210 PolarHBondContact O-N 3.13Å; V208-L211 PolarHBondContact O-N 2.84Å; V208-L211 VanDerWaalsContact O-N 3.09Å; V208-E212 HydrophobicContact CG1-CG 4.15Å; V208-E212 WeakPolarHBondContact O-CB 3.21Å; V208-E212 WeakPolarHBondContact O-CG 3.34Å; V208-E212 PolarHBondContact O-N 3.22Å
209E98.4Very high98.2Very high100 Ų100102 Ų10247%0.46751%0.506SS..Hα-helixtrans-58.4-37.9179.4-73.1171.3-172.600112.1R205 G213R205-E209 IonicContact CZ-OE1 3.32Å; R205-E209 IonicContact NE-OE1 3.48Å; R205-E209 PolarHBondContact NE-OE1 3.48Å; R205-E209 IonicContact NH2-OE1 2.73Å; R205-E209 WeakPolarHBondContact O-CG 3.37Å; R205-E209 PolarHBondContact O-N 3.41Å; E209-G213 PolarHBondContact O-N 3.24Å; E209-G213 VanDerWaalsContact O-N 3.09Å
210R98.2Very high98.2Very high156 Ų156101.2 Ų101.259%0.58950%0.504SS*.Hα-helixtrans-66.1-47.9173.6-74.2-170.6-60.4-85.32.5112.5G206 A207 V208 E212 G213 D214G206-R210 WeakPolarHBondContact O-CG 3.2Å; G206-R210 PolarHBondContact O-N 3.49Å; G206-R210 PolarHBondContact O-NH1 3.24Å; A207-R210 PolarHBondContact O-N 2.85Å; V208-R210 VanDerWaalsContact C-N 3.26Å; V208-R210 PolarHBondContact O-N 3.13Å; R210-E212 VanDerWaalsContact C-N 3.3Å; R210-E212 PolarHBondContact O-N 3.42Å; R210-G213 PolarHBondContact O-N 2.98Å; R210-G213 VanDerWaalsContact O-N 3.15Å; R210-D214 PolarHBondContact O-N 3.22Å
211L98.4Very high98.2Very high110 Ų110101.4 Ų101.458%0.57650%0.5SS*.Hα-helixtrans-62.5-38.1178.7-74.6171.9000112A207 V208 G213 D214 V215A207-L211 WeakPolarHBondContact O-CG 3.45Å; A207-L211 PolarHBondContact O-N 3.18Å; V208-L211 PolarHBondContact O-N 2.84Å; V208-L211 VanDerWaalsContact O-N 3.09Å; L211-G213 VanDerWaalsContact C-N 3.34Å; L211-D214 PolarHBondContact O-N 3.42Å; L211-V215 WeakPolarHBondContact O-CB 3.07Å; L211-V215 VanDerWaalsContact O-CG2 3.24Å; L211-V215 WeakPolarHBondContact O-CG2 3.47Å; L211-V215 PolarHBondContact O-N 3.42Å
212E98.3Very high98.2Very high114 Ų114100.7 Ų100.753%0.53349%0.494SS..Hα-helixtrans-62.3-42.7174-73.7177.9163.200111.2V208 R210 V215 M216V208-E212 HydrophobicContact CG1-CG 4.15Å; V208-E212 WeakPolarHBondContact O-CB 3.21Å; V208-E212 WeakPolarHBondContact O-CG 3.34Å; V208-E212 PolarHBondContact O-N 3.22Å; R210-E212 VanDerWaalsContact C-N 3.3Å; R210-E212 PolarHBondContact O-N 3.42Å; E212-V215 PolarHBondContact O-N 3.32Å; E212-M216 WeakPolarHBondContact O-CG 3.35Å; E212-M216 PolarHBondContact O-N 2.95Å
213G98.4Very high98.2Very high37 Ų3796.8 Ų96.838%0.38148%0.484SS..Hα-helixtrans-58.1-49172.700000112.9E209 R210 L211 V215 M216 Q217E209-G213 PolarHBondContact O-N 3.24Å; E209-G213 VanDerWaalsContact O-N 3.09Å; R210-G213 PolarHBondContact O-N 2.98Å; R210-G213 VanDerWaalsContact O-N 3.15Å; L211-G213 VanDerWaalsContact C-N 3.34Å; G213-V215 VanDerWaalsContact C-N 3.34Å; G213-V215 PolarHBondContact O-N 3.25Å; G213-M216 PolarHBondContact O-N 3.46Å; G213-Q217 PolarHBondContact O-N 2.98Å
214D98.1Very high98.2Very high90 Ų9097.1 Ų97.148%0.48148%0.479SS..Hα-helixtrans-61.8-41.9178.3-65.3-17000111.5R210 L211 M216 Q217 E218R210-D214 PolarHBondContact O-N 3.22Å; L211-D214 PolarHBondContact O-N 3.42Å; D214-M216 PolarHBondContact O-N 2.93Å; D214-Q217 PolarHBondContact O-N 2.98Å; D214-E218 PolarHBondContact O-N 3.48Å
215V98.4Very high98.1Very high71 Ų7196.3 Ų96.343%0.4348%0.476SS..Hα-helixtrans-63.8-41.1176.3168.20000111.4L211 E212 G213 R219L211-V215 WeakPolarHBondContact O-CB 3.07Å; L211-V215 VanDerWaalsContact O-CG2 3.24Å; L211-V215 WeakPolarHBondContact O-CG2 3.47Å; L211-V215 PolarHBondContact O-N 3.42Å; E212-V215 PolarHBondContact O-N 3.32Å; G213-V215 VanDerWaalsContact C-N 3.34Å; G213-V215 PolarHBondContact O-N 3.25Å; V215-R219 WeakPolarHBondContact O-CB 3.42Å; V215-R219 VanDerWaalsContact O-CG 3.26Å; V215-R219 WeakPolarHBondContact O-CG 3.33Å; V215-R219 PolarHBondContact O-N 3.34Å
216M98.1Very high98.1Very high135 Ų13594.4 Ų94.467%0.66547%0.474SS*.Hα-helixtrans-63.2-44.9175.8-76-175.664.900111.5E212 G213 D214 R219 E220E212-M216 WeakPolarHBondContact O-CG 3.35Å; E212-M216 PolarHBondContact O-N 2.95Å; G213-M216 PolarHBondContact O-N 3.46Å; D214-M216 PolarHBondContact O-N 2.93Å; M216-R219 WeakPolarHBondContact O-CB 3.43Å; M216-R219 PolarHBondContact O-N 3.22Å; M216-E220 PolarHBondContact O-N 3.07Å
217Q98.1Very high98Very high123 Ų12399.5 Ų99.558%0.57549%0.493SS*.Hα-helixtrans-62-45178.3-173.3176.936.500111.8G213 D214 R219 E220 R221G213-Q217 PolarHBondContact O-N 2.98Å; D214-Q217 PolarHBondContact O-N 2.98Å; Q217-R219 VanDerWaalsContact C-N 3.32Å; Q217-R219 PolarHBondContact O-N 3.4Å; Q217-E220 PolarHBondContact O-N 2.66Å; Q217-R221 WeakPolarHBondContact O-CB 3.22Å; Q217-R221 PolarHBondContact O-N 3.03Å
218E97.6Very high97.9Very high82 Ų82103.8 Ų103.838%0.38351%0.507SS..Hα-helixtrans-67-32.9176.8-79.1-58.2128.400112.5D214 R221 N222D214-E218 PolarHBondContact O-N 3.48Å; E218-R221 IonicContact OE1-NE 3.71Å; E218-R221 PolarHBondContact OE1-NE 2.97Å; E218-R221 IonicContact OE2-CZ 2.66Å; E218-R221 IonicContact OE2-NE 3.18Å; E218-R221 PolarHBondContact OE2-NE 3.3Å; E218-R221 IonicContact OE2-NH2 2.62Å; E218-R221 PolarHBondContact OE2-NH2 3.05Å; E218-N222 WeakPolarHBondContact O-CB 3.44Å; E218-N222 PolarHBondContact O-N 2.97Å; E218-N222 PolarHBondContact O-ND2 3.05Å
219R98.1Very high97.8Very high182 Ų182104.3 Ų104.369%0.68751%0.507SS*.Hα-helixtrans-64.7-43.4172.6-78.2175.4-178.9-169.12.4111.7V215 M216 Q217 N222 G223V215-R219 WeakPolarHBondContact O-CB 3.42Å; V215-R219 VanDerWaalsContact O-CG 3.26Å; V215-R219 WeakPolarHBondContact O-CG 3.33Å; V215-R219 PolarHBondContact O-N 3.34Å; M216-R219 WeakPolarHBondContact O-CB 3.43Å; M216-R219 PolarHBondContact O-N 3.22Å; Q217-R219 VanDerWaalsContact C-N 3.32Å; Q217-R219 PolarHBondContact O-N 3.4Å; R219-N222 PolarHBondContact O-N 3.08Å; R219-G223 PolarHBondContact O-N 3.25Å
220E97.9Very high97.7Very high137 Ų137103.9 Ų103.964%0.6451%0.505SS*.Hα-helixtrans-63.3-46.8176.1-174.6175.3-160.500111.1M216 Q217 N222 G223 L224M216-E220 PolarHBondContact O-N 3.07Å; Q217-E220 PolarHBondContact O-N 2.66Å; E220-N222 PolarHBondContact O-N 3.35Å; E220-G223 WeakPolarHBondContact O-CA 3.33Å; E220-G223 PolarHBondContact O-N 3.36Å; E220-G223 VanDerWaalsContact O-N 3.09Å; E220-L224 PolarHBondContact O-N 3.5Å
221R97.7Very high97.6Very high117 Ų117100.6 Ų100.644%0.44250%0.503SS..Hα-helixtrans-59-44.6176.5-166.7-177.574.176.96.3112.1Q217 E218 G223 L224 L225Q217-R221 WeakPolarHBondContact O-CB 3.22Å; Q217-R221 PolarHBondContact O-N 3.03Å; E218-R221 IonicContact OE1-NE 3.71Å; E218-R221 PolarHBondContact OE1-NE 2.97Å; E218-R221 IonicContact OE2-CZ 2.66Å; E218-R221 IonicContact OE2-NE 3.18Å; E218-R221 PolarHBondContact OE2-NE 3.3Å; E218-R221 IonicContact OE2-NH2 2.62Å; E218-R221 PolarHBondContact OE2-NH2 3.05Å; R221-G223 VanDerWaalsContact C-N 3.34Å; R221-L224 PolarHBondContact O-N 2.85Å; R221-L225 WeakPolarHBondContact O-CG 3.25Å; R221-L225 PolarHBondContact O-N 2.93Å
222N97.9Very high97.4Very high69 Ų69100.8 Ų100.837%0.36950%0.503SS..Hα-helixtrans-64.6-39.2174.7-79.1-52.3000111.7E218 R219 E220 L224 L225 H226E218-N222 WeakPolarHBondContact O-CB 3.44Å; E218-N222 PolarHBondContact O-N 2.97Å; E218-N222 PolarHBondContact O-ND2 3.05Å; R219-N222 PolarHBondContact O-N 3.08Å; E220-N222 PolarHBondContact O-N 3.35Å; N222-L224 PolarHBondContact O-N 2.97Å; N222-L225 PolarHBondContact O-N 3.38Å; N222-H226 WeakPolarHBondContact O-CB 3.11Å; N222-H226 PolarHBondContact O-CD2 2.87Å; N222-H226 PolarHBondContact O-N 3.42Å
223G98.2Very high97.2Very high31 Ų3197.3 Ų97.332%0.3249%0.485SS..Hα-helixtrans-57.8-46.1174.100000112.4R219 E220 R221 H226 Q227R219-G223 PolarHBondContact O-N 3.25Å; E220-G223 WeakPolarHBondContact O-CA 3.33Å; E220-G223 PolarHBondContact O-N 3.36Å; E220-G223 VanDerWaalsContact O-N 3.09Å; R221-G223 VanDerWaalsContact C-N 3.34Å; G223-H226 PolarHBondContact O-N 3.38Å; G223-Q227 WeakPolarHBondContact O-CG 3.34Å; G223-Q227 PolarHBondContact O-N 3.02Å
224L97.8Very high97.1Very high87 Ų87101.6 Ų101.646%0.45550%0.495SS..Hα-helixtrans-62.7-44.6175.3-69.6172.8000111.9E220 R221 N222 H226 Q227 H228E220-L224 PolarHBondContact O-N 3.5Å; R221-L224 PolarHBondContact O-N 2.85Å; N222-L224 PolarHBondContact O-N 2.97Å; L224-H226 VanDerWaalsContact C-N 3.32Å; L224-H226 PolarHBondContact O-N 2.94Å; L224-Q227 PolarHBondContact O-N 3.27Å; L224-H228 PolarHBondContact O-CD2 2.99Å; L224-H228 PolarHBondContact O-N 3.06Å
225L97.5Very high96.9Very high87 Ų8799 Ų9946%0.45549%0.486SS..Hα-helixtrans-61.5-40.1176.3-74.3174.3000112.3R221 N222 H228 L229R221-L225 WeakPolarHBondContact O-CG 3.25Å; R221-L225 PolarHBondContact O-N 2.93Å; N222-L225 PolarHBondContact O-N 3.38Å; L225-H228 PolarHBondContact O-N 2.91Å; L225-L229 WeakPolarHBondContact O-CB 3.41Å; L225-L229 PolarHBondContact O-N 3.07Å
226H97.3Very high96.7Very high128 Ų12897.8 Ų97.859%0.59348%0.477SS*.Hα-helixtrans-62.6-42.6173.8-81.8-63.2000111.8N222 G223 L224 L229 E230N222-H226 WeakPolarHBondContact O-CB 3.11Å; N222-H226 PolarHBondContact O-CD2 2.87Å; N222-H226 PolarHBondContact O-N 3.42Å; G223-H226 PolarHBondContact O-N 3.38Å; L224-H226 VanDerWaalsContact C-N 3.32Å; L224-H226 PolarHBondContact O-N 2.94Å; H226-L229 PolarHBondContact O-N 3.48Å; H226-E230 WeakPolarHBondContact O-CB 3.06Å; H226-E230 PolarHBondContact O-N 3.34Å
227Q97.6Very high96.5Very high126 Ų12692.4 Ų92.459%0.58945%0.452SS*.Hα-helixtrans-63.4-41175.1-72.8176.7-200112.5G223 L224 E230 T231G223-Q227 WeakPolarHBondContact O-CG 3.34Å; G223-Q227 PolarHBondContact O-N 3.02Å; L224-Q227 PolarHBondContact O-N 3.27Å; Q227-E230 WeakPolarHBondContact O-CB 3.46Å; Q227-E230 PolarHBondContact O-N 3.39Å; Q227-T231 WeakPolarHBondContact O-CB 3.39Å; Q227-T231 PolarHBondContact O-N 3.24Å; Q227-T231 PolarHBondContact O-OG1 3.49Å
228H96.5Very high96.3Very high124 Ų12490.5 Ų90.557%0.57445%0.453SS*.Hα-helixtrans-61.9-44.5173.9-83.7-70.3000111.6L224 L225 T231 L232L224-H228 PolarHBondContact O-CD2 2.99Å; L224-H228 PolarHBondContact O-N 3.06Å; L225-H228 PolarHBondContact O-N 2.91Å; H228-T231 PolarHBondContact O-N 3.42Å; H228-L232 WeakPolarHBondContact O-CG 3.48Å; H228-L232 PolarHBondContact O-N 2.89Å
229L95.6Very high96.1Very high84 Ų8488.4 Ų88.444%0.4445%0.447SS..Hα-helixtrans-61.6-45.4177.2-168.8157000110.8L225 H226 T231 L232 R233L225-L229 WeakPolarHBondContact O-CB 3.41Å; L225-L229 PolarHBondContact O-N 3.07Å; H226-L229 PolarHBondContact O-N 3.48Å; L229-T231 VanDerWaalsContact C-N 3.34Å; L229-T231 PolarHBondContact O-N 3.16Å; L229-L232 PolarHBondContact O-N 2.81Å; L229-R233 HydrophobicContact CD2-CG 3.86Å; L229-R233 WeakPolarHBondContact O-CG 3.33Å; L229-R233 PolarHBondContact O-N 2.99Å
230E96.1Very high95.9Very high91 Ų9179.8 Ų79.843%0.42541%0.414SS..Hα-helixtrans-57-46.9175.8-170.769.8-168.100111.9H226 Q227 L232 R233 Q234 F254H226-E230 WeakPolarHBondContact O-CB 3.06Å; H226-E230 PolarHBondContact O-N 3.34Å; Q227-E230 WeakPolarHBondContact O-CB 3.46Å; Q227-E230 PolarHBondContact O-N 3.39Å; E230-L232 VanDerWaalsContact C-N 3.35Å; E230-L232 PolarHBondContact O-N 3.42Å; E230-R233 WeakPolarHBondContact O-CB 3.33Å; E230-R233 PolarHBondContact O-N 3.34Å; E230-Q234 WeakPolarHBondContact O-CB 3.47Å; E230-Q234 PolarHBondContact O-N 3.1Å; E230-F254 HydrophobicContact CG-CZ 4.31Å; E230-F254 WeakPolarHBondContact OE1-CE1 3.25Å; E230-F254 WeakPolarHBondContact OE1-CE2 3.37Å; E230-F254 WeakPolarHBondContact OE1-CZ 3.41Å; E230-F254 WeakPolarHBondContact OE2-CZ 2.93Å
231T95.1Very high95.7Very high88 Ų8876.1 Ų76.154%0.5440%0.404SS..Hα-helixtrans-61.3-44.5178.4-55.50000111Q227 H228 L229 Q234 A235Q227-T231 WeakPolarHBondContact O-CB 3.39Å; Q227-T231 PolarHBondContact O-N 3.24Å; Q227-T231 PolarHBondContact O-OG1 3.49Å; H228-T231 PolarHBondContact O-N 3.42Å; L229-T231 VanDerWaalsContact C-N 3.34Å; L229-T231 PolarHBondContact O-N 3.16Å; T231-Q234 PolarHBondContact O-N 3.45Å; T231-A235 WeakPolarHBondContact O-CB 3.22Å; T231-A235 PolarHBondContact O-N 3.3Å
232L94.1Very high95.4Very high113 Ų11376 Ų7659%0.59242%0.416SS*.Hα-helixtrans-64.1-44.4176.5-74.3171.2000111.9H228 L229 E230 Q234 A235 L236H228-L232 WeakPolarHBondContact O-CG 3.48Å; H228-L232 PolarHBondContact O-N 2.89Å; L229-L232 PolarHBondContact O-N 2.81Å; E230-L232 VanDerWaalsContact C-N 3.35Å; E230-L232 PolarHBondContact O-N 3.42Å; L232-Q234 VanDerWaalsContact C-N 3.32Å; L232-Q234 PolarHBondContact O-N 3.42Å; L232-A235 PolarHBondContact O-N 3.46Å; L232-L236 WeakPolarHBondContact O-CB 3.39Å; L232-L236 VanDerWaalsContact O-CG 3.26Å; L232-L236 WeakPolarHBondContact O-CG 3.44Å; L232-L236 PolarHBondContact O-N 3.1Å
233R95.4Very high95.1Very high41 Ų4173 Ų7316%0.15540%0.401CS..Hα-helixtrans-56.5-48.6175-73.5180102.391.10.6110.6L229 E230 A235 L236 T237 F254 I257 D258L229-R233 HydrophobicContact CD2-CG 3.86Å; L229-R233 WeakPolarHBondContact O-CG 3.33Å; L229-R233 PolarHBondContact O-N 2.99Å; E230-R233 WeakPolarHBondContact O-CB 3.33Å; E230-R233 PolarHBondContact O-N 3.34Å; R233-A235 PolarHBondContact O-N 2.83Å; R233-L236 PolarHBondContact O-N 3.41Å; R233-T237 WeakPolarHBondContact O-CB 3.43Å; R233-T237 PolarHBondContact O-N 3.32Å; R233-T237 PolarHBondContact O-OG1 2.78Å; R233-F254 HydrophobicContact CB-CD2 4.43Å; R233-F254 HydrophobicContact CB-CE2 3.65Å; R233-F254 HydrophobicContact CB-CZ 3.98Å; R233-F254 PolarHBondContact NE-O 3.44Å; R233-I257 HydrophobicContact CB-CG2 4.01Å; R233-I257 HydrophobicContact CG-CG2 3.81Å; R233-D258 IonicContact CZ-OD1 3.41Å; R233-D258 IonicContact CZ-OD2 3.25Å; R233-D258 IonicContact NH1-OD1 2.76Å; R233-D258 PolarHBondContact NH1-OD1 3.21Å; R233-D258 IonicContact NH1-OD2 3.53Å; R233-D258 PolarHBondContact NH1-OD2 3.08Å; R233-D258 VanDerWaalsContact NH2-CG 3.28Å; R233-D258 IonicContact NH2-OD1 3.1Å; R233-D258 IonicContact NH2-OD2 2.68Å; R233-D258 PolarHBondContact NH2-OD2 3.4Å
234Q95.4Very high94.8Very high127 Ų12774.8 Ų74.859%0.59341%0.406SS*.Hα-helixtrans-61.7-44.7-179.4-170.4174.82100111.8E230 T231 L232 T237 S238 F254E230-Q234 WeakPolarHBondContact O-CB 3.47Å; E230-Q234 PolarHBondContact O-N 3.1Å; T231-Q234 PolarHBondContact O-N 3.45Å; L232-Q234 VanDerWaalsContact C-N 3.32Å; L232-Q234 PolarHBondContact O-N 3.42Å; Q234-T237 PolarHBondContact O-N 3.35Å; Q234-S238 WeakPolarHBondContact O-CB 3.09Å; Q234-S238 PolarHBondContact O-N 3.08Å; Q234-F254 HydrophobicContact CB-CE2 4.42Å
235A93.8Very high94.5Very high35 Ų3571 Ų7129%0.28939%0.386SS..Hα-helixtrans-62-44.3177.100000111.8T231 L232 R233 S238 S239 L289T231-A235 WeakPolarHBondContact O-CB 3.22Å; T231-A235 PolarHBondContact O-N 3.3Å; L232-A235 PolarHBondContact O-N 3.46Å; R233-A235 PolarHBondContact O-N 2.83Å; A235-S238 PolarHBondContact O-N 3.38Å; A235-S239 VanDerWaalsContact O-CB 3.25Å; A235-S239 WeakPolarHBondContact O-CB 3.47Å; A235-S239 PolarHBondContact O-N 2.99Å; A235-S239 PolarHBondContact O-OG 2.83Å; A235-L289 HydrophobicContact CB-CD2 3.71Å
236L93.8Very high93.9Very high46 Ų4669.3 Ų69.324%0.24138%0.381CS..Hα-helixtrans-65.7-48177.1-71172.8000111.8L232 R233 S238 S239 F240 I257 M261 L289L232-L236 WeakPolarHBondContact O-CB 3.39Å; L232-L236 VanDerWaalsContact O-CG 3.26Å; L232-L236 WeakPolarHBondContact O-CG 3.44Å; L232-L236 PolarHBondContact O-N 3.1Å; R233-L236 PolarHBondContact O-N 3.41Å; L236-S238 VanDerWaalsContact C-N 3.3Å; L236-S238 PolarHBondContact O-N 2.87Å; L236-S239 PolarHBondContact O-N 3.23Å; L236-F240 HydrophobicContact CD2-CD2 4.26Å; L236-F240 HydrophobicContact CD2-CE2 3.89Å; L236-F240 WeakPolarHBondContact O-CB 3.47Å; L236-F240 WeakPolarHBondContact O-CD2 3.42Å; L236-F240 PolarHBondContact O-N 2.9Å; L236-I257 HydrophobicContact CB-CD1 3.86Å; L236-I257 HydrophobicContact CB-CG1 3.89Å; L236-M261 HydrophobicContact CD2-CE 4.19Å; L236-L289 HydrophobicContact CD2-CD1 3.83Å; L236-L289 HydrophobicContact CD2-CD2 4.35Å
237T95.5Very high93.3Very high23 Ų2367.8 Ų67.814%0.14140%0.4CS..Hα-helixtrans-57-44.3176.7-61.90000111.2R233 Q234 S241 T253R233-T237 WeakPolarHBondContact O-CB 3.43Å; R233-T237 PolarHBondContact O-N 3.32Å; R233-T237 PolarHBondContact O-OG1 2.78Å; Q234-T237 PolarHBondContact O-N 3.35Å; T237-S241 WeakPolarHBondContact O-CB 3.42Å; T237-S241 PolarHBondContact O-N 2.9Å; T237-S241 VanDerWaalsContact O-N 3.11Å; T237-T253 PolarHBondContact OG1-O 3.1Å
238S93.9Very high92.7Very high83 Ų8365.4 Ų65.458%0.5840%0.397SS*.Hα-helixtrans-64-49177.3-177.30000111.7Q234 A235 L236 F240 S241Q234-S238 WeakPolarHBondContact O-CB 3.09Å; Q234-S238 PolarHBondContact O-N 3.08Å; A235-S238 PolarHBondContact O-N 3.38Å; L236-S238 VanDerWaalsContact C-N 3.3Å; L236-S238 PolarHBondContact O-N 2.87Å; S238-F240 PolarHBondContact O-N 2.99Å; S238-S241 WeakPolarHBondContact O-CB 3.44Å; S238-S241 PolarHBondContact O-N 2.95Å; S238-S241 PolarHBondContact O-OG 3.23Å
239S93.6Very high92.3Very high38 Ų3861.8 Ų61.827%0.26639%0.394SS..Hα-helixtrans-67.6-35.6-174.5-57.70000112.9A235 L236 V285A235-S239 VanDerWaalsContact O-CB 3.25Å; A235-S239 WeakPolarHBondContact O-CB 3.47Å; A235-S239 PolarHBondContact O-N 2.99Å; A235-S239 PolarHBondContact O-OG 2.83Å; L236-S239 PolarHBondContact O-N 3.23Å; S239-V285 WeakPolarHBondContact O-CG1 3.39Å
240F94Very high92.1Very high1 Ų160.9 Ų60.90%0.00439%0.387CS..Hα-helixtrans-95.42.7-179.6-74.1-95.3000114L236 S238 T242 V243 P252 Y260 M261 L264 V282 V285 V286 L289L236-F240 HydrophobicContact CD2-CD2 4.26Å; L236-F240 HydrophobicContact CD2-CE2 3.89Å; L236-F240 WeakPolarHBondContact O-CB 3.47Å; L236-F240 WeakPolarHBondContact O-CD2 3.42Å; L236-F240 PolarHBondContact O-N 2.9Å; S238-F240 PolarHBondContact O-N 2.99Å; F240-T242 PolarHBondContact O-N 3.02Å; F240-V243 HydrophobicContact CD1-CB 4.33Å; F240-V243 HydrophobicContact CD1-CG2 4.39Å; F240-V243 PolarHBondContact O-N 3.26Å; F240-P252 HydrophobicContact CB-CG 3.61Å; F240-P252 VanDerWaalsContact O-CD 3.28Å; F240-P252 WeakPolarHBondContact O-CD 3.16Å; F240-P252 WeakPolarHBondContact O-CG 3.25Å; F240-Y260 HydrophobicContact CB-CE1 4.04Å; F240-Y260 HydrophobicContact CD1-CE1 4.08Å; F240-Y260 HydrophobicContact CG-CE1 4.27Å; F240-M261 HydrophobicContact CD2-SD 4.37Å; F240-M261 HydrophobicContact CE1-SD 4.5Å; F240-M261 HydrophobicContact CE2-CE 4.19Å; F240-M261 HydrophobicContact CE2-SD 4.3Å; F240-M261 HydrophobicContact CZ-CE 4.16Å; F240-M261 HydrophobicContact CZ-SD 4.37Å; F240-L264 HydrophobicContact CD1-CD2 4.01Å; F240-L264 HydrophobicContact CE1-CD2 3.71Å; F240-V282 HydrophobicContact CE1-CG1 4.11Å; F240-V282 HydrophobicContact CE1-CG2 4.13Å; F240-V282 HydrophobicContact CZ-CG1 4.25Å; F240-V285 HydrophobicContact CD1-CG1 4.37Å; F240-V285 HydrophobicContact CD2-CG1 3.85Å; F240-V285 HydrophobicContact CE1-CG1 4.2Å; F240-V285 HydrophobicContact CE2-CG1 3.66Å; F240-V285 HydrophobicContact CG-CG1 4.21Å; F240-V285 HydrophobicContact CZ-CB 4.43Å; F240-V285 HydrophobicContact CZ-CG1 3.85Å; F240-V286 HydrophobicContact CZ-CG2 4.02Å; F240-L289 HydrophobicContact CE2-CD1 3.94Å
241S93.2Very high91.9Very high60 Ų6059.6 Ų59.642%0.4239%0.385SS..THydrogen-bonded Turntrans-55.6-25.6-179.1600000114.4T237 S238 T251T237-S241 WeakPolarHBondContact O-CB 3.42Å; T237-S241 PolarHBondContact O-N 2.9Å; T237-S241 VanDerWaalsContact O-N 3.11Å; S238-S241 WeakPolarHBondContact O-CB 3.44Å; S238-S241 PolarHBondContact O-N 2.95Å; S238-S241 PolarHBondContact O-OG 3.23Å; S241-T251 WeakPolarHBondContact O-CG2 3.44Å
242T91.4Very high91.9Very high114 Ų11455.8 Ų55.870%0.69936%0.362SS*.THydrogen-bonded Turntrans-98.52.2-179.559.40000113.8F240 P244F240-T242 PolarHBondContact O-N 3.02Å; T242-P244 WeakPolarHBondContact O-CD 3.46Å
243V91.7Very high91.9Very high7 Ų753.6 Ų53.64%0.04235%0.354CS..  trans-108.894.4-176.7-174.50000109.5F240 Y260 L278 T281 V285F240-V243 HydrophobicContact CD1-CB 4.33Å; F240-V243 HydrophobicContact CD1-CG2 4.39Å; F240-V243 PolarHBondContact O-N 3.26Å; V243-Y260 PolarHBondContact O-OH 3.42Å; V243-L278 HydrophobicContact CG1-CD1 3.68Å; V243-T281 HydrophobicContact CG2-CG2 4.07Å; V243-V285 HydrophobicContact CG2-CG2 4.32Å
244P91.9Very high91.8Very high67 Ų6754.7 Ų54.744%0.43536%0.36SS..PPolyproline II helixtrans-73.6144.4176.829.1-33.8000111.5T242 T251T242-P244 WeakPolarHBondContact O-CD 3.46Å; P244-T251 HydrophobicContact CB-CG2 4.23Å
245L90.3Very high91.8Very high7 Ų755 Ų554%0.03737%0.366CS..PPolyproline II helixtrans-66.6135.4173.6-83.3169.8000111.6G247 S248 G249 E250 Y260 K263 L264L245-G247 PolarHBondContact O-N 3.22Å; L245-S248 WeakPolarHBondContact CB-OG 3.48Å; L245-S248 PolarHBondContact O-N 3.42Å; L245-G249 WeakPolarHBondContact O-CA 3.41Å; L245-G249 PolarHBondContact O-N 3.22Å; L245-E250 HydrophobicContact CD1-CB 4.41Å; L245-E250 PolarHBondContact N-O 2.93Å; L245-Y260 HydrophobicContact CD1-CD2 3.61Å; L245-Y260 HydrophobicContact CD1-CE2 3.99Å; L245-Y260 HydrophobicContact CD1-CG 4.43Å; L245-Y260 HydrophobicContact CD2-CD2 4.5Å; L245-Y260 HydrophobicContact CD2-CE2 4.24Å; L245-Y260 HydrophobicContact CG-CD2 3.75Å; L245-Y260 HydrophobicContact CG-CE2 3.56Å; L245-K263 HydrophobicContact CD1-CB 3.9Å; L245-K263 HydrophobicContact CD1-CD 3.87Å; L245-K263 HydrophobicContact CD2-CB 4.3Å; L245-L264 HydrophobicContact CD2-CB 3.84Å; L245-L264 HydrophobicContact CD2-CD1 4.04Å
246P86.2Confident91.9Very high52 Ų5255.4 Ų55.434%0.33836%0.364SS..THydrogen-bonded Turntrans-58134.6173-25.435.3000112S248 V267 L278P246-S248 VanDerWaalsContact C-N 3.26Å; P246-S248 PolarHBondContact O-N 3.1Å; P246-S248 VanDerWaalsContact O-N 3.14Å; P246-V267 HydrophobicContact CB-CG1 4.28Å; P246-V267 HydrophobicContact CG-CG1 3.93Å; P246-L278 HydrophobicContact CG-CD2 3.54Å
247G84.7Confident92Very high96 Ų9653.3 Ų53.399%0.9935%0.353SS*.THydrogen-bonded Turntrans83.6-41.7179.400000115L245L245-G247 PolarHBondContact O-N 3.22Å
248S85.4Confident92Very high76 Ų7656.7 Ų56.753%0.53137%0.371SS..THydrogen-bonded Turntrans-95.4-26.1179.768.60000114.4L245 P246 E250L245-S248 WeakPolarHBondContact CB-OG 3.48Å; L245-S248 PolarHBondContact O-N 3.42Å; P246-S248 VanDerWaalsContact C-N 3.26Å; P246-S248 PolarHBondContact O-N 3.1Å; P246-S248 VanDerWaalsContact O-N 3.14Å; S248-E250 PolarHBondContact O-N 3.29Å; S248-E250 WeakPolarHBondContact OG-CB 3.47Å; S248-E250 PolarHBondContact OG-N 3.31Å
249G86.7Confident92.1Very high49 Ų4955.7 Ų55.751%0.50536%0.363SS..  trans69.45.5-174.100000114.4L245L245-G249 WeakPolarHBondContact O-CA 3.41Å; L245-G249 PolarHBondContact O-N 3.22Å
250E91.8Very high92.2Very high64 Ų6453.9 Ų53.930%0.29935%0.351SS..PPolyproline II helixtrans-69.9131.4-176.5-173-177.4-176.700110.3L245 S248 K263L245-E250 HydrophobicContact CD1-CB 4.41Å; L245-E250 PolarHBondContact N-O 2.93Å; S248-E250 PolarHBondContact O-N 3.29Å; S248-E250 WeakPolarHBondContact OG-CB 3.47Å; S248-E250 PolarHBondContact OG-N 3.31Å; E250-K263 IonicContact OE1-NZ 3.71Å; E250-K263 IonicContact OE2-NZ 3.64Å; E250-K263 PolarHBondContact OE2-NZ 3.02Å
251T92.5Very high92.3Very high64 Ų6456.6 Ų56.639%0.39336%0.364SS..PPolyproline II helixtrans-103.7151.6171.252.60000110.1S241 P244S241-T251 WeakPolarHBondContact O-CG2 3.44Å; P244-T251 HydrophobicContact CB-CG2 4.23Å
252P95Very high92.4Very high8 Ų861.2 Ų61.25%0.05238%0.377CS..PPolyproline II helixtrans-70.7138.1-176.423.4-24.6000111.3F240 I257 Y260F240-P252 HydrophobicContact CB-CG 3.61Å; F240-P252 VanDerWaalsContact O-CD 3.28Å; F240-P252 WeakPolarHBondContact O-CD 3.16Å; F240-P252 WeakPolarHBondContact O-CG 3.25Å; P252-I257 HydrophobicContact CB-CD1 3.56Å; P252-I257 HydrophobicContact CG-CD1 4.24Å; P252-Y260 HydrophobicContact CB-CD1 3.71Å; P252-Y260 HydrophobicContact CB-CD2 3.99Å; P252-Y260 HydrophobicContact CB-CE1 4.17Å; P252-Y260 HydrophobicContact CB-CE2 4.38Å; P252-Y260 HydrophobicContact CB-CG 3.64Å; P252-Y260 VanDerWaalsContact CD-CE2 3.5Å; P252-Y260 HydrophobicContact CG-CD1 3.94Å; P252-Y260 HydrophobicContact CG-CD2 4.22Å; P252-Y260 HydrophobicContact CG-CE1 3.85Å; P252-Y260 HydrophobicContact CG-CE2 4.09Å; P252-Y260 HydrophobicContact CG-CG 4.15Å
253T94.1Very high92.5Very high68 Ų6859.8 Ų59.842%0.41736%0.361SS..  trans-109.1174163.371.80000109.5T237 D255 T256 I257T237-T253 PolarHBondContact OG1-O 3.1Å; T253-D255 VanDerWaalsContact C-N 3.28Å; T253-D255 PolarHBondContact O-N 3.45Å; T253-T256 PolarHBondContact N-OG1 3.47Å; T253-T256 PolarHBondContact O-N 3.17Å; T253-T256 WeakPolarHBondContact OG1-CG2 3.31Å; T253-T256 PolarHBondContact OG1-N 2.93Å; T253-T256 PolarHBondContact OG1-OG1 2.99Å; T253-I257 WeakPolarHBondContact O-CB 3.47Å; T253-I257 PolarHBondContact O-N 3.33Å
254F93.7Very high92.6Very high64 Ų6459.7 Ų59.728%0.28136%0.36SS..THydrogen-bonded Turntrans-58.4-41.7179.8-173.1-92.4000112.5E230 R233 Q234 I257E230-F254 HydrophobicContact CG-CZ 4.31Å; E230-F254 WeakPolarHBondContact OE1-CE1 3.25Å; E230-F254 WeakPolarHBondContact OE1-CE2 3.37Å; E230-F254 WeakPolarHBondContact OE1-CZ 3.41Å; E230-F254 WeakPolarHBondContact OE2-CZ 2.93Å; R233-F254 HydrophobicContact CB-CD2 4.43Å; R233-F254 HydrophobicContact CB-CE2 3.65Å; R233-F254 HydrophobicContact CB-CZ 3.98Å; R233-F254 PolarHBondContact NE-O 3.44Å; Q234-F254 HydrophobicContact CB-CE2 4.42Å; F254-I257 WeakPolarHBondContact O-CG2 3.37Å
255D94.9Very high92.7Very high134 Ų13462.1 Ų62.172%0.71737%0.365SS*.THydrogen-bonded Turntrans-78-30.4-179.5-58-49.7000112.6T253T253-D255 VanDerWaalsContact C-N 3.28Å; T253-D255 PolarHBondContact O-N 3.45Å
256T95.9Very high92.9Very high43 Ų4365.3 Ų65.326%0.26439%0.385SS..THydrogen-bonded Turntrans-95.4-5.8-174.466.60000114.2T253 D258 S259 Y260T253-T256 PolarHBondContact N-OG1 3.47Å; T253-T256 PolarHBondContact O-N 3.17Å; T253-T256 WeakPolarHBondContact OG1-CG2 3.31Å; T253-T256 PolarHBondContact OG1-N 2.93Å; T253-T256 PolarHBondContact OG1-OG1 2.99Å; T256-D258 VanDerWaalsContact C-N 3.33Å; T256-D258 PolarHBondContact O-N 3.12Å; T256-S259 PolarHBondContact O-N 3.07Å; T256-Y260 WeakPolarHBondContact O-CB 3.46Å; T256-Y260 PolarHBondContact O-N 3.28Å
257I96Very high93.1Very high1 Ų164.7 Ų64.71%0.00538%0.38CS..Hα-helixtrans-53.2-43.1-171-172.260.2000113.8R233 L236 P252 T253 F254 S259 Y260 M261R233-I257 HydrophobicContact CB-CG2 4.01Å; R233-I257 HydrophobicContact CG-CG2 3.81Å; L236-I257 HydrophobicContact CB-CD1 3.86Å; L236-I257 HydrophobicContact CB-CG1 3.89Å; P252-I257 HydrophobicContact CB-CD1 3.56Å; P252-I257 HydrophobicContact CG-CD1 4.24Å; T253-I257 WeakPolarHBondContact O-CB 3.47Å; T253-I257 PolarHBondContact O-N 3.33Å; F254-I257 WeakPolarHBondContact O-CG2 3.37Å; I257-S259 PolarHBondContact O-N 3.26Å; I257-Y260 HydrophobicContact CD1-CD1 4.26Å; I257-Y260 PolarHBondContact O-N 3.35Å; I257-M261 HydrophobicContact CD1-CG 3.93Å; I257-M261 HydrophobicContact CD1-SD 4.37Å; I257-M261 HydrophobicContact CG1-CG 4.2Å; I257-M261 WeakPolarHBondContact O-CB 3.48Å; I257-M261 VanDerWaalsContact O-CG 3.24Å; I257-M261 WeakPolarHBondContact O-CG 3.44Å; I257-M261 PolarHBondContact O-N 2.98Å
258D95.5Very high93.4Very high95 Ų9561.8 Ų61.851%0.50834%0.342SS..Hα-helixtrans-64.1-43.2179.7-61.4-27.3000112.1R233 T256 K262R233-D258 IonicContact CZ-OD1 3.41Å; R233-D258 IonicContact CZ-OD2 3.25Å; R233-D258 IonicContact NH1-OD1 2.76Å; R233-D258 PolarHBondContact NH1-OD1 3.21Å; R233-D258 IonicContact NH1-OD2 3.53Å; R233-D258 PolarHBondContact NH1-OD2 3.08Å; R233-D258 VanDerWaalsContact NH2-CG 3.28Å; R233-D258 IonicContact NH2-OD1 3.1Å; R233-D258 IonicContact NH2-OD2 2.68Å; R233-D258 PolarHBondContact NH2-OD2 3.4Å; T256-D258 VanDerWaalsContact C-N 3.33Å; T256-D258 PolarHBondContact O-N 3.12Å; D258-K262 WeakPolarHBondContact O-CB 3.34Å; D258-K262 PolarHBondContact O-N 2.93Å
259S96.2Very high93.7Very high61 Ų6163 Ų6343%0.42734%0.341SS..Hα-helixtrans-67.9-43.1178.8-174.70000110.5T256 I257 K262 K263T256-S259 PolarHBondContact O-N 3.07Å; I257-S259 PolarHBondContact O-N 3.26Å; S259-K262 PolarHBondContact O-N 2.87Å; S259-K263 WeakPolarHBondContact O-CB 3.29Å; S259-K263 VanDerWaalsContact O-CG 3.27Å; S259-K263 WeakPolarHBondContact O-CG 3.47Å; S259-K263 PolarHBondContact O-N 2.86Å
260Y96.2Very high93.9Very high0 Ų064.9 Ų64.90%035%0.346CS..Hα-helixtrans-57.9-51.1174170.5-85.6000111.2F240 V243 L245 P252 T256 I257 K262 K263 L264F240-Y260 HydrophobicContact CB-CE1 4.04Å; F240-Y260 HydrophobicContact CD1-CE1 4.08Å; F240-Y260 HydrophobicContact CG-CE1 4.27Å; V243-Y260 PolarHBondContact O-OH 3.42Å; L245-Y260 HydrophobicContact CD1-CD2 3.61Å; L245-Y260 HydrophobicContact CD1-CE2 3.99Å; L245-Y260 HydrophobicContact CD1-CG 4.43Å; L245-Y260 HydrophobicContact CD2-CD2 4.5Å; L245-Y260 HydrophobicContact CD2-CE2 4.24Å; L245-Y260 HydrophobicContact CG-CD2 3.75Å; L245-Y260 HydrophobicContact CG-CE2 3.56Å; P252-Y260 HydrophobicContact CB-CD1 3.71Å; P252-Y260 HydrophobicContact CB-CD2 3.99Å; P252-Y260 HydrophobicContact CB-CE1 4.17Å; P252-Y260 HydrophobicContact CB-CE2 4.38Å; P252-Y260 HydrophobicContact CB-CG 3.64Å; P252-Y260 VanDerWaalsContact CD-CE2 3.5Å; P252-Y260 HydrophobicContact CG-CD1 3.94Å; P252-Y260 HydrophobicContact CG-CD2 4.22Å; P252-Y260 HydrophobicContact CG-CE1 3.85Å; P252-Y260 HydrophobicContact CG-CE2 4.09Å; P252-Y260 HydrophobicContact CG-CG 4.15Å; T256-Y260 WeakPolarHBondContact O-CB 3.46Å; T256-Y260 PolarHBondContact O-N 3.28Å; I257-Y260 HydrophobicContact CD1-CD1 4.26Å; I257-Y260 PolarHBondContact O-N 3.35Å; Y260-K262 VanDerWaalsContact C-N 3.31Å; Y260-K262 PolarHBondContact O-N 3.23Å; Y260-K263 PolarHBondContact O-N 3.32Å; Y260-L264 HydrophobicContact CE1-CB 4.4Å; Y260-L264 HydrophobicContact CE1-CD2 3.89Å; Y260-L264 WeakPolarHBondContact O-CB 3.27Å; Y260-L264 PolarHBondContact O-N 3.48Å
261M94.9Very high93.7Very high59 Ų5963.7 Ų63.729%0.29135%0.345SS..Hα-helixtrans-62.9-38.7-179-70.5-60.7-77.100111.7L236 F240 I257 L264 H265L236-M261 HydrophobicContact CD2-CE 4.19Å; F240-M261 HydrophobicContact CD2-SD 4.37Å; F240-M261 HydrophobicContact CE1-SD 4.5Å; F240-M261 HydrophobicContact CE2-CE 4.19Å; F240-M261 HydrophobicContact CE2-SD 4.3Å; F240-M261 HydrophobicContact CZ-CE 4.16Å; F240-M261 HydrophobicContact CZ-SD 4.37Å; I257-M261 HydrophobicContact CD1-CG 3.93Å; I257-M261 HydrophobicContact CD1-SD 4.37Å; I257-M261 HydrophobicContact CG1-CG 4.2Å; I257-M261 WeakPolarHBondContact O-CB 3.48Å; I257-M261 VanDerWaalsContact O-CG 3.24Å; I257-M261 WeakPolarHBondContact O-CG 3.44Å; I257-M261 PolarHBondContact O-N 2.98Å; M261-L264 PolarHBondContact O-N 2.93Å; M261-L264 HydrophobicContact SD-CD2 4.34Å; M261-H265 VanDerWaalsContact O-CB 3.28Å; M261-H265 WeakPolarHBondContact O-CB 3.31Å; M261-H265 PolarHBondContact O-N 3.42Å
262K95.1Very high93.4Very high156 Ų15663.8 Ų63.868%0.67835%0.347SS*.Hα-helixtrans-64.6-43.9174.8-172.6176.7-178.9179.10112D258 S259 Y260 T266D258-K262 WeakPolarHBondContact O-CB 3.34Å; D258-K262 PolarHBondContact O-N 2.93Å; S259-K262 PolarHBondContact O-N 2.87Å; Y260-K262 VanDerWaalsContact C-N 3.31Å; Y260-K262 PolarHBondContact O-N 3.23Å; K262-T266 WeakPolarHBondContact O-CB 3.45Å; K262-T266 PolarHBondContact O-N 3.1Å; K262-T266 PolarHBondContact O-OG1 2.89Å
263K94.6Very high93Very high84 Ų8472.1 Ų72.137%0.36539%0.385SS..Hα-helixtrans-63.7-46.9175.7-72.6169.3180174.30111L245 E250 S259 Y260 H265 T266 V267L245-K263 HydrophobicContact CD1-CB 3.9Å; L245-K263 HydrophobicContact CD1-CD 3.87Å; L245-K263 HydrophobicContact CD2-CB 4.3Å; E250-K263 IonicContact OE1-NZ 3.71Å; E250-K263 IonicContact OE2-NZ 3.64Å; E250-K263 PolarHBondContact OE2-NZ 3.02Å; S259-K263 WeakPolarHBondContact O-CB 3.29Å; S259-K263 VanDerWaalsContact O-CG 3.27Å; S259-K263 WeakPolarHBondContact O-CG 3.47Å; S259-K263 PolarHBondContact O-N 2.86Å; Y260-K263 PolarHBondContact O-N 3.32Å; K263-H265 VanDerWaalsContact C-N 3.35Å; K263-H265 PolarHBondContact O-N 3.34Å; K263-T266 WeakPolarHBondContact O-CB 3.38Å; K263-T266 PolarHBondContact O-N 3.42Å; K263-T266 VanDerWaalsContact O-N 3.15Å; K263-V267 WeakPolarHBondContact O-CG2 3.49Å; K263-V267 PolarHBondContact O-N 2.93Å
264L93.3Very high92.6Very high5 Ų576 Ų763%0.02640%0.399CS..Hα-helixtrans-56.9-48.8177.8-179.864.1000111F240 L245 Y260 M261 T266 V267 I268 L278 V282F240-L264 HydrophobicContact CD1-CD2 4.01Å; F240-L264 HydrophobicContact CE1-CD2 3.71Å; L245-L264 HydrophobicContact CD2-CB 3.84Å; L245-L264 HydrophobicContact CD2-CD1 4.04Å; Y260-L264 HydrophobicContact CE1-CB 4.4Å; Y260-L264 HydrophobicContact CE1-CD2 3.89Å; Y260-L264 WeakPolarHBondContact O-CB 3.27Å; Y260-L264 PolarHBondContact O-N 3.48Å; M261-L264 PolarHBondContact O-N 2.93Å; M261-L264 HydrophobicContact SD-CD2 4.34Å; L264-T266 VanDerWaalsContact C-N 3.34Å; L264-T266 PolarHBondContact O-N 3.05Å; L264-V267 PolarHBondContact O-N 3.27Å; L264-I268 HydrophobicContact CD1-CD1 4.03Å; L264-I268 HydrophobicContact CG-CD1 3.96Å; L264-I268 VanDerWaalsContact O-CG1 3.3Å; L264-I268 WeakPolarHBondContact O-CG1 3.42Å; L264-I268 PolarHBondContact O-N 2.78Å; L264-L278 HydrophobicContact CD1-CD1 4.36Å; L264-L278 HydrophobicContact CD1-CD2 4.04Å; L264-L278 HydrophobicContact CD1-CG 4.43Å; L264-V282 HydrophobicContact CD1-CG2 4.36Å; L264-V282 HydrophobicContact CD2-CG2 4.08Å
265H93.3Very high92.3Very high119 Ų11974.8 Ų74.855%0.55139%0.394SS*.Hα-helixtrans-60.3-43.3176179.1-96.8000112.2M261 K263 I268 I269M261-H265 VanDerWaalsContact O-CB 3.28Å; M261-H265 WeakPolarHBondContact O-CB 3.31Å; M261-H265 PolarHBondContact O-N 3.42Å; K263-H265 VanDerWaalsContact C-N 3.35Å; K263-H265 PolarHBondContact O-N 3.34Å; H265-I268 PolarHBondContact O-N 3.34Å; H265-I269 WeakPolarHBondContact CE1-CD1 3.44Å; H265-I269 WeakPolarHBondContact NE2-CD1 3.41Å; H265-I269 WeakPolarHBondContact O-CG1 3.25Å; H265-I269 PolarHBondContact O-N 2.81Å
266T94Very high92Very high74 Ų7474.8 Ų74.845%0.45439%0.39SS..Hα-helixtrans-61.6-47.6177.2-54.20000111.2K262 K263 L264 I268 I269 S270K262-T266 WeakPolarHBondContact O-CB 3.45Å; K262-T266 PolarHBondContact O-N 3.1Å; K262-T266 PolarHBondContact O-OG1 2.89Å; K263-T266 WeakPolarHBondContact O-CB 3.38Å; K263-T266 PolarHBondContact O-N 3.42Å; K263-T266 VanDerWaalsContact O-N 3.15Å; L264-T266 VanDerWaalsContact C-N 3.34Å; L264-T266 PolarHBondContact O-N 3.05Å; T266-I268 PolarHBondContact O-N 3.02Å; T266-I269 PolarHBondContact O-N 3.07Å; T266-S270 WeakPolarHBondContact O-CB 3.44Å; T266-S270 PolarHBondContact O-N 3.2Å; T266-S270 PolarHBondContact O-OG 3.47Å
267V91.1Very high91.6Very high39 Ų3977.1 Ų77.124%0.23641%0.408CS..Hα-helixtrans-59.2-46.7178.9169.80000111.3P246 K263 L264 I269 S270 S271 H275P246-V267 HydrophobicContact CB-CG1 4.28Å; P246-V267 HydrophobicContact CG-CG1 3.93Å; K263-V267 WeakPolarHBondContact O-CG2 3.49Å; K263-V267 PolarHBondContact O-N 2.93Å; L264-V267 PolarHBondContact O-N 3.27Å; V267-I269 VanDerWaalsContact C-N 3.33Å; V267-I269 PolarHBondContact O-N 3.26Å; V267-S270 PolarHBondContact O-N 3.11Å; V267-S271 PolarHBondContact O-N 3.28Å; V267-H275 WeakPolarHBondContact CG1-NE2 3.23Å; V267-H275 PolarHBondContact O-CD2 3.02Å
268I90.5Very high91.3Very high34 Ų3478 Ų7817%0.17441%0.412CS..Hα-helixtrans-60.9-41178.6-71.9169.1000111.7L264 H265 T266 P272 L278 I279 V282L264-I268 HydrophobicContact CD1-CD1 4.03Å; L264-I268 HydrophobicContact CG-CD1 3.96Å; L264-I268 VanDerWaalsContact O-CG1 3.3Å; L264-I268 WeakPolarHBondContact O-CG1 3.42Å; L264-I268 PolarHBondContact O-N 2.78Å; H265-I268 PolarHBondContact O-N 3.34Å; T266-I268 PolarHBondContact O-N 3.02Å; I268-P272 WeakPolarHBondContact O-CA 3.49Å; I268-P272 WeakPolarHBondContact O-CG 3.48Å; I268-L278 HydrophobicContact CG1-CD2 4.38Å; I268-I279 HydrophobicContact CG1-CG1 4.22Å; I268-I279 HydrophobicContact CG2-CD1 3.96Å; I268-I279 HydrophobicContact CG2-CG1 3.75Å; I268-V282 HydrophobicContact CD1-CG2 4.17Å
269I92.1Very high91.1Very high102 Ų10275.4 Ų75.452%0.52340%0.398SS..Hα-helixtrans-75.7-36.9-179-70.7-177.8000112.3H265 T266 V267 P272H265-I269 WeakPolarHBondContact CE1-CD1 3.44Å; H265-I269 WeakPolarHBondContact NE2-CD1 3.41Å; H265-I269 WeakPolarHBondContact O-CG1 3.25Å; H265-I269 PolarHBondContact O-N 2.81Å; T266-I269 PolarHBondContact O-N 3.07Å; V267-I269 VanDerWaalsContact C-N 3.33Å; V267-I269 PolarHBondContact O-N 3.26Å; I269-P272 WeakPolarHBondContact O-CD 3.46Å
270S91.3Very high90.8Very high88 Ų8876.2 Ų76.262%0.61540%0.398SS*.Hα-helixtrans-68-38.4-176.6-66.80000112.9T266 V267T266-S270 WeakPolarHBondContact O-CB 3.44Å; T266-S270 PolarHBondContact O-N 3.2Å; T266-S270 PolarHBondContact O-OG 3.47Å; V267-S270 PolarHBondContact O-N 3.11Å
271S88.1Confident90.6Very high39 Ų3979.4 Ų79.427%0.27342%0.417SS..  trans-138.271.6179.6-64.50000112.2V267 Q273 E274 H275V267-S271 PolarHBondContact O-N 3.28Å; S271-Q273 VanDerWaalsContact C-N 3.31Å; S271-Q273 PolarHBondContact O-N 3.46Å; S271-E274 WeakPolarHBondContact CB-OE2 3.4Å; S271-E274 PolarHBondContact O-N 3.45Å; S271-E274 PolarHBondContact OG-OE2 2.94Å; S271-H275 PolarHBondContact O-CD2 3.28Å; S271-H275 VanDerWaalsContact O-CD2 3.28Å; S271-H275 PolarHBondContact O-N 3.04Å
272P85.3Confident90.4Very high66 Ų6677.7 Ų77.743%0.42941%0.41SS..THydrogen-bonded Turntrans-64.4-35.4-172.7-1930.3000113.4I268 I269 E274 H275 E276 I279I268-P272 WeakPolarHBondContact O-CA 3.49Å; I268-P272 WeakPolarHBondContact O-CG 3.48Å; I269-P272 WeakPolarHBondContact O-CD 3.46Å; P272-E274 VanDerWaalsContact C-N 3.34Å; P272-H275 PolarHBondContact O-N 3.32Å; P272-E276 PolarHBondContact O-N 3.22Å; P272-I279 HydrophobicContact CB-CD1 4.46Å; P272-I279 WeakPolarHBondContact O-CD1 3.4Å
273Q86.3Confident90.2Very high184 Ų18478 Ų7886%0.8641%0.407SS*.THydrogen-bonded Turntrans-76.3-24.1-175.9-48.4-155.919.700112.2S271S271-Q273 VanDerWaalsContact C-N 3.31Å; S271-Q273 PolarHBondContact O-N 3.46Å
274E86.6Confident90Very high149 Ų14977.3 Ų77.370%0.69641%0.407SS*.THydrogen-bonded Turntrans-84.8-15.5177.2-61.1179171.400112.2S271 P272S271-E274 WeakPolarHBondContact CB-OE2 3.4Å; S271-E274 PolarHBondContact O-N 3.45Å; S271-E274 PolarHBondContact OG-OE2 2.94Å; P272-E274 VanDerWaalsContact C-N 3.34Å
275H86.4Confident89.9Confident39 Ų3977.8 Ų77.818%0.18141%0.41CS..  trans-119.224.1-173.3-64-39.5000113.3V267 S271 P272 S277 L278 I279V267-H275 WeakPolarHBondContact CG1-NE2 3.23Å; V267-H275 PolarHBondContact O-CD2 3.02Å; S271-H275 PolarHBondContact O-CD2 3.28Å; S271-H275 VanDerWaalsContact O-CD2 3.28Å; S271-H275 PolarHBondContact O-N 3.04Å; P272-H275 PolarHBondContact O-N 3.32Å; H275-S277 VanDerWaalsContact C-N 3.31Å; H275-S277 PolarHBondContact O-N 3.12Å; H275-L278 HydrophobicContact CB-CB 4.29Å; H275-L278 HydrophobicContact CB-CD2 4.44Å; H275-L278 WeakPolarHBondContact O-CB 3.48Å; H275-L278 PolarHBondContact O-N 3.48Å; H275-L278 VanDerWaalsContact O-N 3.09Å; H275-I279 VanDerWaalsContact O-CG1 3.3Å; H275-I279 WeakPolarHBondContact O-CG1 3.47Å; H275-I279 PolarHBondContact O-N 2.9Å
276E89.3Confident89.8Confident134 Ų13475.1 Ų75.163%0.62640%0.402SS*.Hα-helixtrans-57.6-39.5-177.1-167175.9-169.800113.2P272 I279 N280P272-E276 PolarHBondContact O-N 3.22Å; E276-I279 PolarHBondContact O-N 3.02Å; E276-N280 PolarHBondContact O-N 3.44Å; E276-N280 PolarHBondContact O-ND2 2.86Å
277S87.3Confident89.5Confident92 Ų9274.5 Ų74.564%0.64340%0.401SS*.Hα-helixtrans-65.3-43.317558.50000112.5H275 N280 T281H275-S277 VanDerWaalsContact C-N 3.31Å; H275-S277 PolarHBondContact O-N 3.12Å; S277-N280 PolarHBondContact O-N 2.73Å; S277-T281 PolarHBondContact O-N 2.9Å; S277-T281 PolarHBondContact O-OG1 3.44Å; S277-T281 VanDerWaalsContact O-OG1 3.09Å
278L89.2Confident89.3Confident20 Ų2080.6 Ų80.611%0.10542%0.42CS..Hα-helixtrans-62.7-43.3175.417764.5000110.9V243 P246 L264 I268 H275 N280 T281 V282V243-L278 HydrophobicContact CG1-CD1 3.68Å; P246-L278 HydrophobicContact CG-CD2 3.54Å; L264-L278 HydrophobicContact CD1-CD1 4.36Å; L264-L278 HydrophobicContact CD1-CD2 4.04Å; L264-L278 HydrophobicContact CD1-CG 4.43Å; I268-L278 HydrophobicContact CG1-CD2 4.38Å; H275-L278 HydrophobicContact CB-CB 4.29Å; H275-L278 HydrophobicContact CB-CD2 4.44Å; H275-L278 WeakPolarHBondContact O-CB 3.48Å; H275-L278 PolarHBondContact O-N 3.48Å; H275-L278 VanDerWaalsContact O-N 3.09Å; L278-N280 VanDerWaalsContact C-N 3.3Å; L278-N280 PolarHBondContact O-N 3.21Å; L278-T281 PolarHBondContact O-N 3.14Å; L278-V282 HydrophobicContact CD1-CG2 4.2Å; L278-V282 HydrophobicContact CG-CG2 4.36Å; L278-V282 VanDerWaalsContact O-CG2 3.28Å; L278-V282 WeakPolarHBondContact O-CG2 3.26Å; L278-V282 PolarHBondContact O-N 2.68Å
279I91.3Very high88.9Confident39 Ų3981.2 Ų81.220%0.242%0.423CS..Hα-helixtrans-59.4-42.1177-68.5166.2000110.9I268 P272 H275 E276 V282 R283I268-I279 HydrophobicContact CG1-CG1 4.22Å; I268-I279 HydrophobicContact CG2-CD1 3.96Å; I268-I279 HydrophobicContact CG2-CG1 3.75Å; P272-I279 HydrophobicContact CB-CD1 4.46Å; P272-I279 WeakPolarHBondContact O-CD1 3.4Å; H275-I279 VanDerWaalsContact O-CG1 3.3Å; H275-I279 WeakPolarHBondContact O-CG1 3.47Å; H275-I279 PolarHBondContact O-N 2.9Å; E276-I279 PolarHBondContact O-N 3.02Å; I279-V282 PolarHBondContact O-N 3.11Å; I279-R283 WeakPolarHBondContact O-CB 3.48Å; I279-R283 PolarHBondContact O-N 3.29Å
280N91.6Very high87.6Confident79 Ų7983.4 Ų83.442%0.42244%0.436SS..Hα-helixtrans-65.3-41.9176.3-72.4-33.5000112.2E276 S277 L278 R283 D284E276-N280 PolarHBondContact O-N 3.44Å; E276-N280 PolarHBondContact O-ND2 2.86Å; S277-N280 PolarHBondContact O-N 2.73Å; L278-N280 VanDerWaalsContact C-N 3.3Å; L278-N280 PolarHBondContact O-N 3.21Å; N280-R283 PolarHBondContact O-N 3.24Å; N280-R283 PolarHBondContact OD1-NH1 2.85Å; N280-D284 PolarHBondContact O-N 3.04Å
281T90.6Very high85.8Confident67 Ų6792.6 Ų92.641%0.41146%0.457SS..Hα-helixtrans-62.2-46.3174.4-55.90000111.6V243 S277 L278 R283 D284 V285V243-T281 HydrophobicContact CG2-CG2 4.07Å; S277-T281 PolarHBondContact O-N 2.9Å; S277-T281 PolarHBondContact O-OG1 3.44Å; S277-T281 VanDerWaalsContact O-OG1 3.09Å; L278-T281 PolarHBondContact O-N 3.14Å; T281-R283 VanDerWaalsContact C-N 3.31Å; T281-R283 PolarHBondContact O-N 3.34Å; T281-D284 PolarHBondContact O-N 3.02Å; T281-V285 HydrophobicContact CG2-CG2 4.46Å; T281-V285 VanDerWaalsContact O-CG2 3.28Å; T281-V285 WeakPolarHBondContact O-CG2 3.33Å; T281-V285 PolarHBondContact O-N 3.2Å
282V91.6Very high85.7Confident23 Ų2395.3 Ų95.314%0.13947%0.466CS..Hα-helixtrans-60.7-42176.7171.90000110.7F240 L264 I268 L278 I279 V285 V286F240-V282 HydrophobicContact CE1-CG1 4.11Å; F240-V282 HydrophobicContact CE1-CG2 4.13Å; F240-V282 HydrophobicContact CZ-CG1 4.25Å; L264-V282 HydrophobicContact CD1-CG2 4.36Å; L264-V282 HydrophobicContact CD2-CG2 4.08Å; I268-V282 HydrophobicContact CD1-CG2 4.17Å; L278-V282 HydrophobicContact CD1-CG2 4.2Å; L278-V282 HydrophobicContact CG-CG2 4.36Å; L278-V282 VanDerWaalsContact O-CG2 3.28Å; L278-V282 WeakPolarHBondContact O-CG2 3.26Å; L278-V282 PolarHBondContact O-N 2.68Å; I279-V282 PolarHBondContact O-N 3.11Å; V282-V285 PolarHBondContact O-N 2.78Å; V282-V286 HydrophobicContact CG1-CG2 4.27Å; V282-V286 WeakPolarHBondContact O-CB 3.45Å; V282-V286 VanDerWaalsContact O-CG2 3.25Å; V282-V286 WeakPolarHBondContact O-CG2 3.34Å; V282-V286 PolarHBondContact O-N 3.28Å
283R91Very high85.7Confident161 Ų16196.8 Ų96.861%0.60847%0.468SS*.Hα-helixtrans-61.9-43.3176.7-172.8-176-73142.6-4.8112.1I279 N280 T281 S287I279-R283 WeakPolarHBondContact O-CB 3.48Å; I279-R283 PolarHBondContact O-N 3.29Å; N280-R283 PolarHBondContact O-N 3.24Å; N280-R283 PolarHBondContact OD1-NH1 2.85Å; T281-R283 VanDerWaalsContact C-N 3.31Å; T281-R283 PolarHBondContact O-N 3.34Å; R283-S287 WeakPolarHBondContact O-CB 3.31Å; R283-S287 PolarHBondContact O-N 2.66Å
284D91Very high85.7Confident71 Ų7192 Ų9238%0.3845%0.447SS..Hα-helixtrans-63.6-46.6175.917845.9000111.4N280 T281 V286 S287 R288N280-D284 PolarHBondContact O-N 3.04Å; T281-D284 PolarHBondContact O-N 3.02Å; D284-V286 PolarHBondContact O-N 2.65Å; D284-S287 PolarHBondContact O-N 3.25Å; D284-S287 PolarHBondContact O-OG 2.72Å; D284-R288 WeakPolarHBondContact O-CG 3.49Å; D284-R288 PolarHBondContact O-N 2.97Å; D284-R288 IonicContact OD1-CZ 3.67Å; D284-R288 IonicContact OD1-NE 3.96Å; D284-R288 PolarHBondContact OD1-NE 2.87Å; D284-R288 VanDerWaalsContact OD1-NE 3.14Å; D284-R288 IonicContact OD1-NH2 2.81Å; D284-R288 PolarHBondContact OD1-NH2 3.31Å; D284-R288 IonicContact OD2-CZ 3.24Å; D284-R288 VanDerWaalsContact OD2-CZ 3.25Å; D284-R288 IonicContact OD2-NE 3.61Å; D284-R288 PolarHBondContact OD2-NE 3.06Å; D284-R288 IonicContact OD2-NH2 3.14Å; D284-R288 PolarHBondContact OD2-NH2 3.1Å
285V90.9Very high85.6Confident15 Ų1588.6 Ų88.69%0.09143%0.432CS..Hα-helixtrans-59-47176.8173.80000111.5S239 F240 V243 T281 V282 S287 R288 L289S239-V285 WeakPolarHBondContact O-CG1 3.39Å; F240-V285 HydrophobicContact CD1-CG1 4.37Å; F240-V285 HydrophobicContact CD2-CG1 3.85Å; F240-V285 HydrophobicContact CE1-CG1 4.2Å; F240-V285 HydrophobicContact CE2-CG1 3.66Å; F240-V285 HydrophobicContact CG-CG1 4.21Å; F240-V285 HydrophobicContact CZ-CB 4.43Å; F240-V285 HydrophobicContact CZ-CG1 3.85Å; V243-V285 HydrophobicContact CG2-CG2 4.32Å; T281-V285 HydrophobicContact CG2-CG2 4.46Å; T281-V285 VanDerWaalsContact O-CG2 3.28Å; T281-V285 WeakPolarHBondContact O-CG2 3.33Å; T281-V285 PolarHBondContact O-N 3.2Å; V282-V285 PolarHBondContact O-N 2.78Å; V285-S287 VanDerWaalsContact C-N 3.35Å; V285-S287 PolarHBondContact O-N 3.1Å; V285-R288 PolarHBondContact O-N 3.12Å; V285-L289 HydrophobicContact CG1-CD1 4.3Å; V285-L289 PolarHBondContact O-N 3.16Å
286V89.6Confident85.5Confident62 Ų6291.8 Ų91.838%0.37645%0.448SS..Hα-helixtrans-64.5-38.4177.8172.40000111.6F240 V282 D284 R288 L289 D290F240-V286 HydrophobicContact CZ-CG2 4.02Å; V282-V286 HydrophobicContact CG1-CG2 4.27Å; V282-V286 WeakPolarHBondContact O-CB 3.45Å; V282-V286 VanDerWaalsContact O-CG2 3.25Å; V282-V286 WeakPolarHBondContact O-CG2 3.34Å; V282-V286 PolarHBondContact O-N 3.28Å; D284-V286 PolarHBondContact O-N 2.65Å; V286-R288 PolarHBondContact O-N 3.01Å; V286-R288 VanDerWaalsContact O-N 3.12Å; V286-L289 WeakPolarHBondContact O-CB 3.34Å; V286-L289 PolarHBondContact O-N 3.15Å; V286-D290 PolarHBondContact O-N 3.34Å
287S89.1Confident85.3Confident62 Ų6288.9 Ų88.943%0.43444%0.436SS..Hα-helixtrans-62.8-20.917877.10000114R283 D284 V285R283-S287 WeakPolarHBondContact O-CB 3.31Å; R283-S287 PolarHBondContact O-N 2.66Å; D284-S287 PolarHBondContact O-N 3.25Å; D284-S287 PolarHBondContact O-OG 2.72Å; V285-S287 VanDerWaalsContact C-N 3.35Å; V285-S287 PolarHBondContact O-N 3.1Å
288R86.6Confident85.2Confident166 Ų16688.7 Ų88.763%0.62642%0.421SS*.Hα-helixtrans-89.4-20.3176.5-62.3170.8-169.5-159.34.2112.9D284 V285 V286D284-R288 WeakPolarHBondContact O-CG 3.49Å; D284-R288 PolarHBondContact O-N 2.97Å; D284-R288 IonicContact OD1-CZ 3.67Å; D284-R288 IonicContact OD1-NE 3.96Å; D284-R288 PolarHBondContact OD1-NE 2.87Å; D284-R288 VanDerWaalsContact OD1-NE 3.14Å; D284-R288 IonicContact OD1-NH2 2.81Å; D284-R288 PolarHBondContact OD1-NH2 3.31Å; D284-R288 IonicContact OD2-CZ 3.24Å; D284-R288 VanDerWaalsContact OD2-CZ 3.25Å; D284-R288 IonicContact OD2-NE 3.61Å; D284-R288 PolarHBondContact OD2-NE 3.06Å; D284-R288 IonicContact OD2-NH2 3.14Å; D284-R288 PolarHBondContact OD2-NH2 3.1Å; V285-R288 PolarHBondContact O-N 3.12Å; V286-R288 PolarHBondContact O-N 3.01Å; V286-R288 VanDerWaalsContact O-N 3.12Å
289L82.6Confident84.9Confident48 Ų4894 Ų9425%0.25145%0.445SS..Hα-helixtrans-77.6-24.9175.8-89.1148000113A235 L236 F240 V285 V286 R291A235-L289 HydrophobicContact CB-CD2 3.71Å; L236-L289 HydrophobicContact CD2-CD1 3.83Å; L236-L289 HydrophobicContact CD2-CD2 4.35Å; F240-L289 HydrophobicContact CE2-CD1 3.94Å; V285-L289 HydrophobicContact CG1-CD1 4.3Å; V285-L289 PolarHBondContact O-N 3.16Å; V286-L289 WeakPolarHBondContact O-CB 3.34Å; V286-L289 PolarHBondContact O-N 3.15Å; L289-R291 VanDerWaalsContact C-N 3.29Å; L289-R291 PolarHBondContact O-N 3.01Å
290D65Low84.3Confident148 Ų14898.6 Ų98.679%0.79147%0.466SS*.THydrogen-bonded Turntrans-81.64.5-179.9-96.1-13000114.4V286V286-D290 PolarHBondContact O-N 3.34Å
291R52.3Low83.7Confident281 Ų281100.4 Ų100.4100%1.0647%0.47SS*.  trans-112.10177.8-77.4-173.6-179.7-178.91.5111.8L289L289-R291 VanDerWaalsContact C-N 3.29Å; L289-R291 PolarHBondContact O-N 3.01Å

Retrieved 291 of 291 residues in 1803.6 ms (Link to these results)